data_18090 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 18090 _Entry.PDB_ID 2LLV 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 18090 _Entity_delta_chem_shifts.ID 1 loop_ _Delta_CS.Atom_chem_shift_ID _Delta_CS.Entity_delta_chem_shifts_ID _Delta_CS.Conformer_ID _Delta_CS.Assembly_atom_ID _Delta_CS.Entity_assembly_ID _Delta_CS.Entity_ID _Delta_CS.Comp_index_ID _Delta_CS.Seq_ID _Delta_CS.Comp_ID _Delta_CS.Atom_ID _Delta_CS.Atom_type _Delta_CS.Auth_seq_ID _Delta_CS.Original_CS_value _Delta_CS.Corrected_CS_value _Delta_CS.Sparta_CS_value _Delta_CS.Delta_CS_value _Delta_CS.Entry_ID 1 1 1 . 1 1 2 2 PRO HA H 128 4.220 4.220 4.465 -0.245 18090 2 1 1 . 1 1 2 2 PRO CA C 128 63.320 63.320 63.753 -0.433 18090 3 1 1 . 1 1 2 2 PRO CB C 128 31.680 31.680 31.904 -0.224 18090 4 1 1 . 1 1 3 3 ASP N N 129 119.320 119.320 118.955 0.365 18090 5 1 1 . 1 1 3 3 ASP HA H 129 4.400 4.400 4.180 0.220 18090 6 1 1 . 1 1 3 3 ASP C C 129 176.120 176.120 175.107 1.013 18090 7 1 1 . 1 1 3 3 ASP CA C 129 54.050 54.050 55.333 -1.283 18090 8 1 1 . 1 1 3 3 ASP CB C 129 40.770 40.770 40.258 0.512 18090 9 1 1 . 1 1 3 3 ASP H H 129 8.310 8.310 8.393 -0.083 18090 10 1 1 . 1 1 4 4 LEU N N 130 122.280 122.280 119.757 2.523 18090 11 1 1 . 1 1 4 4 LEU HA H 130 4.130 4.130 4.483 -0.353 18090 12 1 1 . 1 1 4 4 LEU C C 130 177.280 177.280 176.538 0.742 18090 13 1 1 . 1 1 4 4 LEU CA C 130 55.350 55.350 53.961 1.389 18090 14 1 1 . 1 1 4 4 LEU CB C 130 41.490 41.490 43.474 -1.984 18090 15 1 1 . 1 1 4 4 LEU H H 130 8.080 8.080 8.119 -0.039 18090 16 1 1 . 1 1 5 5 GLY N N 131 107.830 107.830 108.124 -0.294 18090 17 1 1 . 1 1 5 5 GLY C C 131 175.120 175.120 173.829 1.291 18090 18 1 1 . 1 1 5 5 GLY CA C 131 45.300 45.300 45.868 -0.568 18090 19 1 1 . 1 1 5 5 GLY H H 131 8.180 8.180 8.326 -0.146 18090 20 1 1 . 1 1 6 6 LEU N N 132 121.080 121.080 116.879 4.201 18090 21 1 1 . 1 1 6 6 LEU HA H 132 3.870 3.870 4.465 -0.595 18090 22 1 1 . 1 1 6 6 LEU C C 132 178.000 178.000 177.580 0.420 18090 23 1 1 . 1 1 6 6 LEU CA C 132 57.180 57.180 53.482 3.698 18090 24 1 1 . 1 1 6 6 LEU CB C 132 41.870 41.870 44.103 -2.233 18090 25 1 1 . 1 1 6 6 LEU H H 132 8.150 8.150 7.402 0.748 18090 26 1 1 . 1 1 7 7 THR N N 133 111.580 111.580 113.654 -2.074 18090 27 1 1 . 1 1 7 7 THR HA H 133 3.730 3.730 3.911 -0.181 18090 28 1 1 . 1 1 7 7 THR C C 133 176.530 176.530 176.134 0.396 18090 29 1 1 . 1 1 7 7 THR CA C 133 65.940 65.940 66.015 -0.075 18090 30 1 1 . 1 1 7 7 THR CB C 133 68.130 68.130 68.819 -0.689 18090 31 1 1 . 1 1 7 7 THR H H 133 7.970 7.970 8.652 -0.682 18090 32 1 1 . 1 1 8 8 GLN N N 134 119.490 119.490 121.218 -1.728 18090 33 1 1 . 1 1 8 8 GLN HA H 134 3.990 3.990 3.929 0.061 18090 34 1 1 . 1 1 8 8 GLN C C 134 178.190 178.190 178.327 -0.137 18090 35 1 1 . 1 1 8 8 GLN CA C 134 57.930 57.930 58.587 -0.657 18090 36 1 1 . 1 1 8 8 GLN CB C 134 27.850 27.850 27.928 -0.078 18090 37 1 1 . 1 1 8 8 GLN H H 134 7.890 7.890 8.341 -0.451 18090 38 1 1 . 1 1 9 9 LEU N N 135 120.170 120.170 118.776 1.394 18090 39 1 1 . 1 1 9 9 LEU HA H 135 3.820 3.820 3.943 -0.123 18090 40 1 1 . 1 1 9 9 LEU C C 135 177.810 177.810 178.823 -1.013 18090 41 1 1 . 1 1 9 9 LEU CA C 135 57.470 57.470 57.303 0.167 18090 42 1 1 . 1 1 9 9 LEU CB C 135 41.640 41.640 41.726 -0.086 18090 43 1 1 . 1 1 9 9 LEU H H 135 7.600 7.600 7.261 0.339 18090 44 1 1 . 1 1 10 10 PHE N N 136 111.950 111.950 113.070 -1.120 18090 45 1 1 . 1 1 10 10 PHE HA H 136 4.380 4.380 4.533 -0.153 18090 46 1 1 . 1 1 10 10 PHE C C 136 174.990 174.990 177.249 -2.259 18090 47 1 1 . 1 1 10 10 PHE CA C 136 58.450 58.450 57.558 0.892 18090 48 1 1 . 1 1 10 10 PHE CB C 136 38.570 38.570 37.781 0.789 18090 49 1 1 . 1 1 10 10 PHE H H 136 7.410 7.410 6.592 0.818 18090 50 1 1 . 1 1 11 11 ALA N N 137 120.230 120.230 122.209 -1.979 18090 51 1 1 . 1 1 11 11 ALA HA H 137 4.130 4.130 4.135 -0.005 18090 52 1 1 . 1 1 11 11 ALA C C 137 177.090 177.090 178.153 -1.063 18090 53 1 1 . 1 1 11 11 ALA CA C 137 52.580 52.580 53.448 -0.868 18090 54 1 1 . 1 1 11 11 ALA CB C 137 18.660 18.660 18.979 -0.319 18090 55 1 1 . 1 1 11 11 ALA H H 137 7.330 7.330 8.264 -0.934 18090 56 1 1 . 1 1 12 12 ASP N N 138 119.830 119.830 120.576 -0.746 18090 57 1 1 . 1 1 12 12 ASP HA H 138 4.510 4.510 4.650 -0.140 18090 58 1 1 . 1 1 12 12 ASP C C 138 176.370 176.370 174.677 1.693 18090 59 1 1 . 1 1 12 12 ASP CA C 138 51.960 51.960 53.471 -1.511 18090 60 1 1 . 1 1 12 12 ASP CB C 138 41.990 41.990 40.845 1.145 18090 61 1 1 . 1 1 12 12 ASP H H 138 6.980 6.980 7.604 -0.624 18090 62 1 1 . 1 1 13 13 PRO HA H 139 4.260 4.260 4.383 -0.123 18090 63 1 1 . 1 1 13 13 PRO CA C 139 64.350 64.350 62.949 1.401 18090 64 1 1 . 1 1 13 13 PRO CB C 139 31.760 31.760 32.316 -0.556 18090 65 1 1 . 1 1 14 14 ASN N N 140 116.840 116.840 118.319 -1.479 18090 66 1 1 . 1 1 14 14 ASN HA H 140 4.840 4.840 4.477 0.363 18090 67 1 1 . 1 1 14 14 ASN C C 140 173.840 173.840 175.915 -2.075 18090 68 1 1 . 1 1 14 14 ASN CA C 140 52.380 52.380 54.037 -1.657 18090 69 1 1 . 1 1 14 14 ASN CB C 140 38.330 38.330 36.996 1.334 18090 70 1 1 . 1 1 14 14 ASN H H 140 8.670 8.670 8.660 0.010 18090 71 1 1 . 1 1 15 15 LEU N N 141 120.290 120.290 122.323 -2.033 18090 72 1 1 . 1 1 15 15 LEU HA H 141 3.790 3.790 4.572 -0.782 18090 73 1 1 . 1 1 15 15 LEU C C 141 177.120 177.120 177.660 -0.540 18090 74 1 1 . 1 1 15 15 LEU CA C 141 59.280 59.280 55.820 3.460 18090 75 1 1 . 1 1 15 15 LEU CB C 141 42.980 42.980 42.928 0.052 18090 76 1 1 . 1 1 15 15 LEU H H 141 7.200 7.200 8.486 -1.286 18090 77 1 1 . 1 1 16 16 ILE N N 142 115.290 115.290 120.336 -5.046 18090 78 1 1 . 1 1 16 16 ILE HA H 142 3.480 3.480 3.678 -0.198 18090 79 1 1 . 1 1 16 16 ILE C C 142 177.990 177.990 177.363 0.627 18090 80 1 1 . 1 1 16 16 ILE CA C 142 62.690 62.690 64.981 -2.291 18090 81 1 1 . 1 1 16 16 ILE CB C 142 34.620 34.620 37.585 -2.965 18090 82 1 1 . 1 1 16 16 ILE H H 142 7.940 7.940 8.294 -0.354 18090 83 1 1 . 1 1 17 17 GLU N N 143 119.600 119.600 119.721 -0.121 18090 84 1 1 . 1 1 17 17 GLU HA H 143 3.700 3.700 3.969 -0.269 18090 85 1 1 . 1 1 17 17 GLU C C 143 179.170 179.170 178.796 0.374 18090 86 1 1 . 1 1 17 17 GLU CA C 143 59.360 59.360 60.066 -0.706 18090 87 1 1 . 1 1 17 17 GLU CB C 143 28.520 28.520 29.047 -0.527 18090 88 1 1 . 1 1 17 17 GLU H H 143 7.970 7.970 8.701 -0.731 18090 89 1 1 . 1 1 18 18 ASN N N 144 117.170 117.170 117.720 -0.550 18090 90 1 1 . 1 1 18 18 ASN HA H 144 4.270 4.270 4.468 -0.198 18090 91 1 1 . 1 1 18 18 ASN C C 144 179.120 179.120 177.792 1.328 18090 92 1 1 . 1 1 18 18 ASN CA C 144 55.490 55.490 55.755 -0.265 18090 93 1 1 . 1 1 18 18 ASN CB C 144 36.550 36.550 37.726 -1.176 18090 94 1 1 . 1 1 18 18 ASN H H 144 8.450 8.450 7.896 0.554 18090 95 1 1 . 1 1 19 19 LEU N N 145 121.060 121.060 118.823 2.237 18090 96 1 1 . 1 1 19 19 LEU HA H 145 4.020 4.020 4.008 0.012 18090 97 1 1 . 1 1 19 19 LEU C C 145 180.260 180.260 178.290 1.970 18090 98 1 1 . 1 1 19 19 LEU CA C 145 56.620 56.620 57.176 -0.556 18090 99 1 1 . 1 1 19 19 LEU CB C 145 41.780 41.780 41.471 0.309 18090 100 1 1 . 1 1 19 19 LEU H H 145 7.990 7.990 7.572 0.418 18090 101 1 1 . 1 1 20 20 LYS N N 146 118.960 118.960 117.724 1.236 18090 102 1 1 . 1 1 20 20 LYS HA H 146 3.610 3.610 4.018 -0.408 18090 103 1 1 . 1 1 20 20 LYS C C 146 177.390 177.390 178.330 -0.940 18090 104 1 1 . 1 1 20 20 LYS CA C 146 59.640 59.640 59.060 0.580 18090 105 1 1 . 1 1 20 20 LYS CB C 146 32.450 32.450 32.436 0.014 18090 106 1 1 . 1 1 20 20 LYS H H 146 8.250 8.250 7.710 0.540 18090 107 1 1 . 1 1 21 21 LYS N N 147 114.720 114.720 116.573 -1.853 18090 108 1 1 . 1 1 21 21 LYS HA H 147 4.110 4.110 4.250 -0.140 18090 109 1 1 . 1 1 21 21 LYS C C 147 175.880 175.880 178.209 -2.329 18090 110 1 1 . 1 1 21 21 LYS CA C 147 56.210 56.210 58.233 -2.023 18090 111 1 1 . 1 1 21 21 LYS CB C 147 33.000 33.000 32.873 0.127 18090 112 1 1 . 1 1 21 21 LYS H H 147 7.130 7.130 7.612 -0.482 18090 113 1 1 . 1 1 22 22 ASN N N 148 122.180 122.180 115.758 6.422 18090 114 1 1 . 1 1 22 22 ASN HA H 148 4.740 4.740 4.888 -0.148 18090 115 1 1 . 1 1 22 22 ASN C C 148 174.000 174.000 173.631 0.369 18090 116 1 1 . 1 1 22 22 ASN CA C 148 50.970 50.970 52.907 -1.937 18090 117 1 1 . 1 1 22 22 ASN CB C 148 38.670 38.670 38.754 -0.084 18090 118 1 1 . 1 1 22 22 ASN H H 148 6.930 6.930 7.873 -0.943 18090 119 1 1 . 1 1 23 23 PRO HA H 149 4.300 4.300 4.683 -0.383 18090 120 1 1 . 1 1 23 23 PRO CA C 149 64.610 64.610 61.959 2.651 18090 121 1 1 . 1 1 23 23 PRO CB C 149 32.000 32.000 33.947 -1.947 18090 122 1 1 . 1 1 24 24 LYS N N 150 116.060 116.060 121.288 -5.228 18090 123 1 1 . 1 1 24 24 LYS HA H 150 4.070 4.070 3.994 0.076 18090 124 1 1 . 1 1 24 24 LYS C C 150 178.240 178.240 178.630 -0.390 18090 125 1 1 . 1 1 24 24 LYS CA C 150 57.950 57.950 59.711 -1.761 18090 126 1 1 . 1 1 24 24 LYS CB C 150 32.590 32.590 31.989 0.601 18090 127 1 1 . 1 1 24 24 LYS H H 150 8.520 8.520 8.803 -0.283 18090 128 1 1 . 1 1 25 25 THR N N 151 105.190 105.190 110.820 -5.630 18090 129 1 1 . 1 1 25 25 THR HA H 151 4.390 4.390 4.055 0.335 18090 130 1 1 . 1 1 25 25 THR C C 151 176.090 176.090 176.248 -0.158 18090 131 1 1 . 1 1 25 25 THR CA C 151 61.400 61.400 64.996 -3.596 18090 132 1 1 . 1 1 25 25 THR CB C 151 69.440 69.440 68.260 1.179 18090 133 1 1 . 1 1 25 25 THR H H 151 7.490 7.490 8.135 -0.645 18090 134 1 1 . 1 1 26 26 SER N N 152 119.700 119.700 116.522 3.178 18090 135 1 1 . 1 1 26 26 SER HA H 152 3.770 3.770 4.149 -0.379 18090 136 1 1 . 1 1 26 26 SER C C 152 177.470 177.470 176.000 1.470 18090 137 1 1 . 1 1 26 26 SER CA C 152 62.450 62.450 61.389 1.061 18090 138 1 1 . 1 1 26 26 SER CB C 152 62.520 62.520 62.777 -0.257 18090 139 1 1 . 1 1 26 26 SER H H 152 8.190 8.190 7.861 0.329 18090 140 1 1 . 1 1 27 27 GLU N N 153 119.870 119.870 122.417 -2.547 18090 141 1 1 . 1 1 27 27 GLU HA H 153 3.890 3.890 3.983 -0.093 18090 142 1 1 . 1 1 27 27 GLU C C 153 180.040 180.040 178.727 1.313 18090 143 1 1 . 1 1 27 27 GLU CA C 153 58.700 58.700 59.161 -0.461 18090 144 1 1 . 1 1 27 27 GLU CB C 153 28.590 28.590 29.394 -0.804 18090 145 1 1 . 1 1 27 27 GLU H H 153 8.350 8.350 7.937 0.413 18090 146 1 1 . 1 1 28 28 MET N N 154 119.430 119.430 117.368 2.062 18090 147 1 1 . 1 1 28 28 MET HA H 154 4.040 4.040 4.170 -0.130 18090 148 1 1 . 1 1 28 28 MET C C 154 177.110 177.110 177.899 -0.789 18090 149 1 1 . 1 1 28 28 MET CA C 154 58.510 58.510 58.782 -0.272 18090 150 1 1 . 1 1 28 28 MET CB C 154 31.430 31.430 32.739 -1.309 18090 151 1 1 . 1 1 28 28 MET H H 154 7.850 7.850 7.537 0.313 18090 152 1 1 . 1 1 29 29 MET N N 155 112.640 112.640 114.576 -1.936 18090 153 1 1 . 1 1 29 29 MET HA H 155 4.340 4.340 4.252 0.088 18090 154 1 1 . 1 1 29 29 MET C C 155 175.530 175.530 178.073 -2.543 18090 155 1 1 . 1 1 29 29 MET CA C 155 53.790 53.790 57.132 -3.342 18090 156 1 1 . 1 1 29 29 MET CB C 155 30.380 30.380 32.008 -1.627 18090 157 1 1 . 1 1 29 29 MET H H 155 7.200 7.200 7.354 -0.154 18090 158 1 1 . 1 1 30 30 LYS N N 156 117.050 117.050 116.461 0.589 18090 159 1 1 . 1 1 30 30 LYS HA H 156 3.960 3.960 4.249 -0.289 18090 160 1 1 . 1 1 30 30 LYS C C 156 176.120 176.120 177.309 -1.189 18090 161 1 1 . 1 1 30 30 LYS CA C 156 57.090 57.090 57.570 -0.480 18090 162 1 1 . 1 1 30 30 LYS CB C 156 31.960 31.960 32.828 -0.868 18090 163 1 1 . 1 1 30 30 LYS H H 156 7.130 7.130 7.545 -0.415 18090 164 1 1 . 1 1 31 31 ASP N N 157 119.810 119.810 118.447 1.363 18090 165 1 1 . 1 1 31 31 ASP HA H 157 4.860 4.860 4.957 -0.097 18090 166 1 1 . 1 1 31 31 ASP C C 157 174.890 174.890 174.487 0.403 18090 167 1 1 . 1 1 31 31 ASP CA C 157 50.520 50.520 54.392 -3.872 18090 168 1 1 . 1 1 31 31 ASP CB C 157 41.010 41.010 40.979 0.031 18090 169 1 1 . 1 1 31 31 ASP H H 157 7.340 7.340 7.752 -0.412 18090 170 1 1 . 1 1 32 32 PRO HA H 158 4.130 4.130 4.484 -0.354 18090 171 1 1 . 1 1 32 32 PRO CA C 158 64.270 64.270 63.107 1.163 18090 172 1 1 . 1 1 32 32 PRO CB C 158 31.770 31.770 32.311 -0.541 18090 173 1 1 . 1 1 33 33 GLN N N 159 117.760 117.760 122.641 -4.881 18090 174 1 1 . 1 1 33 33 GLN HA H 159 4.000 4.000 4.066 -0.066 18090 175 1 1 . 1 1 33 33 GLN C C 159 178.740 178.740 177.788 0.952 18090 176 1 1 . 1 1 33 33 GLN CA C 159 58.220 58.220 57.879 0.341 18090 177 1 1 . 1 1 33 33 GLN CB C 159 27.870 27.870 28.208 -0.338 18090 178 1 1 . 1 1 33 33 GLN H H 159 8.150 8.150 8.829 -0.679 18090 179 1 1 . 1 1 34 34 LEU N N 160 123.300 123.300 120.022 3.278 18090 180 1 1 . 1 1 34 34 LEU HA H 160 3.970 3.970 4.041 -0.071 18090 181 1 1 . 1 1 34 34 LEU C C 160 177.980 177.980 178.040 -0.060 18090 182 1 1 . 1 1 34 34 LEU CA C 160 57.050 57.050 57.043 0.007 18090 183 1 1 . 1 1 34 34 LEU CB C 160 40.760 40.760 41.629 -0.869 18090 184 1 1 . 1 1 34 34 LEU H H 160 7.110 7.110 7.897 -0.787 18090 185 1 1 . 1 1 35 35 VAL N N 161 118.390 118.390 119.381 -0.991 18090 186 1 1 . 1 1 35 35 VAL HA H 161 3.110 3.110 3.461 -0.351 18090 187 1 1 . 1 1 35 35 VAL C C 161 176.840 176.840 177.610 -0.770 18090 188 1 1 . 1 1 35 35 VAL CA C 161 67.700 67.700 67.015 0.685 18090 189 1 1 . 1 1 35 35 VAL CB C 161 31.260 31.260 31.357 -0.097 18090 190 1 1 . 1 1 35 35 VAL H H 161 7.430 7.430 7.415 0.015 18090 191 1 1 . 1 1 36 36 ALA N N 162 117.600 117.600 121.489 -3.889 18090 192 1 1 . 1 1 36 36 ALA HA H 162 3.810 3.810 3.948 -0.138 18090 193 1 1 . 1 1 36 36 ALA C C 162 180.620 180.620 179.548 1.072 18090 194 1 1 . 1 1 36 36 ALA CA C 162 54.720 54.720 55.351 -0.631 18090 195 1 1 . 1 1 36 36 ALA CB C 162 17.490 17.490 18.111 -0.621 18090 196 1 1 . 1 1 36 36 ALA H H 162 7.500 7.500 7.689 -0.189 18090 197 1 1 . 1 1 37 37 LYS N N 163 119.880 119.880 118.484 1.396 18090 198 1 1 . 1 1 37 37 LYS HA H 163 3.570 3.570 3.979 -0.409 18090 199 1 1 . 1 1 37 37 LYS C C 163 177.800 177.800 179.214 -1.414 18090 200 1 1 . 1 1 37 37 LYS CA C 163 58.880 58.880 58.800 0.080 18090 201 1 1 . 1 1 37 37 LYS CB C 163 31.610 31.610 31.959 -0.349 18090 202 1 1 . 1 1 37 37 LYS H H 163 7.350 7.350 7.408 -0.058 18090 203 1 1 . 1 1 38 38 LEU N N 164 118.020 118.020 119.963 -1.943 18090 204 1 1 . 1 1 38 38 LEU HA H 164 3.670 3.670 3.984 -0.314 18090 205 1 1 . 1 1 38 38 LEU C C 164 179.380 179.380 178.935 0.445 18090 206 1 1 . 1 1 38 38 LEU CA C 164 57.340 57.340 57.631 -0.291 18090 207 1 1 . 1 1 38 38 LEU CB C 164 41.660 41.660 41.739 -0.079 18090 208 1 1 . 1 1 38 38 LEU H H 164 7.660 7.660 8.204 -0.544 18090 209 1 1 . 1 1 39 39 ILE N N 165 118.070 118.070 119.345 -1.275 18090 210 1 1 . 1 1 39 39 ILE HA H 165 3.510 3.510 3.568 -0.058 18090 211 1 1 . 1 1 39 39 ILE C C 165 179.570 179.570 178.302 1.268 18090 212 1 1 . 1 1 39 39 ILE CA C 165 64.450 64.450 65.620 -1.169 18090 213 1 1 . 1 1 39 39 ILE CB C 165 37.310 37.310 37.512 -0.202 18090 214 1 1 . 1 1 39 39 ILE H H 165 8.030 8.030 7.984 0.046 18090 215 1 1 . 1 1 40 40 GLY N N 166 107.970 107.970 107.088 0.882 18090 216 1 1 . 1 1 40 40 GLY C C 166 176.470 176.470 175.572 0.898 18090 217 1 1 . 1 1 40 40 GLY CA C 166 46.410 46.410 46.954 -0.544 18090 218 1 1 . 1 1 40 40 GLY H H 166 7.590 7.590 7.674 -0.084 18090 219 1 1 . 1 1 41 41 TYR N N 167 121.270 121.270 122.390 -1.120 18090 220 1 1 . 1 1 41 41 TYR HA H 167 4.190 4.190 4.199 -0.009 18090 221 1 1 . 1 1 41 41 TYR C C 167 176.470 176.470 176.169 0.301 18090 222 1 1 . 1 1 41 41 TYR CA C 167 57.130 57.130 60.649 -3.519 18090 223 1 1 . 1 1 41 41 TYR CB C 167 35.950 35.950 38.397 -2.447 18090 224 1 1 . 1 1 41 41 TYR H H 167 7.350 7.350 7.593 -0.243 18090 225 1 1 . 1 1 42 42 LYS N N 168 116.520 116.520 115.433 1.087 18090 226 1 1 . 1 1 42 42 LYS HA H 168 3.820 3.820 4.094 -0.274 18090 227 1 1 . 1 1 42 42 LYS C C 168 177.810 177.810 177.568 0.242 18090 228 1 1 . 1 1 42 42 LYS CA C 168 59.390 59.390 58.169 1.220 18090 229 1 1 . 1 1 42 42 LYS CB C 168 31.580 31.580 32.436 -0.856 18090 230 1 1 . 1 1 42 42 LYS H H 168 7.460 7.460 7.987 -0.527 18090 231 1 1 . 1 1 43 43 GLN N N 169 113.750 113.750 116.202 -2.452 18090 232 1 1 . 1 1 43 43 GLN HA H 169 4.220 4.220 4.163 0.057 18090 233 1 1 . 1 1 43 43 GLN C C 169 175.840 175.840 177.512 -1.672 18090 234 1 1 . 1 1 43 43 GLN CA C 169 56.230 56.230 58.130 -1.900 18090 235 1 1 . 1 1 43 43 GLN CB C 169 29.290 29.290 29.331 -0.041 18090 236 1 1 . 1 1 43 43 GLN H H 169 7.220 7.220 7.664 -0.444 18090 237 1 1 . 1 1 44 44 ASN N N 170 114.130 114.130 115.930 -1.800 18090 238 1 1 . 1 1 44 44 ASN HA H 170 5.050 5.050 5.017 0.033 18090 239 1 1 . 1 1 44 44 ASN C C 170 172.200 172.200 173.483 -1.283 18090 240 1 1 . 1 1 44 44 ASN CA C 170 50.780 50.780 53.004 -2.224 18090 241 1 1 . 1 1 44 44 ASN CB C 170 38.380 38.380 39.882 -1.502 18090 242 1 1 . 1 1 44 44 ASN H H 170 7.580 7.580 7.673 -0.093 18090 243 1 1 . 1 1 45 45 PRO HA H 171 4.130 4.130 4.706 -0.576 18090 244 1 1 . 1 1 45 45 PRO CA C 171 64.800 64.800 62.141 2.659 18090 245 1 1 . 1 1 45 45 PRO CB C 171 31.360 31.360 31.837 -0.477 18090 246 1 1 . 1 1 46 46 GLN N N 172 115.570 115.570 123.321 -7.751 18090 247 1 1 . 1 1 46 46 GLN HA H 172 3.770 3.770 3.805 -0.035 18090 248 1 1 . 1 1 46 46 GLN C C 172 177.360 177.360 177.549 -0.189 18090 249 1 1 . 1 1 46 46 GLN CA C 172 57.950 57.950 57.708 0.242 18090 250 1 1 . 1 1 46 46 GLN CB C 172 27.050 27.050 27.833 -0.783 18090 251 1 1 . 1 1 46 46 GLN H H 172 8.160 8.160 8.615 -0.455 18090 252 1 1 . 1 1 47 47 ALA N N 173 121.420 121.420 121.749 -0.329 18090 253 1 1 . 1 1 47 47 ALA HA H 173 4.050 4.050 4.175 -0.125 18090 254 1 1 . 1 1 47 47 ALA C C 173 178.090 178.090 179.543 -1.453 18090 255 1 1 . 1 1 47 47 ALA CA C 173 53.490 53.490 54.290 -0.800 18090 256 1 1 . 1 1 47 47 ALA CB C 173 18.450 18.450 17.577 0.873 18090 257 1 1 . 1 1 47 47 ALA H H 173 7.470 7.470 8.338 -0.868 18090 258 1 1 . 1 1 48 48 ILE N N 174 118.050 118.050 118.521 -0.471 18090 259 1 1 . 1 1 48 48 ILE HA H 174 3.180 3.180 3.987 -0.807 18090 260 1 1 . 1 1 48 48 ILE C C 174 176.250 176.250 177.919 -1.669 18090 261 1 1 . 1 1 48 48 ILE CA C 174 64.030 64.030 64.055 -0.025 18090 262 1 1 . 1 1 48 48 ILE CB C 174 37.280 37.280 37.136 0.144 18090 263 1 1 . 1 1 48 48 ILE H H 174 7.150 7.150 7.332 -0.182 18090 264 1 1 . 1 1 49 49 GLY N N 175 105.390 105.390 106.704 -1.314 18090 265 1 1 . 1 1 49 49 GLY C C 175 174.220 174.220 175.769 -1.549 18090 266 1 1 . 1 1 49 49 GLY CA C 175 46.700 46.700 47.099 -0.399 18090 267 1 1 . 1 1 49 49 GLY H H 175 7.550 7.550 7.850 -0.300 18090 268 1 1 . 1 1 50 50 GLN N N 176 116.230 116.230 118.168 -1.938 18090 269 1 1 . 1 1 50 50 GLN HA H 176 4.210 4.210 4.736 -0.526 18090 270 1 1 . 1 1 50 50 GLN C C 176 178.120 178.120 177.547 0.573 18090 271 1 1 . 1 1 50 50 GLN CA C 176 57.320 57.320 57.544 -0.224 18090 272 1 1 . 1 1 50 50 GLN CB C 176 28.630 28.630 29.197 -0.567 18090 273 1 1 . 1 1 50 50 GLN H H 176 7.390 7.390 7.740 -0.350 18090 274 1 1 . 1 1 51 51 ASP N N 177 120.000 120.000 120.834 -0.834 18090 275 1 1 . 1 1 51 51 ASP HA H 177 4.420 4.420 4.748 -0.328 18090 276 1 1 . 1 1 51 51 ASP C C 177 177.950 177.950 178.040 -0.090 18090 277 1 1 . 1 1 51 51 ASP CA C 177 55.840 55.840 55.781 0.060 18090 278 1 1 . 1 1 51 51 ASP CB C 177 40.310 40.310 41.331 -1.021 18090 279 1 1 . 1 1 51 51 ASP H H 177 7.870 7.870 7.853 0.017 18090 280 1 1 . 1 1 52 52 LEU N N 178 120.010 120.010 120.112 -0.102 18090 281 1 1 . 1 1 52 52 LEU HA H 178 3.650 3.650 3.949 -0.299 18090 282 1 1 . 1 1 52 52 LEU C C 178 175.810 175.810 178.147 -2.337 18090 283 1 1 . 1 1 52 52 LEU CA C 178 57.620 57.620 57.709 -0.089 18090 284 1 1 . 1 1 52 52 LEU CB C 178 41.880 41.880 41.572 0.308 18090 285 1 1 . 1 1 52 52 LEU H H 178 7.860 7.860 7.722 0.138 18090 286 1 1 . 1 1 53 53 PHE N N 179 110.580 110.580 113.501 -2.921 18090 287 1 1 . 1 1 53 53 PHE HA H 179 4.230 4.230 4.332 -0.102 18090 288 1 1 . 1 1 53 53 PHE C C 179 176.370 176.370 177.936 -1.566 18090 289 1 1 . 1 1 53 53 PHE CA C 179 58.730 58.730 60.480 -1.750 18090 290 1 1 . 1 1 53 53 PHE CB C 179 38.720 38.720 38.902 -0.182 18090 291 1 1 . 1 1 53 53 PHE H H 179 7.210 7.210 8.177 -0.967 18090 292 1 1 . 1 1 54 54 THR N N 180 108.190 108.190 110.343 -2.153 18090 293 1 1 . 1 1 54 54 THR HA H 180 4.300 4.300 4.275 0.025 18090 294 1 1 . 1 1 54 54 THR C C 180 174.400 174.400 175.462 -1.062 18090 295 1 1 . 1 1 54 54 THR CA C 180 62.020 62.020 62.455 -0.434 18090 296 1 1 . 1 1 54 54 THR CB C 180 69.730 69.730 69.959 -0.229 18090 297 1 1 . 1 1 54 54 THR H H 180 7.550 7.550 7.846 -0.296 18090 298 1 1 . 1 1 55 55 ASP N N 181 120.060 120.060 123.196 -3.136 18090 299 1 1 . 1 1 55 55 ASP HA H 181 5.020 5.020 5.137 -0.117 18090 300 1 1 . 1 1 55 55 ASP C C 181 174.120 174.120 174.810 -0.690 18090 301 1 1 . 1 1 55 55 ASP CA C 181 50.560 50.560 51.013 -0.452 18090 302 1 1 . 1 1 55 55 ASP CB C 181 41.190 41.190 42.725 -1.535 18090 303 1 1 . 1 1 55 55 ASP H H 181 7.480 7.480 8.093 -0.613 18090 304 1 1 . 1 1 56 56 PRO HA H 182 4.320 4.320 4.343 -0.023 18090 305 1 1 . 1 1 56 56 PRO CA C 182 64.280 64.280 64.605 -0.325 18090 306 1 1 . 1 1 56 56 PRO CB C 182 31.980 31.980 32.527 -0.547 18090 307 1 1 . 1 1 57 57 ARG N N 183 117.660 117.660 117.806 -0.146 18090 308 1 1 . 1 1 57 57 ARG HA H 183 3.960 3.960 4.056 -0.096 18090 309 1 1 . 1 1 57 57 ARG C C 183 179.030 179.030 178.535 0.495 18090 310 1 1 . 1 1 57 57 ARG CA C 183 59.000 59.000 58.909 0.091 18090 311 1 1 . 1 1 57 57 ARG CB C 183 29.750 29.750 29.461 0.289 18090 312 1 1 . 1 1 57 57 ARG H H 183 7.920 7.920 7.873 0.047 18090 313 1 1 . 1 1 58 58 LEU N N 184 115.670 115.670 119.351 -3.681 18090 314 1 1 . 1 1 58 58 LEU HA H 184 3.850 3.850 3.966 -0.116 18090 315 1 1 . 1 1 58 58 LEU C C 184 178.770 178.770 179.063 -0.293 18090 316 1 1 . 1 1 58 58 LEU CA C 184 57.110 57.110 57.758 -0.648 18090 317 1 1 . 1 1 58 58 LEU CB C 184 41.310 41.310 41.598 -0.288 18090 318 1 1 . 1 1 58 58 LEU H H 184 7.750 7.750 8.184 -0.434 18090 319 1 1 . 1 1 59 59 MET N N 185 118.570 118.570 116.166 2.404 18090 320 1 1 . 1 1 59 59 MET HA H 185 4.060 4.060 4.111 -0.051 18090 321 1 1 . 1 1 59 59 MET C C 185 177.540 177.540 178.265 -0.725 18090 322 1 1 . 1 1 59 59 MET CA C 185 58.090 58.090 59.267 -1.177 18090 323 1 1 . 1 1 59 59 MET CB C 185 31.270 31.270 32.096 -0.827 18090 324 1 1 . 1 1 59 59 MET H H 185 7.590 7.590 7.674 -0.084 18090 325 1 1 . 1 1 60 60 THR N N 186 116.390 116.390 117.364 -0.974 18090 326 1 1 . 1 1 60 60 THR HA H 186 3.680 3.680 3.992 -0.312 18090 327 1 1 . 1 1 60 60 THR C C 186 177.440 177.440 176.693 0.747 18090 328 1 1 . 1 1 60 60 THR CA C 186 66.940 66.940 66.574 0.366 18090 329 1 1 . 1 1 60 60 THR CB C 186 68.030 68.030 68.254 -0.225 18090 330 1 1 . 1 1 60 60 THR H H 186 7.180 7.180 7.765 -0.585 18090 331 1 1 . 1 1 61 61 ILE N N 187 123.840 123.840 122.442 1.398 18090 332 1 1 . 1 1 61 61 ILE HA H 187 3.290 3.290 3.724 -0.434 18090 333 1 1 . 1 1 61 61 ILE C C 187 176.660 176.660 178.402 -1.742 18090 334 1 1 . 1 1 61 61 ILE CA C 187 65.850 65.850 65.329 0.521 18090 335 1 1 . 1 1 61 61 ILE CB C 187 37.640 37.640 37.725 -0.085 18090 336 1 1 . 1 1 61 61 ILE H H 187 8.010 8.010 7.812 0.198 18090 337 1 1 . 1 1 62 62 MET N N 188 118.210 118.210 118.276 -0.066 18090 338 1 1 . 1 1 62 62 MET HA H 188 3.910 3.910 3.989 -0.079 18090 339 1 1 . 1 1 62 62 MET C C 188 177.540 177.540 178.472 -0.932 18090 340 1 1 . 1 1 62 62 MET CA C 188 58.530 58.530 58.867 -0.337 18090 341 1 1 . 1 1 62 62 MET CB C 188 31.200 31.200 31.654 -0.454 18090 342 1 1 . 1 1 62 62 MET H H 188 8.560 8.560 7.609 0.951 18090 343 1 1 . 1 1 63 63 ALA N N 189 119.850 119.850 122.087 -2.237 18090 344 1 1 . 1 1 63 63 ALA HA H 189 3.730 3.730 3.895 -0.165 18090 345 1 1 . 1 1 63 63 ALA C C 189 179.550 179.550 179.511 0.039 18090 346 1 1 . 1 1 63 63 ALA CA C 189 55.470 55.470 55.729 -0.259 18090 347 1 1 . 1 1 63 63 ALA CB C 189 17.640 17.640 18.136 -0.496 18090 348 1 1 . 1 1 63 63 ALA H H 189 8.210 8.210 8.139 0.071 18090 349 1 1 . 1 1 64 64 THR N N 190 114.570 114.570 113.897 0.673 18090 350 1 1 . 1 1 64 64 THR HA H 190 3.790 3.790 3.944 -0.154 18090 351 1 1 . 1 1 64 64 THR C C 190 177.640 177.640 176.809 0.831 18090 352 1 1 . 1 1 64 64 THR CA C 190 66.690 66.690 65.844 0.846 18090 353 1 1 . 1 1 64 64 THR CB C 190 68.310 68.310 68.220 0.090 18090 354 1 1 . 1 1 64 64 THR H H 190 7.740 7.740 7.640 0.100 18090 355 1 1 . 1 1 65 65 LEU N N 191 122.410 122.410 122.755 -0.345 18090 356 1 1 . 1 1 65 65 LEU HA H 191 3.930 3.930 3.955 -0.025 18090 357 1 1 . 1 1 65 65 LEU C C 191 178.470 178.470 179.761 -1.291 18090 358 1 1 . 1 1 65 65 LEU CA C 191 57.120 57.120 58.223 -1.103 18090 359 1 1 . 1 1 65 65 LEU CB C 191 41.830 41.830 41.641 0.189 18090 360 1 1 . 1 1 65 65 LEU H H 191 8.180 8.180 7.681 0.499 18090 361 1 1 . 1 1 66 66 MET N N 192 115.320 115.320 117.049 -1.729 18090 362 1 1 . 1 1 66 66 MET HA H 192 4.090 4.090 4.331 -0.241 18090 363 1 1 . 1 1 66 66 MET C C 192 176.090 176.090 178.121 -2.031 18090 364 1 1 . 1 1 66 66 MET CA C 192 56.390 56.390 56.822 -0.432 18090 365 1 1 . 1 1 66 66 MET CB C 192 33.770 33.770 31.589 2.181 18090 366 1 1 . 1 1 66 66 MET H H 192 7.880 7.880 8.717 -0.837 18090 367 1 1 . 1 1 67 67 GLY N N 193 107.490 107.490 105.422 2.068 18090 368 1 1 . 1 1 67 67 GLY C C 193 174.390 174.390 174.591 -0.201 18090 369 1 1 . 1 1 67 67 GLY CA C 193 45.880 45.880 44.553 1.327 18090 370 1 1 . 1 1 67 67 GLY H H 193 7.580 7.580 8.299 -0.719 18090 371 1 1 . 1 1 68 68 VAL N N 194 118.520 118.520 117.152 1.368 18090 372 1 1 . 1 1 68 68 VAL HA H 194 3.940 3.940 3.595 0.345 18090 373 1 1 . 1 1 68 68 VAL C C 194 174.760 174.760 174.817 -0.057 18090 374 1 1 . 1 1 68 68 VAL CA C 194 61.510 61.510 63.668 -2.158 18090 375 1 1 . 1 1 68 68 VAL CB C 194 32.670 32.670 29.924 2.746 18090 376 1 1 . 1 1 68 68 VAL H H 194 7.840 7.840 7.524 0.316 18090 377 1 1 . 1 1 69 69 ASP N N 195 124.550 124.550 116.465 8.085 18090 378 1 1 . 1 1 69 69 ASP HA H 195 4.430 4.430 4.343 0.087 18090 379 1 1 . 1 1 69 69 ASP C C 195 175.140 175.140 176.219 -1.079 18090 380 1 1 . 1 1 69 69 ASP CA C 195 53.760 53.760 56.014 -2.254 18090 381 1 1 . 1 1 69 69 ASP CB C 195 40.920 40.920 39.754 1.166 18090 382 1 1 . 1 1 69 69 ASP H H 195 8.400 8.400 8.199 0.201 18090 383 1 1 . 1 1 70 70 LEU N N 196 123.930 123.930 118.140 5.790 18090 384 1 1 . 1 1 70 70 LEU HA H 196 4.200 4.200 4.169 0.031 18090 385 1 1 . 1 1 70 70 LEU C C 196 175.950 175.950 178.084 -2.134 18090 386 1 1 . 1 1 70 70 LEU CA C 196 54.380 54.380 56.727 -2.346 18090 387 1 1 . 1 1 70 70 LEU CB C 196 41.610 41.610 42.283 -0.673 18090 388 1 1 . 1 1 70 70 LEU H H 196 8.160 8.160 7.586 0.574 18090 389 1 2 . 1 1 2 2 PRO HA H 128 4.220 4.220 4.624 -0.404 18090 390 1 2 . 1 1 2 2 PRO CA C 128 63.320 63.320 62.808 0.512 18090 391 1 2 . 1 1 2 2 PRO CB C 128 31.680 31.680 32.204 -0.524 18090 392 1 2 . 1 1 3 3 ASP N N 129 119.320 119.320 120.349 -1.029 18090 393 1 2 . 1 1 3 3 ASP HA H 129 4.400 4.400 4.590 -0.190 18090 394 1 2 . 1 1 3 3 ASP C C 129 176.120 176.120 175.650 0.470 18090 395 1 2 . 1 1 3 3 ASP CA C 129 54.050 54.050 54.379 -0.329 18090 396 1 2 . 1 1 3 3 ASP CB C 129 40.770 40.770 41.347 -0.577 18090 397 1 2 . 1 1 3 3 ASP H H 129 8.310 8.310 8.425 -0.115 18090 398 1 2 . 1 1 4 4 LEU N N 130 122.280 122.280 118.988 3.292 18090 399 1 2 . 1 1 4 4 LEU HA H 130 4.130 4.130 4.486 -0.356 18090 400 1 2 . 1 1 4 4 LEU C C 130 177.280 177.280 176.281 0.999 18090 401 1 2 . 1 1 4 4 LEU CA C 130 55.350 55.350 53.997 1.353 18090 402 1 2 . 1 1 4 4 LEU CB C 130 41.490 41.490 45.611 -4.121 18090 403 1 2 . 1 1 4 4 LEU H H 130 8.080 8.080 8.097 -0.017 18090 404 1 2 . 1 1 5 5 GLY N N 131 107.830 107.830 107.765 0.065 18090 405 1 2 . 1 1 5 5 GLY C C 131 175.120 175.120 173.183 1.937 18090 406 1 2 . 1 1 5 5 GLY CA C 131 45.300 45.300 45.516 -0.216 18090 407 1 2 . 1 1 5 5 GLY H H 131 8.180 8.180 8.330 -0.150 18090 408 1 2 . 1 1 6 6 LEU N N 132 121.080 121.080 116.211 4.869 18090 409 1 2 . 1 1 6 6 LEU HA H 132 3.870 3.870 4.494 -0.624 18090 410 1 2 . 1 1 6 6 LEU C C 132 178.000 178.000 177.728 0.272 18090 411 1 2 . 1 1 6 6 LEU CA C 132 57.180 57.180 53.668 3.512 18090 412 1 2 . 1 1 6 6 LEU CB C 132 41.870 41.870 44.341 -2.471 18090 413 1 2 . 1 1 6 6 LEU H H 132 8.150 8.150 7.442 0.708 18090 414 1 2 . 1 1 7 7 THR N N 133 111.580 111.580 113.534 -1.954 18090 415 1 2 . 1 1 7 7 THR HA H 133 3.730 3.730 3.994 -0.264 18090 416 1 2 . 1 1 7 7 THR C C 133 176.530 176.530 176.108 0.422 18090 417 1 2 . 1 1 7 7 THR CA C 133 65.940 65.940 66.254 -0.314 18090 418 1 2 . 1 1 7 7 THR CB C 133 68.130 68.130 68.841 -0.711 18090 419 1 2 . 1 1 7 7 THR H H 133 7.970 7.970 8.703 -0.733 18090 420 1 2 . 1 1 8 8 GLN N N 134 119.490 119.490 120.997 -1.507 18090 421 1 2 . 1 1 8 8 GLN HA H 134 3.990 3.990 3.891 0.099 18090 422 1 2 . 1 1 8 8 GLN C C 134 178.190 178.190 178.100 0.090 18090 423 1 2 . 1 1 8 8 GLN CA C 134 57.930 57.930 58.669 -0.739 18090 424 1 2 . 1 1 8 8 GLN CB C 134 27.850 27.850 28.089 -0.239 18090 425 1 2 . 1 1 8 8 GLN H H 134 7.890 7.890 8.353 -0.463 18090 426 1 2 . 1 1 9 9 LEU N N 135 120.170 120.170 119.329 0.841 18090 427 1 2 . 1 1 9 9 LEU HA H 135 3.820 3.820 3.914 -0.094 18090 428 1 2 . 1 1 9 9 LEU C C 135 177.810 177.810 178.846 -1.036 18090 429 1 2 . 1 1 9 9 LEU CA C 135 57.470 57.470 57.385 0.085 18090 430 1 2 . 1 1 9 9 LEU CB C 135 41.640 41.640 41.659 -0.019 18090 431 1 2 . 1 1 9 9 LEU H H 135 7.600 7.600 7.308 0.292 18090 432 1 2 . 1 1 10 10 PHE N N 136 111.950 111.950 113.798 -1.848 18090 433 1 2 . 1 1 10 10 PHE HA H 136 4.380 4.380 4.472 -0.092 18090 434 1 2 . 1 1 10 10 PHE C C 136 174.990 174.990 177.455 -2.465 18090 435 1 2 . 1 1 10 10 PHE CA C 136 58.450 58.450 57.708 0.742 18090 436 1 2 . 1 1 10 10 PHE CB C 136 38.570 38.570 37.285 1.285 18090 437 1 2 . 1 1 10 10 PHE H H 136 7.410 7.410 6.723 0.687 18090 438 1 2 . 1 1 11 11 ALA N N 137 120.230 120.230 122.239 -2.009 18090 439 1 2 . 1 1 11 11 ALA HA H 137 4.130 4.130 4.066 0.064 18090 440 1 2 . 1 1 11 11 ALA C C 137 177.090 177.090 178.272 -1.182 18090 441 1 2 . 1 1 11 11 ALA CA C 137 52.580 52.580 53.576 -0.996 18090 442 1 2 . 1 1 11 11 ALA CB C 137 18.660 18.660 18.756 -0.096 18090 443 1 2 . 1 1 11 11 ALA H H 137 7.330 7.330 8.488 -1.158 18090 444 1 2 . 1 1 12 12 ASP N N 138 119.830 119.830 120.545 -0.715 18090 445 1 2 . 1 1 12 12 ASP HA H 138 4.510 4.510 4.719 -0.209 18090 446 1 2 . 1 1 12 12 ASP C C 138 176.370 176.370 174.865 1.505 18090 447 1 2 . 1 1 12 12 ASP CA C 138 51.960 51.960 52.779 -0.819 18090 448 1 2 . 1 1 12 12 ASP CB C 138 41.990 41.990 41.573 0.417 18090 449 1 2 . 1 1 12 12 ASP H H 138 6.980 6.980 7.652 -0.672 18090 450 1 2 . 1 1 13 13 PRO HA H 139 4.260 4.260 4.370 -0.111 18090 451 1 2 . 1 1 13 13 PRO CA C 139 64.350 64.350 62.876 1.474 18090 452 1 2 . 1 1 13 13 PRO CB C 139 31.760 31.760 32.378 -0.618 18090 453 1 2 . 1 1 14 14 ASN N N 140 116.840 116.840 117.410 -0.570 18090 454 1 2 . 1 1 14 14 ASN HA H 140 4.840 4.840 4.485 0.355 18090 455 1 2 . 1 1 14 14 ASN C C 140 173.840 173.840 175.303 -1.463 18090 456 1 2 . 1 1 14 14 ASN CA C 140 52.380 52.380 54.189 -1.809 18090 457 1 2 . 1 1 14 14 ASN CB C 140 38.330 38.330 36.986 1.344 18090 458 1 2 . 1 1 14 14 ASN H H 140 8.670 8.670 8.685 -0.016 18090 459 1 2 . 1 1 15 15 LEU N N 141 120.290 120.290 120.194 0.096 18090 460 1 2 . 1 1 15 15 LEU HA H 141 3.790 3.790 4.534 -0.744 18090 461 1 2 . 1 1 15 15 LEU C C 141 177.120 177.120 177.519 -0.399 18090 462 1 2 . 1 1 15 15 LEU CA C 141 59.280 59.280 55.524 3.756 18090 463 1 2 . 1 1 15 15 LEU CB C 141 42.980 42.980 43.163 -0.183 18090 464 1 2 . 1 1 15 15 LEU H H 141 7.200 7.200 8.381 -1.181 18090 465 1 2 . 1 1 16 16 ILE N N 142 115.290 115.290 120.303 -5.013 18090 466 1 2 . 1 1 16 16 ILE HA H 142 3.480 3.480 3.721 -0.241 18090 467 1 2 . 1 1 16 16 ILE C C 142 177.990 177.990 177.521 0.469 18090 468 1 2 . 1 1 16 16 ILE CA C 142 62.690 62.690 65.429 -2.739 18090 469 1 2 . 1 1 16 16 ILE CB C 142 34.620 34.620 37.642 -3.022 18090 470 1 2 . 1 1 16 16 ILE H H 142 7.940 7.940 8.308 -0.368 18090 471 1 2 . 1 1 17 17 GLU N N 143 119.600 119.600 118.986 0.614 18090 472 1 2 . 1 1 17 17 GLU HA H 143 3.700 3.700 3.990 -0.290 18090 473 1 2 . 1 1 17 17 GLU C C 143 179.170 179.170 178.738 0.432 18090 474 1 2 . 1 1 17 17 GLU CA C 143 59.360 59.360 60.096 -0.737 18090 475 1 2 . 1 1 17 17 GLU CB C 143 28.520 28.520 29.221 -0.701 18090 476 1 2 . 1 1 17 17 GLU H H 143 7.970 7.970 8.547 -0.577 18090 477 1 2 . 1 1 18 18 ASN N N 144 117.170 117.170 117.785 -0.615 18090 478 1 2 . 1 1 18 18 ASN HA H 144 4.270 4.270 4.449 -0.179 18090 479 1 2 . 1 1 18 18 ASN C C 144 179.120 179.120 177.798 1.322 18090 480 1 2 . 1 1 18 18 ASN CA C 144 55.490 55.490 55.637 -0.147 18090 481 1 2 . 1 1 18 18 ASN CB C 144 36.550 36.550 37.795 -1.245 18090 482 1 2 . 1 1 18 18 ASN H H 144 8.450 8.450 8.383 0.067 18090 483 1 2 . 1 1 19 19 LEU N N 145 121.060 121.060 119.051 2.009 18090 484 1 2 . 1 1 19 19 LEU HA H 145 4.020 4.020 4.026 -0.006 18090 485 1 2 . 1 1 19 19 LEU C C 145 180.260 180.260 178.132 2.128 18090 486 1 2 . 1 1 19 19 LEU CA C 145 56.620 56.620 57.025 -0.405 18090 487 1 2 . 1 1 19 19 LEU CB C 145 41.780 41.780 41.535 0.245 18090 488 1 2 . 1 1 19 19 LEU H H 145 7.990 7.990 7.509 0.481 18090 489 1 2 . 1 1 20 20 LYS N N 146 118.960 118.960 117.152 1.808 18090 490 1 2 . 1 1 20 20 LYS HA H 146 3.610 3.610 3.988 -0.378 18090 491 1 2 . 1 1 20 20 LYS C C 146 177.390 177.390 178.090 -0.700 18090 492 1 2 . 1 1 20 20 LYS CA C 146 59.640 59.640 59.134 0.506 18090 493 1 2 . 1 1 20 20 LYS CB C 146 32.450 32.450 32.354 0.096 18090 494 1 2 . 1 1 20 20 LYS H H 146 8.250 8.250 7.858 0.392 18090 495 1 2 . 1 1 21 21 LYS N N 147 114.720 114.720 116.870 -2.150 18090 496 1 2 . 1 1 21 21 LYS HA H 147 4.110 4.110 4.272 -0.162 18090 497 1 2 . 1 1 21 21 LYS C C 147 175.880 175.880 178.032 -2.152 18090 498 1 2 . 1 1 21 21 LYS CA C 147 56.210 56.210 58.049 -1.839 18090 499 1 2 . 1 1 21 21 LYS CB C 147 33.000 33.000 32.666 0.334 18090 500 1 2 . 1 1 21 21 LYS H H 147 7.130 7.130 7.638 -0.508 18090 501 1 2 . 1 1 22 22 ASN N N 148 122.180 122.180 115.466 6.714 18090 502 1 2 . 1 1 22 22 ASN HA H 148 4.740 4.740 4.915 -0.175 18090 503 1 2 . 1 1 22 22 ASN C C 148 174.000 174.000 173.520 0.480 18090 504 1 2 . 1 1 22 22 ASN CA C 148 50.970 50.970 52.709 -1.739 18090 505 1 2 . 1 1 22 22 ASN CB C 148 38.670 38.670 38.955 -0.285 18090 506 1 2 . 1 1 22 22 ASN H H 148 6.930 6.930 7.896 -0.966 18090 507 1 2 . 1 1 23 23 PRO HA H 149 4.300 4.300 4.697 -0.397 18090 508 1 2 . 1 1 23 23 PRO CA C 149 64.610 64.610 61.988 2.622 18090 509 1 2 . 1 1 23 23 PRO CB C 149 32.000 32.000 34.133 -2.133 18090 510 1 2 . 1 1 24 24 LYS N N 150 116.060 116.060 121.269 -5.209 18090 511 1 2 . 1 1 24 24 LYS HA H 150 4.070 4.070 3.977 0.093 18090 512 1 2 . 1 1 24 24 LYS C C 150 178.240 178.240 178.595 -0.355 18090 513 1 2 . 1 1 24 24 LYS CA C 150 57.950 57.950 59.748 -1.798 18090 514 1 2 . 1 1 24 24 LYS CB C 150 32.590 32.590 31.956 0.634 18090 515 1 2 . 1 1 24 24 LYS H H 150 8.520 8.520 8.804 -0.284 18090 516 1 2 . 1 1 25 25 THR N N 151 105.190 105.190 110.545 -5.355 18090 517 1 2 . 1 1 25 25 THR HA H 151 4.390 4.390 4.063 0.327 18090 518 1 2 . 1 1 25 25 THR C C 151 176.090 176.090 176.197 -0.107 18090 519 1 2 . 1 1 25 25 THR CA C 151 61.400 61.400 64.836 -3.436 18090 520 1 2 . 1 1 25 25 THR CB C 151 69.440 69.440 68.217 1.223 18090 521 1 2 . 1 1 25 25 THR H H 151 7.490 7.490 8.103 -0.613 18090 522 1 2 . 1 1 26 26 SER N N 152 119.700 119.700 116.488 3.212 18090 523 1 2 . 1 1 26 26 SER HA H 152 3.770 3.770 4.147 -0.377 18090 524 1 2 . 1 1 26 26 SER C C 152 177.470 177.470 176.064 1.406 18090 525 1 2 . 1 1 26 26 SER CA C 152 62.450 62.450 61.324 1.126 18090 526 1 2 . 1 1 26 26 SER CB C 152 62.520 62.520 62.764 -0.244 18090 527 1 2 . 1 1 26 26 SER H H 152 8.190 8.190 7.956 0.234 18090 528 1 2 . 1 1 27 27 GLU N N 153 119.870 119.870 122.937 -3.067 18090 529 1 2 . 1 1 27 27 GLU HA H 153 3.890 3.890 3.957 -0.067 18090 530 1 2 . 1 1 27 27 GLU C C 153 180.040 180.040 178.729 1.311 18090 531 1 2 . 1 1 27 27 GLU CA C 153 58.700 58.700 59.467 -0.767 18090 532 1 2 . 1 1 27 27 GLU CB C 153 28.590 28.590 29.451 -0.861 18090 533 1 2 . 1 1 27 27 GLU H H 153 8.350 8.350 7.918 0.432 18090 534 1 2 . 1 1 28 28 MET N N 154 119.430 119.430 117.079 2.351 18090 535 1 2 . 1 1 28 28 MET HA H 154 4.040 4.040 4.155 -0.115 18090 536 1 2 . 1 1 28 28 MET C C 154 177.110 177.110 178.075 -0.965 18090 537 1 2 . 1 1 28 28 MET CA C 154 58.510 58.510 58.775 -0.265 18090 538 1 2 . 1 1 28 28 MET CB C 154 31.430 31.430 32.767 -1.337 18090 539 1 2 . 1 1 28 28 MET H H 154 7.850 7.850 7.585 0.265 18090 540 1 2 . 1 1 29 29 MET N N 155 112.640 112.640 114.179 -1.539 18090 541 1 2 . 1 1 29 29 MET HA H 155 4.340 4.340 4.254 0.086 18090 542 1 2 . 1 1 29 29 MET C C 155 175.530 175.530 177.833 -2.303 18090 543 1 2 . 1 1 29 29 MET CA C 155 53.790 53.790 57.177 -3.387 18090 544 1 2 . 1 1 29 29 MET CB C 155 30.380 30.380 32.016 -1.636 18090 545 1 2 . 1 1 29 29 MET H H 155 7.200 7.200 7.379 -0.179 18090 546 1 2 . 1 1 30 30 LYS N N 156 117.050 117.050 116.725 0.325 18090 547 1 2 . 1 1 30 30 LYS HA H 156 3.960 3.960 4.272 -0.312 18090 548 1 2 . 1 1 30 30 LYS C C 156 176.120 176.120 177.141 -1.021 18090 549 1 2 . 1 1 30 30 LYS CA C 156 57.090 57.090 57.326 -0.236 18090 550 1 2 . 1 1 30 30 LYS CB C 156 31.960 31.960 32.978 -1.018 18090 551 1 2 . 1 1 30 30 LYS H H 156 7.130 7.130 7.664 -0.534 18090 552 1 2 . 1 1 31 31 ASP N N 157 119.810 119.810 118.585 1.225 18090 553 1 2 . 1 1 31 31 ASP HA H 157 4.860 4.860 4.975 -0.115 18090 554 1 2 . 1 1 31 31 ASP C C 157 174.890 174.890 174.537 0.353 18090 555 1 2 . 1 1 31 31 ASP CA C 157 50.520 50.520 54.501 -3.981 18090 556 1 2 . 1 1 31 31 ASP CB C 157 41.010 41.010 40.850 0.160 18090 557 1 2 . 1 1 31 31 ASP H H 157 7.340 7.340 7.732 -0.392 18090 558 1 2 . 1 1 32 32 PRO HA H 158 4.130 4.130 4.461 -0.331 18090 559 1 2 . 1 1 32 32 PRO CA C 158 64.270 64.270 62.987 1.282 18090 560 1 2 . 1 1 32 32 PRO CB C 158 31.770 31.770 32.369 -0.599 18090 561 1 2 . 1 1 33 33 GLN N N 159 117.760 117.760 120.256 -2.496 18090 562 1 2 . 1 1 33 33 GLN HA H 159 4.000 4.000 4.040 -0.040 18090 563 1 2 . 1 1 33 33 GLN C C 159 178.740 178.740 177.941 0.799 18090 564 1 2 . 1 1 33 33 GLN CA C 159 58.220 58.220 58.038 0.182 18090 565 1 2 . 1 1 33 33 GLN CB C 159 27.870 27.870 28.079 -0.209 18090 566 1 2 . 1 1 33 33 GLN H H 159 8.150 8.150 8.771 -0.621 18090 567 1 2 . 1 1 34 34 LEU N N 160 123.300 123.300 120.028 3.272 18090 568 1 2 . 1 1 34 34 LEU HA H 160 3.970 3.970 4.011 -0.041 18090 569 1 2 . 1 1 34 34 LEU C C 160 177.980 177.980 178.150 -0.170 18090 570 1 2 . 1 1 34 34 LEU CA C 160 57.050 57.050 57.264 -0.214 18090 571 1 2 . 1 1 34 34 LEU CB C 160 40.760 40.760 41.670 -0.910 18090 572 1 2 . 1 1 34 34 LEU H H 160 7.110 7.110 7.983 -0.873 18090 573 1 2 . 1 1 35 35 VAL N N 161 118.390 118.390 119.416 -1.026 18090 574 1 2 . 1 1 35 35 VAL HA H 161 3.110 3.110 3.490 -0.380 18090 575 1 2 . 1 1 35 35 VAL C C 161 176.840 176.840 177.648 -0.808 18090 576 1 2 . 1 1 35 35 VAL CA C 161 67.700 67.700 66.992 0.708 18090 577 1 2 . 1 1 35 35 VAL CB C 161 31.260 31.260 31.320 -0.060 18090 578 1 2 . 1 1 35 35 VAL H H 161 7.430 7.430 7.410 0.020 18090 579 1 2 . 1 1 36 36 ALA N N 162 117.600 117.600 121.233 -3.633 18090 580 1 2 . 1 1 36 36 ALA HA H 162 3.810 3.810 3.944 -0.134 18090 581 1 2 . 1 1 36 36 ALA C C 162 180.620 180.620 179.620 1.000 18090 582 1 2 . 1 1 36 36 ALA CA C 162 54.720 54.720 55.335 -0.615 18090 583 1 2 . 1 1 36 36 ALA CB C 162 17.490 17.490 18.102 -0.612 18090 584 1 2 . 1 1 36 36 ALA H H 162 7.500 7.500 7.775 -0.275 18090 585 1 2 . 1 1 37 37 LYS N N 163 119.880 119.880 118.504 1.376 18090 586 1 2 . 1 1 37 37 LYS HA H 163 3.570 3.570 3.987 -0.417 18090 587 1 2 . 1 1 37 37 LYS C C 163 177.800 177.800 179.124 -1.324 18090 588 1 2 . 1 1 37 37 LYS CA C 163 58.880 58.880 58.933 -0.053 18090 589 1 2 . 1 1 37 37 LYS CB C 163 31.610 31.610 32.038 -0.428 18090 590 1 2 . 1 1 37 37 LYS H H 163 7.350 7.350 7.407 -0.057 18090 591 1 2 . 1 1 38 38 LEU N N 164 118.020 118.020 120.010 -1.990 18090 592 1 2 . 1 1 38 38 LEU HA H 164 3.670 3.670 4.066 -0.396 18090 593 1 2 . 1 1 38 38 LEU C C 164 179.380 179.380 179.214 0.166 18090 594 1 2 . 1 1 38 38 LEU CA C 164 57.340 57.340 57.755 -0.415 18090 595 1 2 . 1 1 38 38 LEU CB C 164 41.660 41.660 41.701 -0.041 18090 596 1 2 . 1 1 38 38 LEU H H 164 7.660 7.660 8.167 -0.507 18090 597 1 2 . 1 1 39 39 ILE N N 165 118.070 118.070 118.353 -0.283 18090 598 1 2 . 1 1 39 39 ILE HA H 165 3.510 3.510 3.641 -0.131 18090 599 1 2 . 1 1 39 39 ILE C C 165 179.570 179.570 178.223 1.347 18090 600 1 2 . 1 1 39 39 ILE CA C 165 64.450 64.450 65.549 -1.099 18090 601 1 2 . 1 1 39 39 ILE CB C 165 37.310 37.310 37.455 -0.145 18090 602 1 2 . 1 1 39 39 ILE H H 165 8.030 8.030 8.026 0.004 18090 603 1 2 . 1 1 40 40 GLY N N 166 107.970 107.970 107.932 0.038 18090 604 1 2 . 1 1 40 40 GLY C C 166 176.470 176.470 175.716 0.754 18090 605 1 2 . 1 1 40 40 GLY CA C 166 46.410 46.410 46.968 -0.558 18090 606 1 2 . 1 1 40 40 GLY H H 166 7.590 7.590 7.625 -0.035 18090 607 1 2 . 1 1 41 41 TYR N N 167 121.270 121.270 122.367 -1.097 18090 608 1 2 . 1 1 41 41 TYR HA H 167 4.190 4.190 4.210 -0.020 18090 609 1 2 . 1 1 41 41 TYR C C 167 176.470 176.470 176.245 0.225 18090 610 1 2 . 1 1 41 41 TYR CA C 167 57.130 57.130 60.441 -3.311 18090 611 1 2 . 1 1 41 41 TYR CB C 167 35.950 35.950 38.234 -2.284 18090 612 1 2 . 1 1 41 41 TYR H H 167 7.350 7.350 7.872 -0.522 18090 613 1 2 . 1 1 42 42 LYS N N 168 116.520 116.520 116.089 0.431 18090 614 1 2 . 1 1 42 42 LYS HA H 168 3.820 3.820 4.052 -0.232 18090 615 1 2 . 1 1 42 42 LYS C C 168 177.810 177.810 177.935 -0.125 18090 616 1 2 . 1 1 42 42 LYS CA C 168 59.390 59.390 58.424 0.966 18090 617 1 2 . 1 1 42 42 LYS CB C 168 31.580 31.580 32.748 -1.167 18090 618 1 2 . 1 1 42 42 LYS H H 168 7.460 7.460 8.283 -0.823 18090 619 1 2 . 1 1 43 43 GLN N N 169 113.750 113.750 116.012 -2.262 18090 620 1 2 . 1 1 43 43 GLN HA H 169 4.220 4.220 4.154 0.066 18090 621 1 2 . 1 1 43 43 GLN C C 169 175.840 175.840 177.358 -1.518 18090 622 1 2 . 1 1 43 43 GLN CA C 169 56.230 56.230 58.147 -1.917 18090 623 1 2 . 1 1 43 43 GLN CB C 169 29.290 29.290 29.383 -0.093 18090 624 1 2 . 1 1 43 43 GLN H H 169 7.220 7.220 7.619 -0.399 18090 625 1 2 . 1 1 44 44 ASN N N 170 114.130 114.130 116.057 -1.927 18090 626 1 2 . 1 1 44 44 ASN HA H 170 5.050 5.050 4.937 0.113 18090 627 1 2 . 1 1 44 44 ASN C C 170 172.200 172.200 173.578 -1.378 18090 628 1 2 . 1 1 44 44 ASN CA C 170 50.780 50.780 53.696 -2.916 18090 629 1 2 . 1 1 44 44 ASN CB C 170 38.380 38.380 39.664 -1.284 18090 630 1 2 . 1 1 44 44 ASN H H 170 7.580 7.580 7.653 -0.073 18090 631 1 2 . 1 1 45 45 PRO HA H 171 4.130 4.130 4.671 -0.541 18090 632 1 2 . 1 1 45 45 PRO CA C 171 64.800 64.800 62.090 2.710 18090 633 1 2 . 1 1 45 45 PRO CB C 171 31.360 31.360 31.960 -0.600 18090 634 1 2 . 1 1 46 46 GLN N N 172 115.570 115.570 122.979 -7.409 18090 635 1 2 . 1 1 46 46 GLN HA H 172 3.770 3.770 3.774 -0.004 18090 636 1 2 . 1 1 46 46 GLN C C 172 177.360 177.360 177.603 -0.243 18090 637 1 2 . 1 1 46 46 GLN CA C 172 57.950 57.950 58.159 -0.209 18090 638 1 2 . 1 1 46 46 GLN CB C 172 27.050 27.050 27.892 -0.842 18090 639 1 2 . 1 1 46 46 GLN H H 172 8.160 8.160 8.703 -0.543 18090 640 1 2 . 1 1 47 47 ALA N N 173 121.420 121.420 121.601 -0.181 18090 641 1 2 . 1 1 47 47 ALA HA H 173 4.050 4.050 4.169 -0.119 18090 642 1 2 . 1 1 47 47 ALA C C 173 178.090 178.090 179.466 -1.376 18090 643 1 2 . 1 1 47 47 ALA CA C 173 53.490 53.490 54.324 -0.834 18090 644 1 2 . 1 1 47 47 ALA CB C 173 18.450 18.450 17.638 0.812 18090 645 1 2 . 1 1 47 47 ALA H H 173 7.470 7.470 8.269 -0.799 18090 646 1 2 . 1 1 48 48 ILE N N 174 118.050 118.050 118.679 -0.629 18090 647 1 2 . 1 1 48 48 ILE HA H 174 3.180 3.180 3.886 -0.706 18090 648 1 2 . 1 1 48 48 ILE C C 174 176.250 176.250 177.873 -1.623 18090 649 1 2 . 1 1 48 48 ILE CA C 174 64.030 64.030 64.052 -0.022 18090 650 1 2 . 1 1 48 48 ILE CB C 174 37.280 37.280 37.095 0.185 18090 651 1 2 . 1 1 48 48 ILE H H 174 7.150 7.150 7.341 -0.191 18090 652 1 2 . 1 1 49 49 GLY N N 175 105.390 105.390 106.646 -1.256 18090 653 1 2 . 1 1 49 49 GLY C C 175 174.220 174.220 176.010 -1.790 18090 654 1 2 . 1 1 49 49 GLY CA C 175 46.700 46.700 47.038 -0.338 18090 655 1 2 . 1 1 49 49 GLY H H 175 7.550 7.550 7.789 -0.239 18090 656 1 2 . 1 1 50 50 GLN N N 176 116.230 116.230 118.615 -2.385 18090 657 1 2 . 1 1 50 50 GLN HA H 176 4.210 4.210 4.566 -0.356 18090 658 1 2 . 1 1 50 50 GLN C C 176 178.120 178.120 178.266 -0.146 18090 659 1 2 . 1 1 50 50 GLN CA C 176 57.320 57.320 57.966 -0.646 18090 660 1 2 . 1 1 50 50 GLN CB C 176 28.630 28.630 29.196 -0.566 18090 661 1 2 . 1 1 50 50 GLN H H 176 7.390 7.390 7.995 -0.605 18090 662 1 2 . 1 1 51 51 ASP N N 177 120.000 120.000 121.022 -1.022 18090 663 1 2 . 1 1 51 51 ASP HA H 177 4.420 4.420 4.642 -0.222 18090 664 1 2 . 1 1 51 51 ASP C C 177 177.950 177.950 178.323 -0.373 18090 665 1 2 . 1 1 51 51 ASP CA C 177 55.840 55.840 56.016 -0.175 18090 666 1 2 . 1 1 51 51 ASP CB C 177 40.310 40.310 40.854 -0.544 18090 667 1 2 . 1 1 51 51 ASP H H 177 7.870 7.870 7.911 -0.041 18090 668 1 2 . 1 1 52 52 LEU N N 178 120.010 120.010 120.416 -0.406 18090 669 1 2 . 1 1 52 52 LEU HA H 178 3.650 3.650 3.992 -0.342 18090 670 1 2 . 1 1 52 52 LEU C C 178 175.810 175.810 178.275 -2.465 18090 671 1 2 . 1 1 52 52 LEU CA C 178 57.620 57.620 57.815 -0.195 18090 672 1 2 . 1 1 52 52 LEU CB C 178 41.880 41.880 41.709 0.171 18090 673 1 2 . 1 1 52 52 LEU H H 178 7.860 7.860 7.616 0.244 18090 674 1 2 . 1 1 53 53 PHE N N 179 110.580 110.580 113.881 -3.301 18090 675 1 2 . 1 1 53 53 PHE HA H 179 4.230 4.230 4.333 -0.103 18090 676 1 2 . 1 1 53 53 PHE C C 179 176.370 176.370 178.058 -1.688 18090 677 1 2 . 1 1 53 53 PHE CA C 179 58.730 58.730 60.450 -1.720 18090 678 1 2 . 1 1 53 53 PHE CB C 179 38.720 38.720 38.826 -0.106 18090 679 1 2 . 1 1 53 53 PHE H H 179 7.210 7.210 7.977 -0.767 18090 680 1 2 . 1 1 54 54 THR N N 180 108.190 108.190 108.099 0.091 18090 681 1 2 . 1 1 54 54 THR HA H 180 4.300 4.300 4.328 -0.028 18090 682 1 2 . 1 1 54 54 THR C C 180 174.400 174.400 174.670 -0.270 18090 683 1 2 . 1 1 54 54 THR CA C 180 62.020 62.020 63.115 -1.095 18090 684 1 2 . 1 1 54 54 THR CB C 180 69.730 69.730 69.661 0.069 18090 685 1 2 . 1 1 54 54 THR H H 180 7.550 7.550 7.468 0.082 18090 686 1 2 . 1 1 55 55 ASP N N 181 120.060 120.060 122.645 -2.585 18090 687 1 2 . 1 1 55 55 ASP HA H 181 5.020 5.020 5.059 -0.039 18090 688 1 2 . 1 1 55 55 ASP C C 181 174.120 174.120 175.369 -1.249 18090 689 1 2 . 1 1 55 55 ASP CA C 181 50.560 50.560 50.616 -0.056 18090 690 1 2 . 1 1 55 55 ASP CB C 181 41.190 41.190 43.284 -2.094 18090 691 1 2 . 1 1 55 55 ASP H H 181 7.480 7.480 7.952 -0.472 18090 692 1 2 . 1 1 56 56 PRO HA H 182 4.320 4.320 4.329 -0.009 18090 693 1 2 . 1 1 56 56 PRO CA C 182 64.280 64.280 64.884 -0.604 18090 694 1 2 . 1 1 56 56 PRO CB C 182 31.980 31.980 32.631 -0.651 18090 695 1 2 . 1 1 57 57 ARG N N 183 117.660 117.660 118.372 -0.712 18090 696 1 2 . 1 1 57 57 ARG HA H 183 3.960 3.960 4.104 -0.144 18090 697 1 2 . 1 1 57 57 ARG C C 183 179.030 179.030 178.690 0.340 18090 698 1 2 . 1 1 57 57 ARG CA C 183 59.000 59.000 58.813 0.187 18090 699 1 2 . 1 1 57 57 ARG CB C 183 29.750 29.750 29.373 0.377 18090 700 1 2 . 1 1 57 57 ARG H H 183 7.920 7.920 7.999 -0.079 18090 701 1 2 . 1 1 58 58 LEU N N 184 115.670 115.670 119.436 -3.766 18090 702 1 2 . 1 1 58 58 LEU HA H 184 3.850 3.850 3.968 -0.118 18090 703 1 2 . 1 1 58 58 LEU C C 184 178.770 178.770 179.094 -0.324 18090 704 1 2 . 1 1 58 58 LEU CA C 184 57.110 57.110 57.707 -0.597 18090 705 1 2 . 1 1 58 58 LEU CB C 184 41.310 41.310 41.600 -0.290 18090 706 1 2 . 1 1 58 58 LEU H H 184 7.750 7.750 8.208 -0.458 18090 707 1 2 . 1 1 59 59 MET N N 185 118.570 118.570 116.367 2.203 18090 708 1 2 . 1 1 59 59 MET HA H 185 4.060 4.060 4.133 -0.073 18090 709 1 2 . 1 1 59 59 MET C C 185 177.540 177.540 178.189 -0.649 18090 710 1 2 . 1 1 59 59 MET CA C 185 58.090 58.090 59.319 -1.229 18090 711 1 2 . 1 1 59 59 MET CB C 185 31.270 31.270 32.167 -0.897 18090 712 1 2 . 1 1 59 59 MET H H 185 7.590 7.590 7.653 -0.063 18090 713 1 2 . 1 1 60 60 THR N N 186 116.390 116.390 117.336 -0.946 18090 714 1 2 . 1 1 60 60 THR HA H 186 3.680 3.680 4.004 -0.324 18090 715 1 2 . 1 1 60 60 THR C C 186 177.440 177.440 176.712 0.728 18090 716 1 2 . 1 1 60 60 THR CA C 186 66.940 66.940 66.369 0.571 18090 717 1 2 . 1 1 60 60 THR CB C 186 68.030 68.030 68.130 -0.100 18090 718 1 2 . 1 1 60 60 THR H H 186 7.180 7.180 7.799 -0.619 18090 719 1 2 . 1 1 61 61 ILE N N 187 123.840 123.840 122.096 1.744 18090 720 1 2 . 1 1 61 61 ILE HA H 187 3.290 3.290 3.768 -0.478 18090 721 1 2 . 1 1 61 61 ILE C C 187 176.660 176.660 178.240 -1.580 18090 722 1 2 . 1 1 61 61 ILE CA C 187 65.850 65.850 65.451 0.398 18090 723 1 2 . 1 1 61 61 ILE CB C 187 37.640 37.640 37.763 -0.123 18090 724 1 2 . 1 1 61 61 ILE H H 187 8.010 8.010 7.814 0.196 18090 725 1 2 . 1 1 62 62 MET N N 188 118.210 118.210 118.269 -0.059 18090 726 1 2 . 1 1 62 62 MET HA H 188 3.910 3.910 4.001 -0.091 18090 727 1 2 . 1 1 62 62 MET C C 188 177.540 177.540 178.431 -0.891 18090 728 1 2 . 1 1 62 62 MET CA C 188 58.530 58.530 58.898 -0.368 18090 729 1 2 . 1 1 62 62 MET CB C 188 31.200 31.200 31.531 -0.331 18090 730 1 2 . 1 1 62 62 MET H H 188 8.560 8.560 7.429 1.131 18090 731 1 2 . 1 1 63 63 ALA N N 189 119.850 119.850 122.440 -2.590 18090 732 1 2 . 1 1 63 63 ALA HA H 189 3.730 3.730 3.876 -0.146 18090 733 1 2 . 1 1 63 63 ALA C C 189 179.550 179.550 179.465 0.085 18090 734 1 2 . 1 1 63 63 ALA CA C 189 55.470 55.470 55.556 -0.085 18090 735 1 2 . 1 1 63 63 ALA CB C 189 17.640 17.640 18.145 -0.506 18090 736 1 2 . 1 1 63 63 ALA H H 189 8.210 8.210 8.227 -0.017 18090 737 1 2 . 1 1 64 64 THR N N 190 114.570 114.570 113.831 0.739 18090 738 1 2 . 1 1 64 64 THR HA H 190 3.790 3.790 3.991 -0.201 18090 739 1 2 . 1 1 64 64 THR C C 190 177.640 177.640 176.666 0.974 18090 740 1 2 . 1 1 64 64 THR CA C 190 66.690 66.690 65.623 1.067 18090 741 1 2 . 1 1 64 64 THR CB C 190 68.310 68.310 68.163 0.147 18090 742 1 2 . 1 1 64 64 THR H H 190 7.740 7.740 7.670 0.070 18090 743 1 2 . 1 1 65 65 LEU N N 191 122.410 122.410 122.593 -0.183 18090 744 1 2 . 1 1 65 65 LEU HA H 191 3.930 3.930 3.966 -0.036 18090 745 1 2 . 1 1 65 65 LEU C C 191 178.470 178.470 179.878 -1.408 18090 746 1 2 . 1 1 65 65 LEU CA C 191 57.120 57.120 58.102 -0.982 18090 747 1 2 . 1 1 65 65 LEU CB C 191 41.830 41.830 41.726 0.104 18090 748 1 2 . 1 1 65 65 LEU H H 191 8.180 8.180 7.669 0.511 18090 749 1 2 . 1 1 66 66 MET N N 192 115.320 115.320 117.209 -1.889 18090 750 1 2 . 1 1 66 66 MET HA H 192 4.090 4.090 4.304 -0.214 18090 751 1 2 . 1 1 66 66 MET C C 192 176.090 176.090 178.288 -2.198 18090 752 1 2 . 1 1 66 66 MET CA C 192 56.390 56.390 57.409 -1.019 18090 753 1 2 . 1 1 66 66 MET CB C 192 33.770 33.770 31.878 1.893 18090 754 1 2 . 1 1 66 66 MET H H 192 7.880 7.880 8.497 -0.617 18090 755 1 2 . 1 1 67 67 GLY N N 193 107.490 107.490 105.125 2.365 18090 756 1 2 . 1 1 67 67 GLY C C 193 174.390 174.390 174.624 -0.234 18090 757 1 2 . 1 1 67 67 GLY CA C 193 45.880 45.880 44.857 1.023 18090 758 1 2 . 1 1 67 67 GLY H H 193 7.580 7.580 8.064 -0.484 18090 759 1 2 . 1 1 68 68 VAL N N 194 118.520 118.520 116.567 1.953 18090 760 1 2 . 1 1 68 68 VAL HA H 194 3.940 3.940 3.563 0.377 18090 761 1 2 . 1 1 68 68 VAL C C 194 174.760 174.760 174.769 -0.009 18090 762 1 2 . 1 1 68 68 VAL CA C 194 61.510 61.510 63.352 -1.842 18090 763 1 2 . 1 1 68 68 VAL CB C 194 32.670 32.670 30.882 1.788 18090 764 1 2 . 1 1 68 68 VAL H H 194 7.840 7.840 7.282 0.558 18090 765 1 2 . 1 1 69 69 ASP N N 195 124.550 124.550 116.648 7.902 18090 766 1 2 . 1 1 69 69 ASP HA H 195 4.430 4.430 4.270 0.160 18090 767 1 2 . 1 1 69 69 ASP C C 195 175.140 175.140 176.031 -0.891 18090 768 1 2 . 1 1 69 69 ASP CA C 195 53.760 53.760 55.582 -1.822 18090 769 1 2 . 1 1 69 69 ASP CB C 195 40.920 40.920 39.701 1.219 18090 770 1 2 . 1 1 69 69 ASP H H 195 8.400 8.400 7.977 0.423 18090 771 1 2 . 1 1 70 70 LEU N N 196 123.930 123.930 118.849 5.081 18090 772 1 2 . 1 1 70 70 LEU HA H 196 4.200 4.200 4.321 -0.121 18090 773 1 2 . 1 1 70 70 LEU C C 196 175.950 175.950 177.274 -1.324 18090 774 1 2 . 1 1 70 70 LEU CA C 196 54.380 54.380 55.244 -0.864 18090 775 1 2 . 1 1 70 70 LEU CB C 196 41.610 41.610 42.638 -1.028 18090 776 1 2 . 1 1 70 70 LEU H H 196 8.160 8.160 7.602 0.558 18090 777 1 3 . 1 1 2 2 PRO HA H 128 4.220 4.220 4.428 -0.208 18090 778 1 3 . 1 1 2 2 PRO CA C 128 63.320 63.320 62.964 0.356 18090 779 1 3 . 1 1 2 2 PRO CB C 128 31.680 31.680 32.139 -0.459 18090 780 1 3 . 1 1 3 3 ASP N N 129 119.320 119.320 117.459 1.861 18090 781 1 3 . 1 1 3 3 ASP HA H 129 4.400 4.400 4.408 -0.008 18090 782 1 3 . 1 1 3 3 ASP C C 129 176.120 176.120 175.717 0.403 18090 783 1 3 . 1 1 3 3 ASP CA C 129 54.050 54.050 54.823 -0.773 18090 784 1 3 . 1 1 3 3 ASP CB C 129 40.770 40.770 41.326 -0.556 18090 785 1 3 . 1 1 3 3 ASP H H 129 8.310 8.310 8.218 0.092 18090 786 1 3 . 1 1 4 4 LEU N N 130 122.280 122.280 120.645 1.635 18090 787 1 3 . 1 1 4 4 LEU HA H 130 4.130 4.130 4.391 -0.261 18090 788 1 3 . 1 1 4 4 LEU C C 130 177.280 177.280 177.811 -0.531 18090 789 1 3 . 1 1 4 4 LEU CA C 130 55.350 55.350 54.559 0.791 18090 790 1 3 . 1 1 4 4 LEU CB C 130 41.490 41.490 42.460 -0.970 18090 791 1 3 . 1 1 4 4 LEU H H 130 8.080 8.080 8.210 -0.130 18090 792 1 3 . 1 1 5 5 GLY N N 131 107.830 107.830 109.530 -1.700 18090 793 1 3 . 1 1 5 5 GLY C C 131 175.120 175.120 173.252 1.868 18090 794 1 3 . 1 1 5 5 GLY CA C 131 45.300 45.300 45.425 -0.125 18090 795 1 3 . 1 1 5 5 GLY H H 131 8.180 8.180 8.431 -0.251 18090 796 1 3 . 1 1 6 6 LEU N N 132 121.080 121.080 116.516 4.564 18090 797 1 3 . 1 1 6 6 LEU HA H 132 3.870 3.870 4.459 -0.589 18090 798 1 3 . 1 1 6 6 LEU C C 132 178.000 178.000 177.610 0.390 18090 799 1 3 . 1 1 6 6 LEU CA C 132 57.180 57.180 53.427 3.753 18090 800 1 3 . 1 1 6 6 LEU CB C 132 41.870 41.870 44.754 -2.884 18090 801 1 3 . 1 1 6 6 LEU H H 132 8.150 8.150 7.397 0.753 18090 802 1 3 . 1 1 7 7 THR N N 133 111.580 111.580 113.813 -2.233 18090 803 1 3 . 1 1 7 7 THR HA H 133 3.730 3.730 4.001 -0.271 18090 804 1 3 . 1 1 7 7 THR C C 133 176.530 176.530 176.060 0.470 18090 805 1 3 . 1 1 7 7 THR CA C 133 65.940 65.940 66.144 -0.204 18090 806 1 3 . 1 1 7 7 THR CB C 133 68.130 68.130 68.559 -0.429 18090 807 1 3 . 1 1 7 7 THR H H 133 7.970 7.970 8.710 -0.740 18090 808 1 3 . 1 1 8 8 GLN N N 134 119.490 119.490 121.488 -1.998 18090 809 1 3 . 1 1 8 8 GLN HA H 134 3.990 3.990 3.928 0.062 18090 810 1 3 . 1 1 8 8 GLN C C 134 178.190 178.190 178.342 -0.152 18090 811 1 3 . 1 1 8 8 GLN CA C 134 57.930 57.930 58.741 -0.811 18090 812 1 3 . 1 1 8 8 GLN CB C 134 27.850 27.850 27.856 -0.006 18090 813 1 3 . 1 1 8 8 GLN H H 134 7.890 7.890 8.376 -0.486 18090 814 1 3 . 1 1 9 9 LEU N N 135 120.170 120.170 118.053 2.117 18090 815 1 3 . 1 1 9 9 LEU HA H 135 3.820 3.820 3.951 -0.131 18090 816 1 3 . 1 1 9 9 LEU C C 135 177.810 177.810 178.322 -0.512 18090 817 1 3 . 1 1 9 9 LEU CA C 135 57.470 57.470 57.114 0.356 18090 818 1 3 . 1 1 9 9 LEU CB C 135 41.640 41.640 41.962 -0.322 18090 819 1 3 . 1 1 9 9 LEU H H 135 7.600 7.600 7.263 0.337 18090 820 1 3 . 1 1 10 10 PHE N N 136 111.950 111.950 113.156 -1.206 18090 821 1 3 . 1 1 10 10 PHE HA H 136 4.380 4.380 4.402 -0.022 18090 822 1 3 . 1 1 10 10 PHE C C 136 174.990 174.990 176.932 -1.942 18090 823 1 3 . 1 1 10 10 PHE CA C 136 58.450 58.450 57.411 1.039 18090 824 1 3 . 1 1 10 10 PHE CB C 136 38.570 38.570 37.978 0.592 18090 825 1 3 . 1 1 10 10 PHE H H 136 7.410 7.410 6.574 0.836 18090 826 1 3 . 1 1 11 11 ALA N N 137 120.230 120.230 121.944 -1.714 18090 827 1 3 . 1 1 11 11 ALA HA H 137 4.130 4.130 4.149 -0.019 18090 828 1 3 . 1 1 11 11 ALA C C 137 177.090 177.090 178.170 -1.080 18090 829 1 3 . 1 1 11 11 ALA CA C 137 52.580 52.580 53.456 -0.876 18090 830 1 3 . 1 1 11 11 ALA CB C 137 18.660 18.660 18.753 -0.093 18090 831 1 3 . 1 1 11 11 ALA H H 137 7.330 7.330 8.544 -1.214 18090 832 1 3 . 1 1 12 12 ASP N N 138 119.830 119.830 120.980 -1.150 18090 833 1 3 . 1 1 12 12 ASP HA H 138 4.510 4.510 4.707 -0.197 18090 834 1 3 . 1 1 12 12 ASP C C 138 176.370 176.370 174.790 1.580 18090 835 1 3 . 1 1 12 12 ASP CA C 138 51.960 51.960 52.464 -0.504 18090 836 1 3 . 1 1 12 12 ASP CB C 138 41.990 41.990 41.694 0.296 18090 837 1 3 . 1 1 12 12 ASP H H 138 6.980 6.980 7.622 -0.642 18090 838 1 3 . 1 1 13 13 PRO HA H 139 4.260 4.260 4.380 -0.120 18090 839 1 3 . 1 1 13 13 PRO CA C 139 64.350 64.350 62.876 1.474 18090 840 1 3 . 1 1 13 13 PRO CB C 139 31.760 31.760 32.470 -0.710 18090 841 1 3 . 1 1 14 14 ASN N N 140 116.840 116.840 117.244 -0.404 18090 842 1 3 . 1 1 14 14 ASN HA H 140 4.840 4.840 4.477 0.363 18090 843 1 3 . 1 1 14 14 ASN C C 140 173.840 173.840 175.298 -1.458 18090 844 1 3 . 1 1 14 14 ASN CA C 140 52.380 52.380 54.198 -1.818 18090 845 1 3 . 1 1 14 14 ASN CB C 140 38.330 38.330 36.901 1.429 18090 846 1 3 . 1 1 14 14 ASN H H 140 8.670 8.670 8.688 -0.018 18090 847 1 3 . 1 1 15 15 LEU N N 141 120.290 120.290 120.128 0.162 18090 848 1 3 . 1 1 15 15 LEU HA H 141 3.790 3.790 4.542 -0.752 18090 849 1 3 . 1 1 15 15 LEU C C 141 177.120 177.120 177.497 -0.377 18090 850 1 3 . 1 1 15 15 LEU CA C 141 59.280 59.280 55.552 3.728 18090 851 1 3 . 1 1 15 15 LEU CB C 141 42.980 42.980 43.154 -0.174 18090 852 1 3 . 1 1 15 15 LEU H H 141 7.200 7.200 8.324 -1.124 18090 853 1 3 . 1 1 16 16 ILE N N 142 115.290 115.290 120.306 -5.016 18090 854 1 3 . 1 1 16 16 ILE HA H 142 3.480 3.480 3.721 -0.241 18090 855 1 3 . 1 1 16 16 ILE C C 142 177.990 177.990 177.509 0.481 18090 856 1 3 . 1 1 16 16 ILE CA C 142 62.690 62.690 65.439 -2.749 18090 857 1 3 . 1 1 16 16 ILE CB C 142 34.620 34.620 37.628 -3.008 18090 858 1 3 . 1 1 16 16 ILE H H 142 7.940 7.940 8.321 -0.381 18090 859 1 3 . 1 1 17 17 GLU N N 143 119.600 119.600 119.017 0.583 18090 860 1 3 . 1 1 17 17 GLU HA H 143 3.700 3.700 3.993 -0.293 18090 861 1 3 . 1 1 17 17 GLU C C 143 179.170 179.170 178.740 0.430 18090 862 1 3 . 1 1 17 17 GLU CA C 143 59.360 59.360 60.094 -0.734 18090 863 1 3 . 1 1 17 17 GLU CB C 143 28.520 28.520 29.217 -0.697 18090 864 1 3 . 1 1 17 17 GLU H H 143 7.970 7.970 8.550 -0.580 18090 865 1 3 . 1 1 18 18 ASN N N 144 117.170 117.170 117.826 -0.656 18090 866 1 3 . 1 1 18 18 ASN HA H 144 4.270 4.270 4.450 -0.180 18090 867 1 3 . 1 1 18 18 ASN C C 144 179.120 179.120 177.793 1.327 18090 868 1 3 . 1 1 18 18 ASN CA C 144 55.490 55.490 55.639 -0.149 18090 869 1 3 . 1 1 18 18 ASN CB C 144 36.550 36.550 37.809 -1.259 18090 870 1 3 . 1 1 18 18 ASN H H 144 8.450 8.450 8.365 0.085 18090 871 1 3 . 1 1 19 19 LEU N N 145 121.060 121.060 119.098 1.962 18090 872 1 3 . 1 1 19 19 LEU HA H 145 4.020 4.020 4.022 -0.002 18090 873 1 3 . 1 1 19 19 LEU C C 145 180.260 180.260 178.135 2.125 18090 874 1 3 . 1 1 19 19 LEU CA C 145 56.620 56.620 57.053 -0.433 18090 875 1 3 . 1 1 19 19 LEU CB C 145 41.780 41.780 41.535 0.245 18090 876 1 3 . 1 1 19 19 LEU H H 145 7.990 7.990 7.551 0.439 18090 877 1 3 . 1 1 20 20 LYS N N 146 118.960 118.960 117.415 1.545 18090 878 1 3 . 1 1 20 20 LYS HA H 146 3.610 3.610 4.004 -0.394 18090 879 1 3 . 1 1 20 20 LYS C C 146 177.390 177.390 178.111 -0.721 18090 880 1 3 . 1 1 20 20 LYS CA C 146 59.640 59.640 59.018 0.622 18090 881 1 3 . 1 1 20 20 LYS CB C 146 32.450 32.450 32.300 0.150 18090 882 1 3 . 1 1 20 20 LYS H H 146 8.250 8.250 7.799 0.451 18090 883 1 3 . 1 1 21 21 LYS N N 147 114.720 114.720 116.611 -1.891 18090 884 1 3 . 1 1 21 21 LYS HA H 147 4.110 4.110 4.242 -0.132 18090 885 1 3 . 1 1 21 21 LYS C C 147 175.880 175.880 178.101 -2.221 18090 886 1 3 . 1 1 21 21 LYS CA C 147 56.210 56.210 58.148 -1.938 18090 887 1 3 . 1 1 21 21 LYS CB C 147 33.000 33.000 32.765 0.235 18090 888 1 3 . 1 1 21 21 LYS H H 147 7.130 7.130 7.693 -0.563 18090 889 1 3 . 1 1 22 22 ASN N N 148 122.180 122.180 115.428 6.752 18090 890 1 3 . 1 1 22 22 ASN HA H 148 4.740 4.740 4.916 -0.176 18090 891 1 3 . 1 1 22 22 ASN C C 148 174.000 174.000 173.514 0.486 18090 892 1 3 . 1 1 22 22 ASN CA C 148 50.970 50.970 52.708 -1.738 18090 893 1 3 . 1 1 22 22 ASN CB C 148 38.670 38.670 38.969 -0.299 18090 894 1 3 . 1 1 22 22 ASN H H 148 6.930 6.930 7.887 -0.957 18090 895 1 3 . 1 1 23 23 PRO HA H 149 4.300 4.300 4.698 -0.398 18090 896 1 3 . 1 1 23 23 PRO CA C 149 64.610 64.610 61.995 2.615 18090 897 1 3 . 1 1 23 23 PRO CB C 149 32.000 32.000 34.154 -2.154 18090 898 1 3 . 1 1 24 24 LYS N N 150 116.060 116.060 121.204 -5.144 18090 899 1 3 . 1 1 24 24 LYS HA H 150 4.070 4.070 3.949 0.121 18090 900 1 3 . 1 1 24 24 LYS C C 150 178.240 178.240 178.291 -0.051 18090 901 1 3 . 1 1 24 24 LYS CA C 150 57.950 57.950 59.652 -1.702 18090 902 1 3 . 1 1 24 24 LYS CB C 150 32.590 32.590 31.867 0.723 18090 903 1 3 . 1 1 24 24 LYS H H 150 8.520 8.520 8.824 -0.304 18090 904 1 3 . 1 1 25 25 THR N N 151 105.190 105.190 110.558 -5.368 18090 905 1 3 . 1 1 25 25 THR HA H 151 4.390 4.390 4.053 0.337 18090 906 1 3 . 1 1 25 25 THR C C 151 176.090 176.090 176.375 -0.285 18090 907 1 3 . 1 1 25 25 THR CA C 151 61.400 61.400 64.692 -3.292 18090 908 1 3 . 1 1 25 25 THR CB C 151 69.440 69.440 67.150 2.291 18090 909 1 3 . 1 1 25 25 THR H H 151 7.490 7.490 8.158 -0.668 18090 910 1 3 . 1 1 26 26 SER N N 152 119.700 119.700 116.655 3.045 18090 911 1 3 . 1 1 26 26 SER HA H 152 3.770 3.770 4.126 -0.356 18090 912 1 3 . 1 1 26 26 SER C C 152 177.470 177.470 175.963 1.507 18090 913 1 3 . 1 1 26 26 SER CA C 152 62.450 62.450 61.529 0.921 18090 914 1 3 . 1 1 26 26 SER CB C 152 62.520 62.520 62.630 -0.110 18090 915 1 3 . 1 1 26 26 SER H H 152 8.190 8.190 7.948 0.242 18090 916 1 3 . 1 1 27 27 GLU N N 153 119.870 119.870 122.662 -2.792 18090 917 1 3 . 1 1 27 27 GLU HA H 153 3.890 3.890 3.964 -0.074 18090 918 1 3 . 1 1 27 27 GLU C C 153 180.040 180.040 178.731 1.309 18090 919 1 3 . 1 1 27 27 GLU CA C 153 58.700 58.700 59.336 -0.636 18090 920 1 3 . 1 1 27 27 GLU CB C 153 28.590 28.590 29.451 -0.861 18090 921 1 3 . 1 1 27 27 GLU H H 153 8.350 8.350 7.887 0.463 18090 922 1 3 . 1 1 28 28 MET N N 154 119.430 119.430 117.004 2.426 18090 923 1 3 . 1 1 28 28 MET HA H 154 4.040 4.040 4.165 -0.125 18090 924 1 3 . 1 1 28 28 MET C C 154 177.110 177.110 178.148 -1.038 18090 925 1 3 . 1 1 28 28 MET CA C 154 58.510 58.510 58.642 -0.132 18090 926 1 3 . 1 1 28 28 MET CB C 154 31.430 31.430 32.733 -1.304 18090 927 1 3 . 1 1 28 28 MET H H 154 7.850 7.850 7.585 0.265 18090 928 1 3 . 1 1 29 29 MET N N 155 112.640 112.640 114.294 -1.654 18090 929 1 3 . 1 1 29 29 MET HA H 155 4.340 4.340 4.254 0.086 18090 930 1 3 . 1 1 29 29 MET C C 155 175.530 175.530 177.825 -2.295 18090 931 1 3 . 1 1 29 29 MET CA C 155 53.790 53.790 57.155 -3.365 18090 932 1 3 . 1 1 29 29 MET CB C 155 30.380 30.380 32.051 -1.671 18090 933 1 3 . 1 1 29 29 MET H H 155 7.200 7.200 7.361 -0.161 18090 934 1 3 . 1 1 30 30 LYS N N 156 117.050 117.050 116.694 0.356 18090 935 1 3 . 1 1 30 30 LYS HA H 156 3.960 3.960 4.263 -0.303 18090 936 1 3 . 1 1 30 30 LYS C C 156 176.120 176.120 177.159 -1.039 18090 937 1 3 . 1 1 30 30 LYS CA C 156 57.090 57.090 57.336 -0.246 18090 938 1 3 . 1 1 30 30 LYS CB C 156 31.960 31.960 32.936 -0.976 18090 939 1 3 . 1 1 30 30 LYS H H 156 7.130 7.130 7.633 -0.503 18090 940 1 3 . 1 1 31 31 ASP N N 157 119.810 119.810 118.488 1.322 18090 941 1 3 . 1 1 31 31 ASP HA H 157 4.860 4.860 4.981 -0.121 18090 942 1 3 . 1 1 31 31 ASP C C 157 174.890 174.890 174.512 0.378 18090 943 1 3 . 1 1 31 31 ASP CA C 157 50.520 50.520 54.230 -3.710 18090 944 1 3 . 1 1 31 31 ASP CB C 157 41.010 41.010 40.502 0.508 18090 945 1 3 . 1 1 31 31 ASP H H 157 7.340 7.340 7.745 -0.405 18090 946 1 3 . 1 1 32 32 PRO HA H 158 4.130 4.130 4.474 -0.344 18090 947 1 3 . 1 1 32 32 PRO CA C 158 64.270 64.270 62.923 1.347 18090 948 1 3 . 1 1 32 32 PRO CB C 158 31.770 31.770 32.396 -0.626 18090 949 1 3 . 1 1 33 33 GLN N N 159 117.760 117.760 120.265 -2.505 18090 950 1 3 . 1 1 33 33 GLN HA H 159 4.000 4.000 4.039 -0.039 18090 951 1 3 . 1 1 33 33 GLN C C 159 178.740 178.740 177.948 0.792 18090 952 1 3 . 1 1 33 33 GLN CA C 159 58.220 58.220 58.052 0.168 18090 953 1 3 . 1 1 33 33 GLN CB C 159 27.870 27.870 28.075 -0.205 18090 954 1 3 . 1 1 33 33 GLN H H 159 8.150 8.150 8.770 -0.620 18090 955 1 3 . 1 1 34 34 LEU N N 160 123.300 123.300 120.192 3.108 18090 956 1 3 . 1 1 34 34 LEU HA H 160 3.970 3.970 4.024 -0.054 18090 957 1 3 . 1 1 34 34 LEU C C 160 177.980 177.980 178.170 -0.190 18090 958 1 3 . 1 1 34 34 LEU CA C 160 57.050 57.050 57.287 -0.237 18090 959 1 3 . 1 1 34 34 LEU CB C 160 40.760 40.760 41.638 -0.878 18090 960 1 3 . 1 1 34 34 LEU H H 160 7.110 7.110 7.995 -0.885 18090 961 1 3 . 1 1 35 35 VAL N N 161 118.390 118.390 119.333 -0.943 18090 962 1 3 . 1 1 35 35 VAL HA H 161 3.110 3.110 3.556 -0.446 18090 963 1 3 . 1 1 35 35 VAL C C 161 176.840 176.840 177.950 -1.110 18090 964 1 3 . 1 1 35 35 VAL CA C 161 67.700 67.700 66.635 1.065 18090 965 1 3 . 1 1 35 35 VAL CB C 161 31.260 31.260 30.616 0.644 18090 966 1 3 . 1 1 35 35 VAL H H 161 7.430 7.430 7.436 -0.006 18090 967 1 3 . 1 1 36 36 ALA N N 162 117.600 117.600 121.699 -4.099 18090 968 1 3 . 1 1 36 36 ALA HA H 162 3.810 3.810 3.938 -0.128 18090 969 1 3 . 1 1 36 36 ALA C C 162 180.620 180.620 179.717 0.903 18090 970 1 3 . 1 1 36 36 ALA CA C 162 54.720 54.720 55.367 -0.647 18090 971 1 3 . 1 1 36 36 ALA CB C 162 17.490 17.490 18.197 -0.707 18090 972 1 3 . 1 1 36 36 ALA H H 162 7.500 7.500 7.823 -0.323 18090 973 1 3 . 1 1 37 37 LYS N N 163 119.880 119.880 118.529 1.351 18090 974 1 3 . 1 1 37 37 LYS HA H 163 3.570 3.570 3.987 -0.417 18090 975 1 3 . 1 1 37 37 LYS C C 163 177.800 177.800 179.113 -1.313 18090 976 1 3 . 1 1 37 37 LYS CA C 163 58.880 58.880 58.936 -0.056 18090 977 1 3 . 1 1 37 37 LYS CB C 163 31.610 31.610 32.037 -0.427 18090 978 1 3 . 1 1 37 37 LYS H H 163 7.350 7.350 7.412 -0.062 18090 979 1 3 . 1 1 38 38 LEU N N 164 118.020 118.020 119.957 -1.937 18090 980 1 3 . 1 1 38 38 LEU HA H 164 3.670 3.670 4.065 -0.395 18090 981 1 3 . 1 1 38 38 LEU C C 164 179.380 179.380 179.268 0.112 18090 982 1 3 . 1 1 38 38 LEU CA C 164 57.340 57.340 57.729 -0.389 18090 983 1 3 . 1 1 38 38 LEU CB C 164 41.660 41.660 41.704 -0.044 18090 984 1 3 . 1 1 38 38 LEU H H 164 7.660 7.660 8.155 -0.495 18090 985 1 3 . 1 1 39 39 ILE N N 165 118.070 118.070 118.304 -0.234 18090 986 1 3 . 1 1 39 39 ILE HA H 165 3.510 3.510 3.652 -0.142 18090 987 1 3 . 1 1 39 39 ILE C C 165 179.570 179.570 178.205 1.365 18090 988 1 3 . 1 1 39 39 ILE CA C 165 64.450 64.450 65.513 -1.063 18090 989 1 3 . 1 1 39 39 ILE CB C 165 37.310 37.310 37.464 -0.154 18090 990 1 3 . 1 1 39 39 ILE H H 165 8.030 8.030 7.981 0.049 18090 991 1 3 . 1 1 40 40 GLY N N 166 107.970 107.970 108.031 -0.061 18090 992 1 3 . 1 1 40 40 GLY C C 166 176.470 176.470 175.717 0.753 18090 993 1 3 . 1 1 40 40 GLY CA C 166 46.410 46.410 46.969 -0.559 18090 994 1 3 . 1 1 40 40 GLY H H 166 7.590 7.590 7.627 -0.037 18090 995 1 3 . 1 1 41 41 TYR N N 167 121.270 121.270 122.339 -1.069 18090 996 1 3 . 1 1 41 41 TYR HA H 167 4.190 4.190 4.211 -0.021 18090 997 1 3 . 1 1 41 41 TYR C C 167 176.470 176.470 176.229 0.241 18090 998 1 3 . 1 1 41 41 TYR CA C 167 57.130 57.130 60.444 -3.313 18090 999 1 3 . 1 1 41 41 TYR CB C 167 35.950 35.950 38.236 -2.286 18090 1000 1 3 . 1 1 41 41 TYR H H 167 7.350 7.350 7.903 -0.553 18090 1001 1 3 . 1 1 42 42 LYS N N 168 116.520 116.520 116.137 0.383 18090 1002 1 3 . 1 1 42 42 LYS HA H 168 3.820 3.820 4.043 -0.223 18090 1003 1 3 . 1 1 42 42 LYS C C 168 177.810 177.810 177.915 -0.105 18090 1004 1 3 . 1 1 42 42 LYS CA C 168 59.390 59.390 58.419 0.971 18090 1005 1 3 . 1 1 42 42 LYS CB C 168 31.580 31.580 32.749 -1.169 18090 1006 1 3 . 1 1 42 42 LYS H H 168 7.460 7.460 8.262 -0.802 18090 1007 1 3 . 1 1 43 43 GLN N N 169 113.750 113.750 115.995 -2.245 18090 1008 1 3 . 1 1 43 43 GLN HA H 169 4.220 4.220 4.158 0.062 18090 1009 1 3 . 1 1 43 43 GLN C C 169 175.840 175.840 177.389 -1.549 18090 1010 1 3 . 1 1 43 43 GLN CA C 169 56.230 56.230 58.103 -1.873 18090 1011 1 3 . 1 1 43 43 GLN CB C 169 29.290 29.290 29.318 -0.028 18090 1012 1 3 . 1 1 43 43 GLN H H 169 7.220 7.220 7.630 -0.410 18090 1013 1 3 . 1 1 44 44 ASN N N 170 114.130 114.130 116.156 -2.026 18090 1014 1 3 . 1 1 44 44 ASN HA H 170 5.050 5.050 4.936 0.114 18090 1015 1 3 . 1 1 44 44 ASN C C 170 172.200 172.200 173.618 -1.418 18090 1016 1 3 . 1 1 44 44 ASN CA C 170 50.780 50.780 53.380 -2.600 18090 1017 1 3 . 1 1 44 44 ASN CB C 170 38.380 38.380 39.537 -1.157 18090 1018 1 3 . 1 1 44 44 ASN H H 170 7.580 7.580 7.668 -0.088 18090 1019 1 3 . 1 1 45 45 PRO HA H 171 4.130 4.130 4.684 -0.554 18090 1020 1 3 . 1 1 45 45 PRO CA C 171 64.800 64.800 62.102 2.699 18090 1021 1 3 . 1 1 45 45 PRO CB C 171 31.360 31.360 31.956 -0.596 18090 1022 1 3 . 1 1 46 46 GLN N N 172 115.570 115.570 123.920 -8.350 18090 1023 1 3 . 1 1 46 46 GLN HA H 172 3.770 3.770 3.857 -0.087 18090 1024 1 3 . 1 1 46 46 GLN C C 172 177.360 177.360 177.638 -0.278 18090 1025 1 3 . 1 1 46 46 GLN CA C 172 57.950 57.950 58.255 -0.305 18090 1026 1 3 . 1 1 46 46 GLN CB C 172 27.050 27.050 27.649 -0.599 18090 1027 1 3 . 1 1 46 46 GLN H H 172 8.160 8.160 8.716 -0.556 18090 1028 1 3 . 1 1 47 47 ALA N N 173 121.420 121.420 121.620 -0.200 18090 1029 1 3 . 1 1 47 47 ALA HA H 173 4.050 4.050 4.170 -0.120 18090 1030 1 3 . 1 1 47 47 ALA C C 173 178.090 178.090 179.477 -1.387 18090 1031 1 3 . 1 1 47 47 ALA CA C 173 53.490 53.490 54.324 -0.834 18090 1032 1 3 . 1 1 47 47 ALA CB C 173 18.450 18.450 17.634 0.817 18090 1033 1 3 . 1 1 47 47 ALA H H 173 7.470 7.470 8.266 -0.796 18090 1034 1 3 . 1 1 48 48 ILE N N 174 118.050 118.050 118.694 -0.644 18090 1035 1 3 . 1 1 48 48 ILE HA H 174 3.180 3.180 3.888 -0.708 18090 1036 1 3 . 1 1 48 48 ILE C C 174 176.250 176.250 177.886 -1.636 18090 1037 1 3 . 1 1 48 48 ILE CA C 174 64.030 64.030 64.072 -0.042 18090 1038 1 3 . 1 1 48 48 ILE CB C 174 37.280 37.280 37.076 0.204 18090 1039 1 3 . 1 1 48 48 ILE H H 174 7.150 7.150 7.341 -0.191 18090 1040 1 3 . 1 1 49 49 GLY N N 175 105.390 105.390 106.607 -1.217 18090 1041 1 3 . 1 1 49 49 GLY C C 175 174.220 174.220 175.996 -1.776 18090 1042 1 3 . 1 1 49 49 GLY CA C 175 46.700 46.700 47.047 -0.347 18090 1043 1 3 . 1 1 49 49 GLY H H 175 7.550 7.550 7.798 -0.248 18090 1044 1 3 . 1 1 50 50 GLN N N 176 116.230 116.230 118.622 -2.392 18090 1045 1 3 . 1 1 50 50 GLN HA H 176 4.210 4.210 4.615 -0.405 18090 1046 1 3 . 1 1 50 50 GLN C C 176 178.120 178.120 178.305 -0.185 18090 1047 1 3 . 1 1 50 50 GLN CA C 176 57.320 57.320 57.995 -0.675 18090 1048 1 3 . 1 1 50 50 GLN CB C 176 28.630 28.630 29.215 -0.585 18090 1049 1 3 . 1 1 50 50 GLN H H 176 7.390 7.390 7.990 -0.600 18090 1050 1 3 . 1 1 51 51 ASP N N 177 120.000 120.000 121.054 -1.054 18090 1051 1 3 . 1 1 51 51 ASP HA H 177 4.420 4.420 4.644 -0.224 18090 1052 1 3 . 1 1 51 51 ASP C C 177 177.950 177.950 178.311 -0.361 18090 1053 1 3 . 1 1 51 51 ASP CA C 177 55.840 55.840 56.012 -0.172 18090 1054 1 3 . 1 1 51 51 ASP CB C 177 40.310 40.310 40.837 -0.527 18090 1055 1 3 . 1 1 51 51 ASP H H 177 7.870 7.870 7.912 -0.042 18090 1056 1 3 . 1 1 52 52 LEU N N 178 120.010 120.010 120.367 -0.357 18090 1057 1 3 . 1 1 52 52 LEU HA H 178 3.650 3.650 3.979 -0.329 18090 1058 1 3 . 1 1 52 52 LEU C C 178 175.810 175.810 178.246 -2.436 18090 1059 1 3 . 1 1 52 52 LEU CA C 178 57.620 57.620 57.809 -0.188 18090 1060 1 3 . 1 1 52 52 LEU CB C 178 41.880 41.880 41.670 0.210 18090 1061 1 3 . 1 1 52 52 LEU H H 178 7.860 7.860 7.647 0.213 18090 1062 1 3 . 1 1 53 53 PHE N N 179 110.580 110.580 113.773 -3.193 18090 1063 1 3 . 1 1 53 53 PHE HA H 179 4.230 4.230 4.319 -0.089 18090 1064 1 3 . 1 1 53 53 PHE C C 179 176.370 176.370 178.025 -1.655 18090 1065 1 3 . 1 1 53 53 PHE CA C 179 58.730 58.730 60.491 -1.761 18090 1066 1 3 . 1 1 53 53 PHE CB C 179 38.720 38.720 38.901 -0.181 18090 1067 1 3 . 1 1 53 53 PHE H H 179 7.210 7.210 7.857 -0.647 18090 1068 1 3 . 1 1 54 54 THR N N 180 108.190 108.190 107.793 0.397 18090 1069 1 3 . 1 1 54 54 THR HA H 180 4.300 4.300 4.298 0.002 18090 1070 1 3 . 1 1 54 54 THR C C 180 174.400 174.400 174.958 -0.558 18090 1071 1 3 . 1 1 54 54 THR CA C 180 62.020 62.020 62.850 -0.830 18090 1072 1 3 . 1 1 54 54 THR CB C 180 69.730 69.730 69.769 -0.039 18090 1073 1 3 . 1 1 54 54 THR H H 180 7.550 7.550 7.474 0.076 18090 1074 1 3 . 1 1 55 55 ASP N N 181 120.060 120.060 123.072 -3.012 18090 1075 1 3 . 1 1 55 55 ASP HA H 181 5.020 5.020 5.084 -0.064 18090 1076 1 3 . 1 1 55 55 ASP C C 181 174.120 174.120 175.226 -1.106 18090 1077 1 3 . 1 1 55 55 ASP CA C 181 50.560 50.560 50.446 0.114 18090 1078 1 3 . 1 1 55 55 ASP CB C 181 41.190 41.190 43.047 -1.857 18090 1079 1 3 . 1 1 55 55 ASP H H 181 7.480 7.480 7.992 -0.512 18090 1080 1 3 . 1 1 56 56 PRO HA H 182 4.320 4.320 4.337 -0.017 18090 1081 1 3 . 1 1 56 56 PRO CA C 182 64.280 64.280 64.837 -0.557 18090 1082 1 3 . 1 1 56 56 PRO CB C 182 31.980 31.980 32.554 -0.574 18090 1083 1 3 . 1 1 57 57 ARG N N 183 117.660 117.660 117.507 0.153 18090 1084 1 3 . 1 1 57 57 ARG HA H 183 3.960 3.960 4.127 -0.167 18090 1085 1 3 . 1 1 57 57 ARG C C 183 179.030 179.030 178.462 0.568 18090 1086 1 3 . 1 1 57 57 ARG CA C 183 59.000 59.000 58.764 0.236 18090 1087 1 3 . 1 1 57 57 ARG CB C 183 29.750 29.750 29.781 -0.031 18090 1088 1 3 . 1 1 57 57 ARG H H 183 7.920 7.920 8.096 -0.176 18090 1089 1 3 . 1 1 58 58 LEU N N 184 115.670 115.670 119.125 -3.455 18090 1090 1 3 . 1 1 58 58 LEU HA H 184 3.850 3.850 3.944 -0.094 18090 1091 1 3 . 1 1 58 58 LEU C C 184 178.770 178.770 178.941 -0.171 18090 1092 1 3 . 1 1 58 58 LEU CA C 184 57.110 57.110 57.581 -0.471 18090 1093 1 3 . 1 1 58 58 LEU CB C 184 41.310 41.310 41.675 -0.365 18090 1094 1 3 . 1 1 58 58 LEU H H 184 7.750 7.750 7.903 -0.153 18090 1095 1 3 . 1 1 59 59 MET N N 185 118.570 118.570 116.252 2.318 18090 1096 1 3 . 1 1 59 59 MET HA H 185 4.060 4.060 4.132 -0.072 18090 1097 1 3 . 1 1 59 59 MET C C 185 177.540 177.540 178.195 -0.655 18090 1098 1 3 . 1 1 59 59 MET CA C 185 58.090 58.090 59.310 -1.220 18090 1099 1 3 . 1 1 59 59 MET CB C 185 31.270 31.270 32.185 -0.915 18090 1100 1 3 . 1 1 59 59 MET H H 185 7.590 7.590 7.674 -0.084 18090 1101 1 3 . 1 1 60 60 THR N N 186 116.390 116.390 117.362 -0.972 18090 1102 1 3 . 1 1 60 60 THR HA H 186 3.680 3.680 4.007 -0.327 18090 1103 1 3 . 1 1 60 60 THR C C 186 177.440 177.440 176.703 0.737 18090 1104 1 3 . 1 1 60 60 THR CA C 186 66.940 66.940 66.383 0.557 18090 1105 1 3 . 1 1 60 60 THR CB C 186 68.030 68.030 68.143 -0.113 18090 1106 1 3 . 1 1 60 60 THR H H 186 7.180 7.180 7.770 -0.590 18090 1107 1 3 . 1 1 61 61 ILE N N 187 123.840 123.840 122.125 1.715 18090 1108 1 3 . 1 1 61 61 ILE HA H 187 3.290 3.290 3.771 -0.481 18090 1109 1 3 . 1 1 61 61 ILE C C 187 176.660 176.660 178.231 -1.571 18090 1110 1 3 . 1 1 61 61 ILE CA C 187 65.850 65.850 65.441 0.409 18090 1111 1 3 . 1 1 61 61 ILE CB C 187 37.640 37.640 37.754 -0.114 18090 1112 1 3 . 1 1 61 61 ILE H H 187 8.010 8.010 7.822 0.188 18090 1113 1 3 . 1 1 62 62 MET N N 188 118.210 118.210 118.290 -0.080 18090 1114 1 3 . 1 1 62 62 MET HA H 188 3.910 3.910 3.997 -0.087 18090 1115 1 3 . 1 1 62 62 MET C C 188 177.540 177.540 178.461 -0.921 18090 1116 1 3 . 1 1 62 62 MET CA C 188 58.530 58.530 58.873 -0.343 18090 1117 1 3 . 1 1 62 62 MET CB C 188 31.200 31.200 31.499 -0.299 18090 1118 1 3 . 1 1 62 62 MET H H 188 8.560 8.560 7.424 1.136 18090 1119 1 3 . 1 1 63 63 ALA N N 189 119.850 119.850 122.030 -2.180 18090 1120 1 3 . 1 1 63 63 ALA HA H 189 3.730 3.730 3.926 -0.196 18090 1121 1 3 . 1 1 63 63 ALA C C 189 179.550 179.550 179.259 0.291 18090 1122 1 3 . 1 1 63 63 ALA CA C 189 55.470 55.470 55.375 0.095 18090 1123 1 3 . 1 1 63 63 ALA CB C 189 17.640 17.640 18.218 -0.579 18090 1124 1 3 . 1 1 63 63 ALA H H 189 8.210 8.210 8.194 0.016 18090 1125 1 3 . 1 1 64 64 THR N N 190 114.570 114.570 113.717 0.853 18090 1126 1 3 . 1 1 64 64 THR HA H 190 3.790 3.790 3.915 -0.125 18090 1127 1 3 . 1 1 64 64 THR C C 190 177.640 177.640 176.926 0.714 18090 1128 1 3 . 1 1 64 64 THR CA C 190 66.690 66.690 66.141 0.549 18090 1129 1 3 . 1 1 64 64 THR CB C 190 68.310 68.310 68.552 -0.242 18090 1130 1 3 . 1 1 64 64 THR H H 190 7.740 7.740 7.578 0.162 18090 1131 1 3 . 1 1 65 65 LEU N N 191 122.410 122.410 121.478 0.932 18090 1132 1 3 . 1 1 65 65 LEU HA H 191 3.930 3.930 3.960 -0.030 18090 1133 1 3 . 1 1 65 65 LEU C C 191 178.470 178.470 179.581 -1.111 18090 1134 1 3 . 1 1 65 65 LEU CA C 191 57.120 57.120 58.028 -0.908 18090 1135 1 3 . 1 1 65 65 LEU CB C 191 41.830 41.830 41.789 0.041 18090 1136 1 3 . 1 1 65 65 LEU H H 191 8.180 8.180 7.636 0.544 18090 1137 1 3 . 1 1 66 66 MET N N 192 115.320 115.320 117.153 -1.833 18090 1138 1 3 . 1 1 66 66 MET HA H 192 4.090 4.090 4.304 -0.214 18090 1139 1 3 . 1 1 66 66 MET C C 192 176.090 176.090 178.275 -2.185 18090 1140 1 3 . 1 1 66 66 MET CA C 192 56.390 56.390 57.400 -1.010 18090 1141 1 3 . 1 1 66 66 MET CB C 192 33.770 33.770 31.890 1.880 18090 1142 1 3 . 1 1 66 66 MET H H 192 7.880 7.880 8.463 -0.583 18090 1143 1 3 . 1 1 67 67 GLY N N 193 107.490 107.490 105.105 2.385 18090 1144 1 3 . 1 1 67 67 GLY C C 193 174.390 174.390 174.927 -0.537 18090 1145 1 3 . 1 1 67 67 GLY CA C 193 45.880 45.880 45.149 0.731 18090 1146 1 3 . 1 1 67 67 GLY H H 193 7.580 7.580 8.165 -0.585 18090 1147 1 3 . 1 1 68 68 VAL N N 194 118.520 118.520 116.751 1.769 18090 1148 1 3 . 1 1 68 68 VAL HA H 194 3.940 3.940 3.636 0.304 18090 1149 1 3 . 1 1 68 68 VAL C C 194 174.760 174.760 175.971 -1.211 18090 1150 1 3 . 1 1 68 68 VAL CA C 194 61.510 61.510 63.979 -2.469 18090 1151 1 3 . 1 1 68 68 VAL CB C 194 32.670 32.670 29.668 3.002 18090 1152 1 3 . 1 1 68 68 VAL H H 194 7.840 7.840 7.457 0.383 18090 1153 1 3 . 1 1 69 69 ASP N N 195 124.550 124.550 119.721 4.829 18090 1154 1 3 . 1 1 69 69 ASP HA H 195 4.430 4.430 4.545 -0.115 18090 1155 1 3 . 1 1 69 69 ASP C C 195 175.140 175.140 176.730 -1.590 18090 1156 1 3 . 1 1 69 69 ASP CA C 195 53.760 53.760 55.770 -2.010 18090 1157 1 3 . 1 1 69 69 ASP CB C 195 40.920 40.920 41.058 -0.138 18090 1158 1 3 . 1 1 69 69 ASP H H 195 8.400 8.400 8.010 0.390 18090 1159 1 3 . 1 1 70 70 LEU N N 196 123.930 123.930 119.758 4.172 18090 1160 1 3 . 1 1 70 70 LEU HA H 196 4.200 4.200 4.179 0.021 18090 1161 1 3 . 1 1 70 70 LEU C C 196 175.950 175.950 177.292 -1.342 18090 1162 1 3 . 1 1 70 70 LEU CA C 196 54.380 54.380 56.438 -2.058 18090 1163 1 3 . 1 1 70 70 LEU CB C 196 41.610 41.610 42.256 -0.646 18090 1164 1 3 . 1 1 70 70 LEU H H 196 8.160 8.160 7.454 0.706 18090 1165 1 4 . 1 1 2 2 PRO HA H 128 4.220 4.220 4.469 -0.249 18090 1166 1 4 . 1 1 2 2 PRO CA C 128 63.320 63.320 63.632 -0.312 18090 1167 1 4 . 1 1 2 2 PRO CB C 128 31.680 31.680 31.832 -0.152 18090 1168 1 4 . 1 1 3 3 ASP N N 129 119.320 119.320 119.967 -0.647 18090 1169 1 4 . 1 1 3 3 ASP HA H 129 4.400 4.400 4.425 -0.025 18090 1170 1 4 . 1 1 3 3 ASP C C 129 176.120 176.120 175.058 1.062 18090 1171 1 4 . 1 1 3 3 ASP CA C 129 54.050 54.050 54.760 -0.709 18090 1172 1 4 . 1 1 3 3 ASP CB C 129 40.770 40.770 41.021 -0.251 18090 1173 1 4 . 1 1 3 3 ASP H H 129 8.310 8.310 8.354 -0.044 18090 1174 1 4 . 1 1 4 4 LEU N N 130 122.280 122.280 121.596 0.684 18090 1175 1 4 . 1 1 4 4 LEU HA H 130 4.130 4.130 4.477 -0.347 18090 1176 1 4 . 1 1 4 4 LEU C C 130 177.280 177.280 176.443 0.837 18090 1177 1 4 . 1 1 4 4 LEU CA C 130 55.350 55.350 54.035 1.315 18090 1178 1 4 . 1 1 4 4 LEU CB C 130 41.490 41.490 45.192 -3.702 18090 1179 1 4 . 1 1 4 4 LEU H H 130 8.080 8.080 7.963 0.117 18090 1180 1 4 . 1 1 5 5 GLY N N 131 107.830 107.830 107.921 -0.091 18090 1181 1 4 . 1 1 5 5 GLY C C 131 175.120 175.120 172.997 2.123 18090 1182 1 4 . 1 1 5 5 GLY CA C 131 45.300 45.300 45.593 -0.293 18090 1183 1 4 . 1 1 5 5 GLY H H 131 8.180 8.180 8.232 -0.052 18090 1184 1 4 . 1 1 6 6 LEU N N 132 121.080 121.080 118.373 2.707 18090 1185 1 4 . 1 1 6 6 LEU HA H 132 3.870 3.870 4.432 -0.562 18090 1186 1 4 . 1 1 6 6 LEU C C 132 178.000 178.000 177.629 0.371 18090 1187 1 4 . 1 1 6 6 LEU CA C 132 57.180 57.180 53.616 3.564 18090 1188 1 4 . 1 1 6 6 LEU CB C 132 41.870 41.870 45.475 -3.605 18090 1189 1 4 . 1 1 6 6 LEU H H 132 8.150 8.150 7.671 0.479 18090 1190 1 4 . 1 1 7 7 THR N N 133 111.580 111.580 113.708 -2.128 18090 1191 1 4 . 1 1 7 7 THR HA H 133 3.730 3.730 4.023 -0.293 18090 1192 1 4 . 1 1 7 7 THR C C 133 176.530 176.530 176.161 0.369 18090 1193 1 4 . 1 1 7 7 THR CA C 133 65.940 65.940 66.028 -0.087 18090 1194 1 4 . 1 1 7 7 THR CB C 133 68.130 68.130 68.513 -0.383 18090 1195 1 4 . 1 1 7 7 THR H H 133 7.970 7.970 8.504 -0.534 18090 1196 1 4 . 1 1 8 8 GLN N N 134 119.490 119.490 120.151 -0.661 18090 1197 1 4 . 1 1 8 8 GLN HA H 134 3.990 3.990 3.935 0.055 18090 1198 1 4 . 1 1 8 8 GLN C C 134 178.190 178.190 178.417 -0.227 18090 1199 1 4 . 1 1 8 8 GLN CA C 134 57.930 57.930 59.099 -1.169 18090 1200 1 4 . 1 1 8 8 GLN CB C 134 27.850 27.850 28.025 -0.175 18090 1201 1 4 . 1 1 8 8 GLN H H 134 7.890 7.890 8.462 -0.572 18090 1202 1 4 . 1 1 9 9 LEU N N 135 120.170 120.170 119.223 0.947 18090 1203 1 4 . 1 1 9 9 LEU HA H 135 3.820 3.820 3.918 -0.098 18090 1204 1 4 . 1 1 9 9 LEU C C 135 177.810 177.810 178.822 -1.012 18090 1205 1 4 . 1 1 9 9 LEU CA C 135 57.470 57.470 57.383 0.087 18090 1206 1 4 . 1 1 9 9 LEU CB C 135 41.640 41.640 41.643 -0.003 18090 1207 1 4 . 1 1 9 9 LEU H H 135 7.600 7.600 7.313 0.287 18090 1208 1 4 . 1 1 10 10 PHE N N 136 111.950 111.950 113.777 -1.827 18090 1209 1 4 . 1 1 10 10 PHE HA H 136 4.380 4.380 4.465 -0.085 18090 1210 1 4 . 1 1 10 10 PHE C C 136 174.990 174.990 177.420 -2.430 18090 1211 1 4 . 1 1 10 10 PHE CA C 136 58.450 58.450 57.653 0.797 18090 1212 1 4 . 1 1 10 10 PHE CB C 136 38.570 38.570 37.310 1.260 18090 1213 1 4 . 1 1 10 10 PHE H H 136 7.410 7.410 6.707 0.703 18090 1214 1 4 . 1 1 11 11 ALA N N 137 120.230 120.230 122.027 -1.797 18090 1215 1 4 . 1 1 11 11 ALA HA H 137 4.130 4.130 4.083 0.047 18090 1216 1 4 . 1 1 11 11 ALA C C 137 177.090 177.090 178.254 -1.164 18090 1217 1 4 . 1 1 11 11 ALA CA C 137 52.580 52.580 53.493 -0.913 18090 1218 1 4 . 1 1 11 11 ALA CB C 137 18.660 18.660 18.728 -0.068 18090 1219 1 4 . 1 1 11 11 ALA H H 137 7.330 7.330 8.504 -1.174 18090 1220 1 4 . 1 1 12 12 ASP N N 138 119.830 119.830 120.977 -1.147 18090 1221 1 4 . 1 1 12 12 ASP HA H 138 4.510 4.510 4.740 -0.230 18090 1222 1 4 . 1 1 12 12 ASP C C 138 176.370 176.370 174.810 1.560 18090 1223 1 4 . 1 1 12 12 ASP CA C 138 51.960 51.960 52.948 -0.988 18090 1224 1 4 . 1 1 12 12 ASP CB C 138 41.990 41.990 41.576 0.414 18090 1225 1 4 . 1 1 12 12 ASP H H 138 6.980 6.980 7.625 -0.645 18090 1226 1 4 . 1 1 13 13 PRO HA H 139 4.260 4.260 4.422 -0.162 18090 1227 1 4 . 1 1 13 13 PRO CA C 139 64.350 64.350 63.188 1.163 18090 1228 1 4 . 1 1 13 13 PRO CB C 139 31.760 31.760 32.286 -0.526 18090 1229 1 4 . 1 1 14 14 ASN N N 140 116.840 116.840 118.166 -1.326 18090 1230 1 4 . 1 1 14 14 ASN HA H 140 4.840 4.840 4.472 0.368 18090 1231 1 4 . 1 1 14 14 ASN C C 140 173.840 173.840 175.681 -1.841 18090 1232 1 4 . 1 1 14 14 ASN CA C 140 52.380 52.380 54.050 -1.669 18090 1233 1 4 . 1 1 14 14 ASN CB C 140 38.330 38.330 36.839 1.492 18090 1234 1 4 . 1 1 14 14 ASN H H 140 8.670 8.670 8.719 -0.049 18090 1235 1 4 . 1 1 15 15 LEU N N 141 120.290 120.290 120.427 -0.137 18090 1236 1 4 . 1 1 15 15 LEU HA H 141 3.790 3.790 4.534 -0.744 18090 1237 1 4 . 1 1 15 15 LEU C C 141 177.120 177.120 177.528 -0.408 18090 1238 1 4 . 1 1 15 15 LEU CA C 141 59.280 59.280 55.581 3.699 18090 1239 1 4 . 1 1 15 15 LEU CB C 141 42.980 42.980 43.149 -0.169 18090 1240 1 4 . 1 1 15 15 LEU H H 141 7.200 7.200 8.427 -1.227 18090 1241 1 4 . 1 1 16 16 ILE N N 142 115.290 115.290 120.274 -4.984 18090 1242 1 4 . 1 1 16 16 ILE HA H 142 3.480 3.480 3.724 -0.244 18090 1243 1 4 . 1 1 16 16 ILE C C 142 177.990 177.990 177.500 0.490 18090 1244 1 4 . 1 1 16 16 ILE CA C 142 62.690 62.690 65.366 -2.676 18090 1245 1 4 . 1 1 16 16 ILE CB C 142 34.620 34.620 37.642 -3.022 18090 1246 1 4 . 1 1 16 16 ILE H H 142 7.940 7.940 8.298 -0.358 18090 1247 1 4 . 1 1 17 17 GLU N N 143 119.600 119.600 119.032 0.568 18090 1248 1 4 . 1 1 17 17 GLU HA H 143 3.700 3.700 3.991 -0.291 18090 1249 1 4 . 1 1 17 17 GLU C C 143 179.170 179.170 178.726 0.444 18090 1250 1 4 . 1 1 17 17 GLU CA C 143 59.360 59.360 60.093 -0.733 18090 1251 1 4 . 1 1 17 17 GLU CB C 143 28.520 28.520 29.216 -0.696 18090 1252 1 4 . 1 1 17 17 GLU H H 143 7.970 7.970 8.549 -0.579 18090 1253 1 4 . 1 1 18 18 ASN N N 144 117.170 117.170 117.338 -0.168 18090 1254 1 4 . 1 1 18 18 ASN HA H 144 4.270 4.270 4.429 -0.159 18090 1255 1 4 . 1 1 18 18 ASN C C 144 179.120 179.120 177.614 1.506 18090 1256 1 4 . 1 1 18 18 ASN CA C 144 55.490 55.490 55.761 -0.272 18090 1257 1 4 . 1 1 18 18 ASN CB C 144 36.550 36.550 37.843 -1.292 18090 1258 1 4 . 1 1 18 18 ASN H H 144 8.450 8.450 8.376 0.074 18090 1259 1 4 . 1 1 19 19 LEU N N 145 121.060 121.060 118.984 2.076 18090 1260 1 4 . 1 1 19 19 LEU HA H 145 4.020 4.020 4.031 -0.011 18090 1261 1 4 . 1 1 19 19 LEU C C 145 180.260 180.260 178.194 2.066 18090 1262 1 4 . 1 1 19 19 LEU CA C 145 56.620 56.620 57.060 -0.441 18090 1263 1 4 . 1 1 19 19 LEU CB C 145 41.780 41.780 41.514 0.266 18090 1264 1 4 . 1 1 19 19 LEU H H 145 7.990 7.990 7.515 0.475 18090 1265 1 4 . 1 1 20 20 LYS N N 146 118.960 118.960 117.659 1.301 18090 1266 1 4 . 1 1 20 20 LYS HA H 146 3.610 3.610 3.969 -0.359 18090 1267 1 4 . 1 1 20 20 LYS C C 146 177.390 177.390 178.463 -1.073 18090 1268 1 4 . 1 1 20 20 LYS CA C 146 59.640 59.640 59.377 0.263 18090 1269 1 4 . 1 1 20 20 LYS CB C 146 32.450 32.450 32.278 0.172 18090 1270 1 4 . 1 1 20 20 LYS H H 146 8.250 8.250 7.840 0.410 18090 1271 1 4 . 1 1 21 21 LYS N N 147 114.720 114.720 116.800 -2.080 18090 1272 1 4 . 1 1 21 21 LYS HA H 147 4.110 4.110 4.213 -0.103 18090 1273 1 4 . 1 1 21 21 LYS C C 147 175.880 175.880 178.282 -2.402 18090 1274 1 4 . 1 1 21 21 LYS CA C 147 56.210 56.210 58.367 -2.157 18090 1275 1 4 . 1 1 21 21 LYS CB C 147 33.000 33.000 32.663 0.336 18090 1276 1 4 . 1 1 21 21 LYS H H 147 7.130 7.130 7.640 -0.510 18090 1277 1 4 . 1 1 22 22 ASN N N 148 122.180 122.180 115.261 6.919 18090 1278 1 4 . 1 1 22 22 ASN HA H 148 4.740 4.740 4.917 -0.177 18090 1279 1 4 . 1 1 22 22 ASN C C 148 174.000 174.000 173.487 0.513 18090 1280 1 4 . 1 1 22 22 ASN CA C 148 50.970 50.970 52.691 -1.720 18090 1281 1 4 . 1 1 22 22 ASN CB C 148 38.670 38.670 39.007 -0.337 18090 1282 1 4 . 1 1 22 22 ASN H H 148 6.930 6.930 7.886 -0.956 18090 1283 1 4 . 1 1 23 23 PRO HA H 149 4.300 4.300 4.699 -0.399 18090 1284 1 4 . 1 1 23 23 PRO CA C 149 64.610 64.610 61.987 2.623 18090 1285 1 4 . 1 1 23 23 PRO CB C 149 32.000 32.000 34.192 -2.192 18090 1286 1 4 . 1 1 24 24 LYS N N 150 116.060 116.060 121.294 -5.234 18090 1287 1 4 . 1 1 24 24 LYS HA H 150 4.070 4.070 3.938 0.132 18090 1288 1 4 . 1 1 24 24 LYS C C 150 178.240 178.240 178.546 -0.306 18090 1289 1 4 . 1 1 24 24 LYS CA C 150 57.950 57.950 59.694 -1.744 18090 1290 1 4 . 1 1 24 24 LYS CB C 150 32.590 32.590 31.899 0.691 18090 1291 1 4 . 1 1 24 24 LYS H H 150 8.520 8.520 8.823 -0.303 18090 1292 1 4 . 1 1 25 25 THR N N 151 105.190 105.190 109.934 -4.744 18090 1293 1 4 . 1 1 25 25 THR HA H 151 4.390 4.390 4.045 0.345 18090 1294 1 4 . 1 1 25 25 THR C C 151 176.090 176.090 176.390 -0.300 18090 1295 1 4 . 1 1 25 25 THR CA C 151 61.400 61.400 64.629 -3.228 18090 1296 1 4 . 1 1 25 25 THR CB C 151 69.440 69.440 67.784 1.656 18090 1297 1 4 . 1 1 25 25 THR H H 151 7.490 7.490 8.152 -0.662 18090 1298 1 4 . 1 1 26 26 SER N N 152 119.700 119.700 116.478 3.222 18090 1299 1 4 . 1 1 26 26 SER HA H 152 3.770 3.770 4.142 -0.372 18090 1300 1 4 . 1 1 26 26 SER C C 152 177.470 177.470 176.001 1.469 18090 1301 1 4 . 1 1 26 26 SER CA C 152 62.450 62.450 61.420 1.030 18090 1302 1 4 . 1 1 26 26 SER CB C 152 62.520 62.520 62.754 -0.234 18090 1303 1 4 . 1 1 26 26 SER H H 152 8.190 8.190 7.980 0.210 18090 1304 1 4 . 1 1 27 27 GLU N N 153 119.870 119.870 122.668 -2.798 18090 1305 1 4 . 1 1 27 27 GLU HA H 153 3.890 3.890 3.963 -0.073 18090 1306 1 4 . 1 1 27 27 GLU C C 153 180.040 180.040 178.725 1.315 18090 1307 1 4 . 1 1 27 27 GLU CA C 153 58.700 58.700 59.344 -0.645 18090 1308 1 4 . 1 1 27 27 GLU CB C 153 28.590 28.590 29.445 -0.855 18090 1309 1 4 . 1 1 27 27 GLU H H 153 8.350 8.350 7.870 0.480 18090 1310 1 4 . 1 1 28 28 MET N N 154 119.430 119.430 117.129 2.301 18090 1311 1 4 . 1 1 28 28 MET HA H 154 4.040 4.040 4.159 -0.119 18090 1312 1 4 . 1 1 28 28 MET C C 154 177.110 177.110 178.156 -1.046 18090 1313 1 4 . 1 1 28 28 MET CA C 154 58.510 58.510 58.738 -0.228 18090 1314 1 4 . 1 1 28 28 MET CB C 154 31.430 31.430 32.734 -1.304 18090 1315 1 4 . 1 1 28 28 MET H H 154 7.850 7.850 7.559 0.291 18090 1316 1 4 . 1 1 29 29 MET N N 155 112.640 112.640 114.116 -1.476 18090 1317 1 4 . 1 1 29 29 MET HA H 155 4.340 4.340 4.255 0.085 18090 1318 1 4 . 1 1 29 29 MET C C 155 175.530 175.530 177.815 -2.285 18090 1319 1 4 . 1 1 29 29 MET CA C 155 53.790 53.790 57.172 -3.382 18090 1320 1 4 . 1 1 29 29 MET CB C 155 30.380 30.380 32.032 -1.652 18090 1321 1 4 . 1 1 29 29 MET H H 155 7.200 7.200 7.380 -0.180 18090 1322 1 4 . 1 1 30 30 LYS N N 156 117.050 117.050 116.716 0.334 18090 1323 1 4 . 1 1 30 30 LYS HA H 156 3.960 3.960 4.258 -0.298 18090 1324 1 4 . 1 1 30 30 LYS C C 156 176.120 176.120 177.163 -1.043 18090 1325 1 4 . 1 1 30 30 LYS CA C 156 57.090 57.090 57.356 -0.266 18090 1326 1 4 . 1 1 30 30 LYS CB C 156 31.960 31.960 32.917 -0.957 18090 1327 1 4 . 1 1 30 30 LYS H H 156 7.130 7.130 7.636 -0.506 18090 1328 1 4 . 1 1 31 31 ASP N N 157 119.810 119.810 118.438 1.372 18090 1329 1 4 . 1 1 31 31 ASP HA H 157 4.860 4.860 4.981 -0.121 18090 1330 1 4 . 1 1 31 31 ASP C C 157 174.890 174.890 174.502 0.388 18090 1331 1 4 . 1 1 31 31 ASP CA C 157 50.520 50.520 54.218 -3.698 18090 1332 1 4 . 1 1 31 31 ASP CB C 157 41.010 41.010 40.508 0.502 18090 1333 1 4 . 1 1 31 31 ASP H H 157 7.340 7.340 7.747 -0.407 18090 1334 1 4 . 1 1 32 32 PRO HA H 158 4.130 4.130 4.476 -0.346 18090 1335 1 4 . 1 1 32 32 PRO CA C 158 64.270 64.270 62.915 1.355 18090 1336 1 4 . 1 1 32 32 PRO CB C 158 31.770 31.770 32.397 -0.627 18090 1337 1 4 . 1 1 33 33 GLN N N 159 117.760 117.760 120.246 -2.486 18090 1338 1 4 . 1 1 33 33 GLN HA H 159 4.000 4.000 4.038 -0.038 18090 1339 1 4 . 1 1 33 33 GLN C C 159 178.740 178.740 177.947 0.793 18090 1340 1 4 . 1 1 33 33 GLN CA C 159 58.220 58.220 58.051 0.169 18090 1341 1 4 . 1 1 33 33 GLN CB C 159 27.870 27.870 28.069 -0.199 18090 1342 1 4 . 1 1 33 33 GLN H H 159 8.150 8.150 8.769 -0.619 18090 1343 1 4 . 1 1 34 34 LEU N N 160 123.300 123.300 120.049 3.251 18090 1344 1 4 . 1 1 34 34 LEU HA H 160 3.970 3.970 4.007 -0.037 18090 1345 1 4 . 1 1 34 34 LEU C C 160 177.980 177.980 178.144 -0.164 18090 1346 1 4 . 1 1 34 34 LEU CA C 160 57.050 57.050 57.267 -0.217 18090 1347 1 4 . 1 1 34 34 LEU CB C 160 40.760 40.760 41.668 -0.908 18090 1348 1 4 . 1 1 34 34 LEU H H 160 7.110 7.110 7.986 -0.876 18090 1349 1 4 . 1 1 35 35 VAL N N 161 118.390 118.390 119.422 -1.032 18090 1350 1 4 . 1 1 35 35 VAL HA H 161 3.110 3.110 3.499 -0.389 18090 1351 1 4 . 1 1 35 35 VAL C C 161 176.840 176.840 177.660 -0.820 18090 1352 1 4 . 1 1 35 35 VAL CA C 161 67.700 67.700 66.975 0.725 18090 1353 1 4 . 1 1 35 35 VAL CB C 161 31.260 31.260 31.331 -0.071 18090 1354 1 4 . 1 1 35 35 VAL H H 161 7.430 7.430 7.412 0.018 18090 1355 1 4 . 1 1 36 36 ALA N N 162 117.600 117.600 121.223 -3.623 18090 1356 1 4 . 1 1 36 36 ALA HA H 162 3.810 3.810 3.945 -0.135 18090 1357 1 4 . 1 1 36 36 ALA C C 162 180.620 180.620 179.615 1.005 18090 1358 1 4 . 1 1 36 36 ALA CA C 162 54.720 54.720 55.326 -0.606 18090 1359 1 4 . 1 1 36 36 ALA CB C 162 17.490 17.490 18.100 -0.610 18090 1360 1 4 . 1 1 36 36 ALA H H 162 7.500 7.500 7.777 -0.277 18090 1361 1 4 . 1 1 37 37 LYS N N 163 119.880 119.880 118.522 1.358 18090 1362 1 4 . 1 1 37 37 LYS HA H 163 3.570 3.570 3.987 -0.417 18090 1363 1 4 . 1 1 37 37 LYS C C 163 177.800 177.800 179.108 -1.308 18090 1364 1 4 . 1 1 37 37 LYS CA C 163 58.880 58.880 58.938 -0.058 18090 1365 1 4 . 1 1 37 37 LYS CB C 163 31.610 31.610 32.033 -0.423 18090 1366 1 4 . 1 1 37 37 LYS H H 163 7.350 7.350 7.412 -0.062 18090 1367 1 4 . 1 1 38 38 LEU N N 164 118.020 118.020 119.957 -1.937 18090 1368 1 4 . 1 1 38 38 LEU HA H 164 3.670 3.670 4.064 -0.394 18090 1369 1 4 . 1 1 38 38 LEU C C 164 179.380 179.380 179.279 0.101 18090 1370 1 4 . 1 1 38 38 LEU CA C 164 57.340 57.340 57.722 -0.382 18090 1371 1 4 . 1 1 38 38 LEU CB C 164 41.660 41.660 41.719 -0.060 18090 1372 1 4 . 1 1 38 38 LEU H H 164 7.660 7.660 8.140 -0.480 18090 1373 1 4 . 1 1 39 39 ILE N N 165 118.070 118.070 118.277 -0.207 18090 1374 1 4 . 1 1 39 39 ILE HA H 165 3.510 3.510 3.656 -0.146 18090 1375 1 4 . 1 1 39 39 ILE C C 165 179.570 179.570 178.193 1.377 18090 1376 1 4 . 1 1 39 39 ILE CA C 165 64.450 64.450 65.513 -1.063 18090 1377 1 4 . 1 1 39 39 ILE CB C 165 37.310 37.310 37.456 -0.146 18090 1378 1 4 . 1 1 39 39 ILE H H 165 8.030 8.030 7.971 0.059 18090 1379 1 4 . 1 1 40 40 GLY N N 166 107.970 107.970 108.064 -0.094 18090 1380 1 4 . 1 1 40 40 GLY C C 166 176.470 176.470 175.720 0.750 18090 1381 1 4 . 1 1 40 40 GLY CA C 166 46.410 46.410 46.968 -0.558 18090 1382 1 4 . 1 1 40 40 GLY H H 166 7.590 7.590 7.639 -0.049 18090 1383 1 4 . 1 1 41 41 TYR N N 167 121.270 121.270 122.334 -1.064 18090 1384 1 4 . 1 1 41 41 TYR HA H 167 4.190 4.190 4.208 -0.018 18090 1385 1 4 . 1 1 41 41 TYR C C 167 176.470 176.470 176.228 0.242 18090 1386 1 4 . 1 1 41 41 TYR CA C 167 57.130 57.130 60.482 -3.352 18090 1387 1 4 . 1 1 41 41 TYR CB C 167 35.950 35.950 38.244 -2.294 18090 1388 1 4 . 1 1 41 41 TYR H H 167 7.350 7.350 7.919 -0.569 18090 1389 1 4 . 1 1 42 42 LYS N N 168 116.520 116.520 116.167 0.353 18090 1390 1 4 . 1 1 42 42 LYS HA H 168 3.820 3.820 4.041 -0.221 18090 1391 1 4 . 1 1 42 42 LYS C C 168 177.810 177.810 177.922 -0.112 18090 1392 1 4 . 1 1 42 42 LYS CA C 168 59.390 59.390 58.462 0.928 18090 1393 1 4 . 1 1 42 42 LYS CB C 168 31.580 31.580 32.745 -1.165 18090 1394 1 4 . 1 1 42 42 LYS H H 168 7.460 7.460 8.244 -0.784 18090 1395 1 4 . 1 1 43 43 GLN N N 169 113.750 113.750 116.064 -2.314 18090 1396 1 4 . 1 1 43 43 GLN HA H 169 4.220 4.220 4.174 0.046 18090 1397 1 4 . 1 1 43 43 GLN C C 169 175.840 175.840 177.286 -1.446 18090 1398 1 4 . 1 1 43 43 GLN CA C 169 56.230 56.230 58.197 -1.967 18090 1399 1 4 . 1 1 43 43 GLN CB C 169 29.290 29.290 29.335 -0.045 18090 1400 1 4 . 1 1 43 43 GLN H H 169 7.220 7.220 7.702 -0.482 18090 1401 1 4 . 1 1 44 44 ASN N N 170 114.130 114.130 116.072 -1.942 18090 1402 1 4 . 1 1 44 44 ASN HA H 170 5.050 5.050 4.982 0.068 18090 1403 1 4 . 1 1 44 44 ASN C C 170 172.200 172.200 173.642 -1.442 18090 1404 1 4 . 1 1 44 44 ASN CA C 170 50.780 50.780 53.452 -2.672 18090 1405 1 4 . 1 1 44 44 ASN CB C 170 38.380 38.380 39.882 -1.502 18090 1406 1 4 . 1 1 44 44 ASN H H 170 7.580 7.580 7.605 -0.025 18090 1407 1 4 . 1 1 45 45 PRO HA H 171 4.130 4.130 4.694 -0.564 18090 1408 1 4 . 1 1 45 45 PRO CA C 171 64.800 64.800 62.221 2.579 18090 1409 1 4 . 1 1 45 45 PRO CB C 171 31.360 31.360 31.784 -0.424 18090 1410 1 4 . 1 1 46 46 GLN N N 172 115.570 115.570 123.926 -8.356 18090 1411 1 4 . 1 1 46 46 GLN HA H 172 3.770 3.770 3.856 -0.086 18090 1412 1 4 . 1 1 46 46 GLN C C 172 177.360 177.360 177.633 -0.273 18090 1413 1 4 . 1 1 46 46 GLN CA C 172 57.950 57.950 58.253 -0.303 18090 1414 1 4 . 1 1 46 46 GLN CB C 172 27.050 27.050 27.655 -0.605 18090 1415 1 4 . 1 1 46 46 GLN H H 172 8.160 8.160 8.706 -0.546 18090 1416 1 4 . 1 1 47 47 ALA N N 173 121.420 121.420 121.620 -0.200 18090 1417 1 4 . 1 1 47 47 ALA HA H 173 4.050 4.050 4.167 -0.117 18090 1418 1 4 . 1 1 47 47 ALA C C 173 178.090 178.090 179.453 -1.363 18090 1419 1 4 . 1 1 47 47 ALA CA C 173 53.490 53.490 54.305 -0.815 18090 1420 1 4 . 1 1 47 47 ALA CB C 173 18.450 18.450 17.619 0.832 18090 1421 1 4 . 1 1 47 47 ALA H H 173 7.470 7.470 8.262 -0.792 18090 1422 1 4 . 1 1 48 48 ILE N N 174 118.050 118.050 118.688 -0.638 18090 1423 1 4 . 1 1 48 48 ILE HA H 174 3.180 3.180 3.868 -0.688 18090 1424 1 4 . 1 1 48 48 ILE C C 174 176.250 176.250 177.863 -1.613 18090 1425 1 4 . 1 1 48 48 ILE CA C 174 64.030 64.030 64.046 -0.017 18090 1426 1 4 . 1 1 48 48 ILE CB C 174 37.280 37.280 37.074 0.206 18090 1427 1 4 . 1 1 48 48 ILE H H 174 7.150 7.150 7.340 -0.190 18090 1428 1 4 . 1 1 49 49 GLY N N 175 105.390 105.390 106.624 -1.234 18090 1429 1 4 . 1 1 49 49 GLY C C 175 174.220 174.220 176.007 -1.787 18090 1430 1 4 . 1 1 49 49 GLY CA C 175 46.700 46.700 47.040 -0.340 18090 1431 1 4 . 1 1 49 49 GLY H H 175 7.550 7.550 7.788 -0.238 18090 1432 1 4 . 1 1 50 50 GLN N N 176 116.230 116.230 118.673 -2.443 18090 1433 1 4 . 1 1 50 50 GLN HA H 176 4.210 4.210 4.590 -0.380 18090 1434 1 4 . 1 1 50 50 GLN C C 176 178.120 178.120 178.323 -0.203 18090 1435 1 4 . 1 1 50 50 GLN CA C 176 57.320 57.320 58.017 -0.697 18090 1436 1 4 . 1 1 50 50 GLN CB C 176 28.630 28.630 29.208 -0.578 18090 1437 1 4 . 1 1 50 50 GLN H H 176 7.390 7.390 7.992 -0.602 18090 1438 1 4 . 1 1 51 51 ASP N N 177 120.000 120.000 120.986 -0.986 18090 1439 1 4 . 1 1 51 51 ASP HA H 177 4.420 4.420 4.638 -0.218 18090 1440 1 4 . 1 1 51 51 ASP C C 177 177.950 177.950 178.291 -0.341 18090 1441 1 4 . 1 1 51 51 ASP CA C 177 55.840 55.840 55.990 -0.150 18090 1442 1 4 . 1 1 51 51 ASP CB C 177 40.310 40.310 40.846 -0.536 18090 1443 1 4 . 1 1 51 51 ASP H H 177 7.870 7.870 7.880 -0.010 18090 1444 1 4 . 1 1 52 52 LEU N N 178 120.010 120.010 120.349 -0.339 18090 1445 1 4 . 1 1 52 52 LEU HA H 178 3.650 3.650 4.013 -0.363 18090 1446 1 4 . 1 1 52 52 LEU C C 178 175.810 175.810 178.690 -2.880 18090 1447 1 4 . 1 1 52 52 LEU CA C 178 57.620 57.620 57.675 -0.055 18090 1448 1 4 . 1 1 52 52 LEU CB C 178 41.880 41.880 41.777 0.103 18090 1449 1 4 . 1 1 52 52 LEU H H 178 7.860 7.860 7.564 0.296 18090 1450 1 4 . 1 1 53 53 PHE N N 179 110.580 110.580 112.170 -1.590 18090 1451 1 4 . 1 1 53 53 PHE HA H 179 4.230 4.230 4.324 -0.094 18090 1452 1 4 . 1 1 53 53 PHE C C 179 176.370 176.370 177.475 -1.105 18090 1453 1 4 . 1 1 53 53 PHE CA C 179 58.730 58.730 60.136 -1.407 18090 1454 1 4 . 1 1 53 53 PHE CB C 179 38.720 38.720 38.832 -0.112 18090 1455 1 4 . 1 1 53 53 PHE H H 179 7.210 7.210 7.876 -0.666 18090 1456 1 4 . 1 1 54 54 THR N N 180 108.190 108.190 109.476 -1.286 18090 1457 1 4 . 1 1 54 54 THR HA H 180 4.300 4.300 4.266 0.034 18090 1458 1 4 . 1 1 54 54 THR C C 180 174.400 174.400 175.386 -0.986 18090 1459 1 4 . 1 1 54 54 THR CA C 180 62.020 62.020 62.584 -0.564 18090 1460 1 4 . 1 1 54 54 THR CB C 180 69.730 69.730 70.057 -0.327 18090 1461 1 4 . 1 1 54 54 THR H H 180 7.550 7.550 7.441 0.109 18090 1462 1 4 . 1 1 55 55 ASP N N 181 120.060 120.060 123.450 -3.390 18090 1463 1 4 . 1 1 55 55 ASP HA H 181 5.020 5.020 5.110 -0.090 18090 1464 1 4 . 1 1 55 55 ASP C C 181 174.120 174.120 174.861 -0.741 18090 1465 1 4 . 1 1 55 55 ASP CA C 181 50.560 50.560 51.019 -0.459 18090 1466 1 4 . 1 1 55 55 ASP CB C 181 41.190 41.190 42.860 -1.670 18090 1467 1 4 . 1 1 55 55 ASP H H 181 7.480 7.480 8.010 -0.530 18090 1468 1 4 . 1 1 56 56 PRO HA H 182 4.320 4.320 4.293 0.027 18090 1469 1 4 . 1 1 56 56 PRO CA C 182 64.280 64.280 64.925 -0.645 18090 1470 1 4 . 1 1 56 56 PRO CB C 182 31.980 31.980 32.347 -0.367 18090 1471 1 4 . 1 1 57 57 ARG N N 183 117.660 117.660 117.733 -0.073 18090 1472 1 4 . 1 1 57 57 ARG HA H 183 3.960 3.960 4.072 -0.112 18090 1473 1 4 . 1 1 57 57 ARG C C 183 179.030 179.030 178.501 0.529 18090 1474 1 4 . 1 1 57 57 ARG CA C 183 59.000 59.000 58.871 0.129 18090 1475 1 4 . 1 1 57 57 ARG CB C 183 29.750 29.750 29.507 0.243 18090 1476 1 4 . 1 1 57 57 ARG H H 183 7.920 7.920 8.074 -0.154 18090 1477 1 4 . 1 1 58 58 LEU N N 184 115.670 115.670 119.523 -3.853 18090 1478 1 4 . 1 1 58 58 LEU HA H 184 3.850 3.850 3.963 -0.113 18090 1479 1 4 . 1 1 58 58 LEU C C 184 178.770 178.770 179.141 -0.371 18090 1480 1 4 . 1 1 58 58 LEU CA C 184 57.110 57.110 57.743 -0.633 18090 1481 1 4 . 1 1 58 58 LEU CB C 184 41.310 41.310 41.621 -0.311 18090 1482 1 4 . 1 1 58 58 LEU H H 184 7.750 7.750 8.185 -0.435 18090 1483 1 4 . 1 1 59 59 MET N N 185 118.570 118.570 116.162 2.408 18090 1484 1 4 . 1 1 59 59 MET HA H 185 4.060 4.060 4.149 -0.089 18090 1485 1 4 . 1 1 59 59 MET C C 185 177.540 177.540 178.188 -0.648 18090 1486 1 4 . 1 1 59 59 MET CA C 185 58.090 58.090 59.232 -1.142 18090 1487 1 4 . 1 1 59 59 MET CB C 185 31.270 31.270 32.263 -0.993 18090 1488 1 4 . 1 1 59 59 MET H H 185 7.590 7.590 7.692 -0.102 18090 1489 1 4 . 1 1 60 60 THR N N 186 116.390 116.390 117.494 -1.104 18090 1490 1 4 . 1 1 60 60 THR HA H 186 3.680 3.680 4.016 -0.336 18090 1491 1 4 . 1 1 60 60 THR C C 186 177.440 177.440 176.659 0.781 18090 1492 1 4 . 1 1 60 60 THR CA C 186 66.940 66.940 66.371 0.569 18090 1493 1 4 . 1 1 60 60 THR CB C 186 68.030 68.030 68.133 -0.103 18090 1494 1 4 . 1 1 60 60 THR H H 186 7.180 7.180 7.795 -0.615 18090 1495 1 4 . 1 1 61 61 ILE N N 187 123.840 123.840 122.802 1.038 18090 1496 1 4 . 1 1 61 61 ILE HA H 187 3.290 3.290 3.739 -0.449 18090 1497 1 4 . 1 1 61 61 ILE C C 187 176.660 176.660 178.257 -1.597 18090 1498 1 4 . 1 1 61 61 ILE CA C 187 65.850 65.850 65.303 0.547 18090 1499 1 4 . 1 1 61 61 ILE CB C 187 37.640 37.640 37.745 -0.105 18090 1500 1 4 . 1 1 61 61 ILE H H 187 8.010 8.010 7.979 0.031 18090 1501 1 4 . 1 1 62 62 MET N N 188 118.210 118.210 118.375 -0.165 18090 1502 1 4 . 1 1 62 62 MET HA H 188 3.910 3.910 4.028 -0.118 18090 1503 1 4 . 1 1 62 62 MET C C 188 177.540 177.540 178.419 -0.879 18090 1504 1 4 . 1 1 62 62 MET CA C 188 58.530 58.530 57.567 0.963 18090 1505 1 4 . 1 1 62 62 MET CB C 188 31.200 31.200 31.258 -0.058 18090 1506 1 4 . 1 1 62 62 MET H H 188 8.560 8.560 7.515 1.045 18090 1507 1 4 . 1 1 63 63 ALA N N 189 119.850 119.850 122.422 -2.572 18090 1508 1 4 . 1 1 63 63 ALA HA H 189 3.730 3.730 3.891 -0.161 18090 1509 1 4 . 1 1 63 63 ALA C C 189 179.550 179.550 179.382 0.168 18090 1510 1 4 . 1 1 63 63 ALA CA C 189 55.470 55.470 55.596 -0.126 18090 1511 1 4 . 1 1 63 63 ALA CB C 189 17.640 17.640 18.185 -0.545 18090 1512 1 4 . 1 1 63 63 ALA H H 189 8.210 8.210 8.198 0.012 18090 1513 1 4 . 1 1 64 64 THR N N 190 114.570 114.570 114.447 0.123 18090 1514 1 4 . 1 1 64 64 THR HA H 190 3.790 3.790 4.255 -0.465 18090 1515 1 4 . 1 1 64 64 THR C C 190 177.640 177.640 177.219 0.421 18090 1516 1 4 . 1 1 64 64 THR CA C 190 66.690 66.690 65.429 1.261 18090 1517 1 4 . 1 1 64 64 THR CB C 190 68.310 68.310 68.267 0.043 18090 1518 1 4 . 1 1 64 64 THR H H 190 7.740 7.740 7.643 0.097 18090 1519 1 4 . 1 1 65 65 LEU N N 191 122.410 122.410 122.507 -0.097 18090 1520 1 4 . 1 1 65 65 LEU HA H 191 3.930 3.930 3.985 -0.055 18090 1521 1 4 . 1 1 65 65 LEU C C 191 178.470 178.470 179.701 -1.231 18090 1522 1 4 . 1 1 65 65 LEU CA C 191 57.120 57.120 57.914 -0.794 18090 1523 1 4 . 1 1 65 65 LEU CB C 191 41.830 41.830 41.854 -0.024 18090 1524 1 4 . 1 1 65 65 LEU H H 191 8.180 8.180 7.798 0.382 18090 1525 1 4 . 1 1 66 66 MET N N 192 115.320 115.320 117.113 -1.793 18090 1526 1 4 . 1 1 66 66 MET HA H 192 4.090 4.090 4.304 -0.214 18090 1527 1 4 . 1 1 66 66 MET C C 192 176.090 176.090 178.239 -2.149 18090 1528 1 4 . 1 1 66 66 MET CA C 192 56.390 56.390 57.462 -1.072 18090 1529 1 4 . 1 1 66 66 MET CB C 192 33.770 33.770 31.952 1.818 18090 1530 1 4 . 1 1 66 66 MET H H 192 7.880 7.880 8.468 -0.588 18090 1531 1 4 . 1 1 67 67 GLY N N 193 107.490 107.490 105.151 2.339 18090 1532 1 4 . 1 1 67 67 GLY C C 193 174.390 174.390 174.894 -0.504 18090 1533 1 4 . 1 1 67 67 GLY CA C 193 45.880 45.880 45.131 0.749 18090 1534 1 4 . 1 1 67 67 GLY H H 193 7.580 7.580 8.110 -0.530 18090 1535 1 4 . 1 1 68 68 VAL N N 194 118.520 118.520 116.602 1.918 18090 1536 1 4 . 1 1 68 68 VAL HA H 194 3.940 3.940 3.642 0.298 18090 1537 1 4 . 1 1 68 68 VAL C C 194 174.760 174.760 176.018 -1.258 18090 1538 1 4 . 1 1 68 68 VAL CA C 194 61.510 61.510 63.586 -2.076 18090 1539 1 4 . 1 1 68 68 VAL CB C 194 32.670 32.670 29.453 3.217 18090 1540 1 4 . 1 1 68 68 VAL H H 194 7.840 7.840 7.394 0.446 18090 1541 1 4 . 1 1 69 69 ASP N N 195 124.550 124.550 119.145 5.405 18090 1542 1 4 . 1 1 69 69 ASP HA H 195 4.430 4.430 4.531 -0.101 18090 1543 1 4 . 1 1 69 69 ASP C C 195 175.140 175.140 177.992 -2.852 18090 1544 1 4 . 1 1 69 69 ASP CA C 195 53.760 53.760 56.297 -2.537 18090 1545 1 4 . 1 1 69 69 ASP CB C 195 40.920 40.920 41.609 -0.689 18090 1546 1 4 . 1 1 69 69 ASP H H 195 8.400 8.400 7.811 0.589 18090 1547 1 4 . 1 1 70 70 LEU N N 196 123.930 123.930 117.257 6.673 18090 1548 1 4 . 1 1 70 70 LEU HA H 196 4.200 4.200 3.761 0.439 18090 1549 1 4 . 1 1 70 70 LEU C C 196 175.950 175.950 176.941 -0.991 18090 1550 1 4 . 1 1 70 70 LEU CA C 196 54.380 54.380 57.521 -3.141 18090 1551 1 4 . 1 1 70 70 LEU CB C 196 41.610 41.610 40.231 1.379 18090 1552 1 4 . 1 1 70 70 LEU H H 196 8.160 8.160 7.732 0.428 18090 1553 1 5 . 1 1 2 2 PRO HA H 128 4.220 4.220 4.557 -0.337 18090 1554 1 5 . 1 1 2 2 PRO CA C 128 63.320 63.320 63.135 0.185 18090 1555 1 5 . 1 1 2 2 PRO CB C 128 31.680 31.680 32.446 -0.766 18090 1556 1 5 . 1 1 3 3 ASP N N 129 119.320 119.320 119.210 0.110 18090 1557 1 5 . 1 1 3 3 ASP HA H 129 4.400 4.400 4.805 -0.405 18090 1558 1 5 . 1 1 3 3 ASP C C 129 176.120 176.120 174.453 1.667 18090 1559 1 5 . 1 1 3 3 ASP CA C 129 54.050 54.050 53.925 0.125 18090 1560 1 5 . 1 1 3 3 ASP CB C 129 40.770 40.770 40.989 -0.219 18090 1561 1 5 . 1 1 3 3 ASP H H 129 8.310 8.310 8.510 -0.200 18090 1562 1 5 . 1 1 4 4 LEU N N 130 122.280 122.280 118.264 4.016 18090 1563 1 5 . 1 1 4 4 LEU HA H 130 4.130 4.130 4.556 -0.426 18090 1564 1 5 . 1 1 4 4 LEU C C 130 177.280 177.280 176.078 1.202 18090 1565 1 5 . 1 1 4 4 LEU CA C 130 55.350 55.350 54.188 1.162 18090 1566 1 5 . 1 1 4 4 LEU CB C 130 41.490 41.490 45.181 -3.691 18090 1567 1 5 . 1 1 4 4 LEU H H 130 8.080 8.080 7.561 0.519 18090 1568 1 5 . 1 1 5 5 GLY N N 131 107.830 107.830 107.974 -0.144 18090 1569 1 5 . 1 1 5 5 GLY C C 131 175.120 175.120 173.182 1.938 18090 1570 1 5 . 1 1 5 5 GLY CA C 131 45.300 45.300 45.501 -0.201 18090 1571 1 5 . 1 1 5 5 GLY H H 131 8.180 8.180 8.346 -0.166 18090 1572 1 5 . 1 1 6 6 LEU N N 132 121.080 121.080 116.252 4.828 18090 1573 1 5 . 1 1 6 6 LEU HA H 132 3.870 3.870 4.486 -0.616 18090 1574 1 5 . 1 1 6 6 LEU C C 132 178.000 178.000 177.734 0.266 18090 1575 1 5 . 1 1 6 6 LEU CA C 132 57.180 57.180 53.677 3.503 18090 1576 1 5 . 1 1 6 6 LEU CB C 132 41.870 41.870 44.281 -2.411 18090 1577 1 5 . 1 1 6 6 LEU H H 132 8.150 8.150 7.434 0.716 18090 1578 1 5 . 1 1 7 7 THR N N 133 111.580 111.580 113.585 -2.005 18090 1579 1 5 . 1 1 7 7 THR HA H 133 3.730 3.730 3.973 -0.243 18090 1580 1 5 . 1 1 7 7 THR C C 133 176.530 176.530 176.140 0.390 18090 1581 1 5 . 1 1 7 7 THR CA C 133 65.940 65.940 66.240 -0.300 18090 1582 1 5 . 1 1 7 7 THR CB C 133 68.130 68.130 68.827 -0.697 18090 1583 1 5 . 1 1 7 7 THR H H 133 7.970 7.970 8.706 -0.736 18090 1584 1 5 . 1 1 8 8 GLN N N 134 119.490 119.490 120.896 -1.406 18090 1585 1 5 . 1 1 8 8 GLN HA H 134 3.990 3.990 3.892 0.098 18090 1586 1 5 . 1 1 8 8 GLN C C 134 178.190 178.190 178.096 0.094 18090 1587 1 5 . 1 1 8 8 GLN CA C 134 57.930 57.930 58.608 -0.678 18090 1588 1 5 . 1 1 8 8 GLN CB C 134 27.850 27.850 28.119 -0.269 18090 1589 1 5 . 1 1 8 8 GLN H H 134 7.890 7.890 8.354 -0.464 18090 1590 1 5 . 1 1 9 9 LEU N N 135 120.170 120.170 118.367 1.803 18090 1591 1 5 . 1 1 9 9 LEU HA H 135 3.820 3.820 3.943 -0.123 18090 1592 1 5 . 1 1 9 9 LEU C C 135 177.810 177.810 178.631 -0.821 18090 1593 1 5 . 1 1 9 9 LEU CA C 135 57.470 57.470 57.229 0.241 18090 1594 1 5 . 1 1 9 9 LEU CB C 135 41.640 41.640 41.862 -0.222 18090 1595 1 5 . 1 1 9 9 LEU H H 135 7.600 7.600 7.255 0.345 18090 1596 1 5 . 1 1 10 10 PHE N N 136 111.950 111.950 113.549 -1.599 18090 1597 1 5 . 1 1 10 10 PHE HA H 136 4.380 4.380 4.478 -0.098 18090 1598 1 5 . 1 1 10 10 PHE C C 136 174.990 174.990 177.429 -2.439 18090 1599 1 5 . 1 1 10 10 PHE CA C 136 58.450 58.450 57.619 0.831 18090 1600 1 5 . 1 1 10 10 PHE CB C 136 38.570 38.570 37.770 0.799 18090 1601 1 5 . 1 1 10 10 PHE H H 136 7.410 7.410 6.578 0.832 18090 1602 1 5 . 1 1 11 11 ALA N N 137 120.230 120.230 122.771 -2.541 18090 1603 1 5 . 1 1 11 11 ALA HA H 137 4.130 4.130 4.161 -0.031 18090 1604 1 5 . 1 1 11 11 ALA C C 137 177.090 177.090 178.199 -1.109 18090 1605 1 5 . 1 1 11 11 ALA CA C 137 52.580 52.580 53.624 -1.044 18090 1606 1 5 . 1 1 11 11 ALA CB C 137 18.660 18.660 18.659 0.001 18090 1607 1 5 . 1 1 11 11 ALA H H 137 7.330 7.330 8.582 -1.252 18090 1608 1 5 . 1 1 12 12 ASP N N 138 119.830 119.830 120.753 -0.923 18090 1609 1 5 . 1 1 12 12 ASP HA H 138 4.510 4.510 4.714 -0.204 18090 1610 1 5 . 1 1 12 12 ASP C C 138 176.370 176.370 174.750 1.620 18090 1611 1 5 . 1 1 12 12 ASP CA C 138 51.960 51.960 52.878 -0.918 18090 1612 1 5 . 1 1 12 12 ASP CB C 138 41.990 41.990 41.595 0.395 18090 1613 1 5 . 1 1 12 12 ASP H H 138 6.980 6.980 7.640 -0.660 18090 1614 1 5 . 1 1 13 13 PRO HA H 139 4.260 4.260 4.372 -0.112 18090 1615 1 5 . 1 1 13 13 PRO CA C 139 64.350 64.350 62.864 1.486 18090 1616 1 5 . 1 1 13 13 PRO CB C 139 31.760 31.760 32.374 -0.614 18090 1617 1 5 . 1 1 14 14 ASN N N 140 116.840 116.840 117.535 -0.695 18090 1618 1 5 . 1 1 14 14 ASN HA H 140 4.840 4.840 4.482 0.358 18090 1619 1 5 . 1 1 14 14 ASN C C 140 173.840 173.840 175.349 -1.509 18090 1620 1 5 . 1 1 14 14 ASN CA C 140 52.380 52.380 54.184 -1.804 18090 1621 1 5 . 1 1 14 14 ASN CB C 140 38.330 38.330 37.018 1.312 18090 1622 1 5 . 1 1 14 14 ASN H H 140 8.670 8.670 8.680 -0.010 18090 1623 1 5 . 1 1 15 15 LEU N N 141 120.290 120.290 120.401 -0.111 18090 1624 1 5 . 1 1 15 15 LEU HA H 141 3.790 3.790 4.534 -0.744 18090 1625 1 5 . 1 1 15 15 LEU C C 141 177.120 177.120 177.538 -0.418 18090 1626 1 5 . 1 1 15 15 LEU CA C 141 59.280 59.280 55.592 3.688 18090 1627 1 5 . 1 1 15 15 LEU CB C 141 42.980 42.980 43.162 -0.182 18090 1628 1 5 . 1 1 15 15 LEU H H 141 7.200 7.200 8.429 -1.229 18090 1629 1 5 . 1 1 16 16 ILE N N 142 115.290 115.290 120.206 -4.916 18090 1630 1 5 . 1 1 16 16 ILE HA H 142 3.480 3.480 3.724 -0.244 18090 1631 1 5 . 1 1 16 16 ILE C C 142 177.990 177.990 177.499 0.491 18090 1632 1 5 . 1 1 16 16 ILE CA C 142 62.690 62.690 65.343 -2.653 18090 1633 1 5 . 1 1 16 16 ILE CB C 142 34.620 34.620 37.644 -3.024 18090 1634 1 5 . 1 1 16 16 ILE H H 142 7.940 7.940 8.286 -0.346 18090 1635 1 5 . 1 1 17 17 GLU N N 143 119.600 119.600 119.024 0.576 18090 1636 1 5 . 1 1 17 17 GLU HA H 143 3.700 3.700 3.992 -0.292 18090 1637 1 5 . 1 1 17 17 GLU C C 143 179.170 179.170 178.733 0.437 18090 1638 1 5 . 1 1 17 17 GLU CA C 143 59.360 59.360 60.085 -0.725 18090 1639 1 5 . 1 1 17 17 GLU CB C 143 28.520 28.520 29.214 -0.694 18090 1640 1 5 . 1 1 17 17 GLU H H 143 7.970 7.970 8.542 -0.572 18090 1641 1 5 . 1 1 18 18 ASN N N 144 117.170 117.170 117.836 -0.666 18090 1642 1 5 . 1 1 18 18 ASN HA H 144 4.270 4.270 4.447 -0.177 18090 1643 1 5 . 1 1 18 18 ASN C C 144 179.120 179.120 177.802 1.318 18090 1644 1 5 . 1 1 18 18 ASN CA C 144 55.490 55.490 55.636 -0.146 18090 1645 1 5 . 1 1 18 18 ASN CB C 144 36.550 36.550 37.796 -1.246 18090 1646 1 5 . 1 1 18 18 ASN H H 144 8.450 8.450 8.374 0.076 18090 1647 1 5 . 1 1 19 19 LEU N N 145 121.060 121.060 119.031 2.029 18090 1648 1 5 . 1 1 19 19 LEU HA H 145 4.020 4.020 4.028 -0.008 18090 1649 1 5 . 1 1 19 19 LEU C C 145 180.260 180.260 178.171 2.089 18090 1650 1 5 . 1 1 19 19 LEU CA C 145 56.620 56.620 57.026 -0.406 18090 1651 1 5 . 1 1 19 19 LEU CB C 145 41.780 41.780 41.531 0.249 18090 1652 1 5 . 1 1 19 19 LEU H H 145 7.990 7.990 7.531 0.459 18090 1653 1 5 . 1 1 20 20 LYS N N 146 118.960 118.960 117.601 1.359 18090 1654 1 5 . 1 1 20 20 LYS HA H 146 3.610 3.610 3.980 -0.370 18090 1655 1 5 . 1 1 20 20 LYS C C 146 177.390 177.390 178.105 -0.715 18090 1656 1 5 . 1 1 20 20 LYS CA C 146 59.640 59.640 59.193 0.447 18090 1657 1 5 . 1 1 20 20 LYS CB C 146 32.450 32.450 32.324 0.126 18090 1658 1 5 . 1 1 20 20 LYS H H 146 8.250 8.250 7.814 0.436 18090 1659 1 5 . 1 1 21 21 LYS N N 147 114.720 114.720 116.410 -1.690 18090 1660 1 5 . 1 1 21 21 LYS HA H 147 4.110 4.110 4.221 -0.111 18090 1661 1 5 . 1 1 21 21 LYS C C 147 175.880 175.880 178.334 -2.454 18090 1662 1 5 . 1 1 21 21 LYS CA C 147 56.210 56.210 58.219 -2.009 18090 1663 1 5 . 1 1 21 21 LYS CB C 147 33.000 33.000 32.715 0.285 18090 1664 1 5 . 1 1 21 21 LYS H H 147 7.130 7.130 7.680 -0.550 18090 1665 1 5 . 1 1 22 22 ASN N N 148 122.180 122.180 115.410 6.770 18090 1666 1 5 . 1 1 22 22 ASN HA H 148 4.740 4.740 4.916 -0.176 18090 1667 1 5 . 1 1 22 22 ASN C C 148 174.000 174.000 173.514 0.486 18090 1668 1 5 . 1 1 22 22 ASN CA C 148 50.970 50.970 52.700 -1.730 18090 1669 1 5 . 1 1 22 22 ASN CB C 148 38.670 38.670 38.967 -0.297 18090 1670 1 5 . 1 1 22 22 ASN H H 148 6.930 6.930 7.900 -0.970 18090 1671 1 5 . 1 1 23 23 PRO HA H 149 4.300 4.300 4.697 -0.397 18090 1672 1 5 . 1 1 23 23 PRO CA C 149 64.610 64.610 61.994 2.616 18090 1673 1 5 . 1 1 23 23 PRO CB C 149 32.000 32.000 34.158 -2.158 18090 1674 1 5 . 1 1 24 24 LYS N N 150 116.060 116.060 121.288 -5.228 18090 1675 1 5 . 1 1 24 24 LYS HA H 150 4.070 4.070 3.978 0.092 18090 1676 1 5 . 1 1 24 24 LYS C C 150 178.240 178.240 178.601 -0.361 18090 1677 1 5 . 1 1 24 24 LYS CA C 150 57.950 57.950 59.741 -1.791 18090 1678 1 5 . 1 1 24 24 LYS CB C 150 32.590 32.590 31.962 0.628 18090 1679 1 5 . 1 1 24 24 LYS H H 150 8.520 8.520 8.805 -0.285 18090 1680 1 5 . 1 1 25 25 THR N N 151 105.190 105.190 110.636 -5.446 18090 1681 1 5 . 1 1 25 25 THR HA H 151 4.390 4.390 4.044 0.346 18090 1682 1 5 . 1 1 25 25 THR C C 151 176.090 176.090 176.209 -0.119 18090 1683 1 5 . 1 1 25 25 THR CA C 151 61.400 61.400 64.956 -3.556 18090 1684 1 5 . 1 1 25 25 THR CB C 151 69.440 69.440 68.234 1.206 18090 1685 1 5 . 1 1 25 25 THR H H 151 7.490 7.490 8.131 -0.641 18090 1686 1 5 . 1 1 26 26 SER N N 152 119.700 119.700 116.474 3.226 18090 1687 1 5 . 1 1 26 26 SER HA H 152 3.770 3.770 4.145 -0.375 18090 1688 1 5 . 1 1 26 26 SER C C 152 177.470 177.470 176.008 1.462 18090 1689 1 5 . 1 1 26 26 SER CA C 152 62.450 62.450 61.385 1.065 18090 1690 1 5 . 1 1 26 26 SER CB C 152 62.520 62.520 62.743 -0.223 18090 1691 1 5 . 1 1 26 26 SER H H 152 8.190 8.190 7.944 0.246 18090 1692 1 5 . 1 1 27 27 GLU N N 153 119.870 119.870 122.671 -2.801 18090 1693 1 5 . 1 1 27 27 GLU HA H 153 3.890 3.890 3.967 -0.077 18090 1694 1 5 . 1 1 27 27 GLU C C 153 180.040 180.040 178.706 1.334 18090 1695 1 5 . 1 1 27 27 GLU CA C 153 58.700 58.700 59.396 -0.696 18090 1696 1 5 . 1 1 27 27 GLU CB C 153 28.590 28.590 29.452 -0.862 18090 1697 1 5 . 1 1 27 27 GLU H H 153 8.350 8.350 7.911 0.439 18090 1698 1 5 . 1 1 28 28 MET N N 154 119.430 119.430 116.962 2.468 18090 1699 1 5 . 1 1 28 28 MET HA H 154 4.040 4.040 4.164 -0.124 18090 1700 1 5 . 1 1 28 28 MET C C 154 177.110 177.110 178.164 -1.054 18090 1701 1 5 . 1 1 28 28 MET CA C 154 58.510 58.510 58.644 -0.134 18090 1702 1 5 . 1 1 28 28 MET CB C 154 31.430 31.430 32.733 -1.303 18090 1703 1 5 . 1 1 28 28 MET H H 154 7.850 7.850 7.588 0.262 18090 1704 1 5 . 1 1 29 29 MET N N 155 112.640 112.640 114.386 -1.746 18090 1705 1 5 . 1 1 29 29 MET HA H 155 4.340 4.340 4.253 0.087 18090 1706 1 5 . 1 1 29 29 MET C C 155 175.530 175.530 177.837 -2.307 18090 1707 1 5 . 1 1 29 29 MET CA C 155 53.790 53.790 57.182 -3.392 18090 1708 1 5 . 1 1 29 29 MET CB C 155 30.380 30.380 32.038 -1.658 18090 1709 1 5 . 1 1 29 29 MET H H 155 7.200 7.200 7.349 -0.149 18090 1710 1 5 . 1 1 30 30 LYS N N 156 117.050 117.050 117.030 0.020 18090 1711 1 5 . 1 1 30 30 LYS HA H 156 3.960 3.960 4.270 -0.310 18090 1712 1 5 . 1 1 30 30 LYS C C 156 176.120 176.120 177.079 -0.959 18090 1713 1 5 . 1 1 30 30 LYS CA C 156 57.090 57.090 57.299 -0.209 18090 1714 1 5 . 1 1 30 30 LYS CB C 156 31.960 31.960 33.047 -1.087 18090 1715 1 5 . 1 1 30 30 LYS H H 156 7.130 7.130 7.646 -0.516 18090 1716 1 5 . 1 1 31 31 ASP N N 157 119.810 119.810 118.283 1.527 18090 1717 1 5 . 1 1 31 31 ASP HA H 157 4.860 4.860 4.903 -0.043 18090 1718 1 5 . 1 1 31 31 ASP C C 157 174.890 174.890 174.380 0.510 18090 1719 1 5 . 1 1 31 31 ASP CA C 157 50.520 50.520 54.429 -3.909 18090 1720 1 5 . 1 1 31 31 ASP CB C 157 41.010 41.010 40.557 0.452 18090 1721 1 5 . 1 1 31 31 ASP H H 157 7.340 7.340 7.773 -0.433 18090 1722 1 5 . 1 1 32 32 PRO HA H 158 4.130 4.130 4.461 -0.331 18090 1723 1 5 . 1 1 32 32 PRO CA C 158 64.270 64.270 62.811 1.459 18090 1724 1 5 . 1 1 32 32 PRO CB C 158 31.770 31.770 32.426 -0.656 18090 1725 1 5 . 1 1 33 33 GLN N N 159 117.760 117.760 120.255 -2.495 18090 1726 1 5 . 1 1 33 33 GLN HA H 159 4.000 4.000 4.042 -0.042 18090 1727 1 5 . 1 1 33 33 GLN C C 159 178.740 178.740 177.943 0.797 18090 1728 1 5 . 1 1 33 33 GLN CA C 159 58.220 58.220 58.031 0.189 18090 1729 1 5 . 1 1 33 33 GLN CB C 159 27.870 27.870 28.080 -0.210 18090 1730 1 5 . 1 1 33 33 GLN H H 159 8.150 8.150 8.769 -0.619 18090 1731 1 5 . 1 1 34 34 LEU N N 160 123.300 123.300 120.190 3.110 18090 1732 1 5 . 1 1 34 34 LEU HA H 160 3.970 3.970 4.025 -0.055 18090 1733 1 5 . 1 1 34 34 LEU C C 160 177.980 177.980 178.160 -0.180 18090 1734 1 5 . 1 1 34 34 LEU CA C 160 57.050 57.050 57.276 -0.226 18090 1735 1 5 . 1 1 34 34 LEU CB C 160 40.760 40.760 41.640 -0.880 18090 1736 1 5 . 1 1 34 34 LEU H H 160 7.110 7.110 7.995 -0.885 18090 1737 1 5 . 1 1 35 35 VAL N N 161 118.390 118.390 119.343 -0.953 18090 1738 1 5 . 1 1 35 35 VAL HA H 161 3.110 3.110 3.548 -0.438 18090 1739 1 5 . 1 1 35 35 VAL C C 161 176.840 176.840 177.938 -1.098 18090 1740 1 5 . 1 1 35 35 VAL CA C 161 67.700 67.700 66.647 1.053 18090 1741 1 5 . 1 1 35 35 VAL CB C 161 31.260 31.260 30.615 0.645 18090 1742 1 5 . 1 1 35 35 VAL H H 161 7.430 7.430 7.425 0.005 18090 1743 1 5 . 1 1 36 36 ALA N N 162 117.600 117.600 121.675 -4.075 18090 1744 1 5 . 1 1 36 36 ALA HA H 162 3.810 3.810 3.934 -0.124 18090 1745 1 5 . 1 1 36 36 ALA C C 162 180.620 180.620 179.719 0.901 18090 1746 1 5 . 1 1 36 36 ALA CA C 162 54.720 54.720 55.370 -0.650 18090 1747 1 5 . 1 1 36 36 ALA CB C 162 17.490 17.490 18.194 -0.704 18090 1748 1 5 . 1 1 36 36 ALA H H 162 7.500 7.500 7.830 -0.330 18090 1749 1 5 . 1 1 37 37 LYS N N 163 119.880 119.880 118.507 1.373 18090 1750 1 5 . 1 1 37 37 LYS HA H 163 3.570 3.570 3.986 -0.416 18090 1751 1 5 . 1 1 37 37 LYS C C 163 177.800 177.800 179.121 -1.321 18090 1752 1 5 . 1 1 37 37 LYS CA C 163 58.880 58.880 58.934 -0.054 18090 1753 1 5 . 1 1 37 37 LYS CB C 163 31.610 31.610 32.035 -0.425 18090 1754 1 5 . 1 1 37 37 LYS H H 163 7.350 7.350 7.405 -0.055 18090 1755 1 5 . 1 1 38 38 LEU N N 164 118.020 118.020 120.004 -1.984 18090 1756 1 5 . 1 1 38 38 LEU HA H 164 3.670 3.670 4.060 -0.390 18090 1757 1 5 . 1 1 38 38 LEU C C 164 179.380 179.380 179.213 0.167 18090 1758 1 5 . 1 1 38 38 LEU CA C 164 57.340 57.340 57.767 -0.427 18090 1759 1 5 . 1 1 38 38 LEU CB C 164 41.660 41.660 41.704 -0.044 18090 1760 1 5 . 1 1 38 38 LEU H H 164 7.660 7.660 8.145 -0.485 18090 1761 1 5 . 1 1 39 39 ILE N N 165 118.070 118.070 118.223 -0.153 18090 1762 1 5 . 1 1 39 39 ILE HA H 165 3.510 3.510 3.642 -0.132 18090 1763 1 5 . 1 1 39 39 ILE C C 165 179.570 179.570 178.227 1.343 18090 1764 1 5 . 1 1 39 39 ILE CA C 165 64.450 64.450 65.498 -1.048 18090 1765 1 5 . 1 1 39 39 ILE CB C 165 37.310 37.310 37.451 -0.141 18090 1766 1 5 . 1 1 39 39 ILE H H 165 8.030 8.030 7.983 0.047 18090 1767 1 5 . 1 1 40 40 GLY N N 166 107.970 107.970 107.972 -0.002 18090 1768 1 5 . 1 1 40 40 GLY C C 166 176.470 176.470 175.703 0.767 18090 1769 1 5 . 1 1 40 40 GLY CA C 166 46.410 46.410 46.957 -0.547 18090 1770 1 5 . 1 1 40 40 GLY H H 166 7.590 7.590 7.621 -0.031 18090 1771 1 5 . 1 1 41 41 TYR N N 167 121.270 121.270 122.329 -1.059 18090 1772 1 5 . 1 1 41 41 TYR HA H 167 4.190 4.190 4.210 -0.020 18090 1773 1 5 . 1 1 41 41 TYR C C 167 176.470 176.470 176.208 0.262 18090 1774 1 5 . 1 1 41 41 TYR CA C 167 57.130 57.130 60.397 -3.267 18090 1775 1 5 . 1 1 41 41 TYR CB C 167 35.950 35.950 38.219 -2.269 18090 1776 1 5 . 1 1 41 41 TYR H H 167 7.350 7.350 7.870 -0.520 18090 1777 1 5 . 1 1 42 42 LYS N N 168 116.520 116.520 116.084 0.436 18090 1778 1 5 . 1 1 42 42 LYS HA H 168 3.820 3.820 4.053 -0.233 18090 1779 1 5 . 1 1 42 42 LYS C C 168 177.810 177.810 177.920 -0.110 18090 1780 1 5 . 1 1 42 42 LYS CA C 168 59.390 59.390 58.387 1.003 18090 1781 1 5 . 1 1 42 42 LYS CB C 168 31.580 31.580 32.759 -1.179 18090 1782 1 5 . 1 1 42 42 LYS H H 168 7.460 7.460 8.257 -0.797 18090 1783 1 5 . 1 1 43 43 GLN N N 169 113.750 113.750 115.987 -2.237 18090 1784 1 5 . 1 1 43 43 GLN HA H 169 4.220 4.220 4.158 0.062 18090 1785 1 5 . 1 1 43 43 GLN C C 169 175.840 175.840 177.299 -1.459 18090 1786 1 5 . 1 1 43 43 GLN CA C 169 56.230 56.230 58.181 -1.951 18090 1787 1 5 . 1 1 43 43 GLN CB C 169 29.290 29.290 29.357 -0.067 18090 1788 1 5 . 1 1 43 43 GLN H H 169 7.220 7.220 7.627 -0.407 18090 1789 1 5 . 1 1 44 44 ASN N N 170 114.130 114.130 116.204 -2.074 18090 1790 1 5 . 1 1 44 44 ASN HA H 170 5.050 5.050 4.976 0.074 18090 1791 1 5 . 1 1 44 44 ASN C C 170 172.200 172.200 173.644 -1.444 18090 1792 1 5 . 1 1 44 44 ASN CA C 170 50.780 50.780 53.133 -2.353 18090 1793 1 5 . 1 1 44 44 ASN CB C 170 38.380 38.380 39.598 -1.218 18090 1794 1 5 . 1 1 44 44 ASN H H 170 7.580 7.580 7.657 -0.077 18090 1795 1 5 . 1 1 45 45 PRO HA H 171 4.130 4.130 4.714 -0.584 18090 1796 1 5 . 1 1 45 45 PRO CA C 171 64.800 64.800 62.203 2.597 18090 1797 1 5 . 1 1 45 45 PRO CB C 171 31.360 31.360 31.880 -0.520 18090 1798 1 5 . 1 1 46 46 GLN N N 172 115.570 115.570 122.952 -7.382 18090 1799 1 5 . 1 1 46 46 GLN HA H 172 3.770 3.770 3.774 -0.004 18090 1800 1 5 . 1 1 46 46 GLN C C 172 177.360 177.360 177.599 -0.239 18090 1801 1 5 . 1 1 46 46 GLN CA C 172 57.950 57.950 58.147 -0.197 18090 1802 1 5 . 1 1 46 46 GLN CB C 172 27.050 27.050 27.886 -0.836 18090 1803 1 5 . 1 1 46 46 GLN H H 172 8.160 8.160 8.700 -0.540 18090 1804 1 5 . 1 1 47 47 ALA N N 173 121.420 121.420 121.585 -0.165 18090 1805 1 5 . 1 1 47 47 ALA HA H 173 4.050 4.050 4.174 -0.124 18090 1806 1 5 . 1 1 47 47 ALA C C 173 178.090 178.090 179.463 -1.373 18090 1807 1 5 . 1 1 47 47 ALA CA C 173 53.490 53.490 54.308 -0.818 18090 1808 1 5 . 1 1 47 47 ALA CB C 173 18.450 18.450 17.637 0.813 18090 1809 1 5 . 1 1 47 47 ALA H H 173 7.470 7.470 8.268 -0.798 18090 1810 1 5 . 1 1 48 48 ILE N N 174 118.050 118.050 118.710 -0.660 18090 1811 1 5 . 1 1 48 48 ILE HA H 174 3.180 3.180 3.889 -0.709 18090 1812 1 5 . 1 1 48 48 ILE C C 174 176.250 176.250 177.870 -1.620 18090 1813 1 5 . 1 1 48 48 ILE CA C 174 64.030 64.030 64.049 -0.019 18090 1814 1 5 . 1 1 48 48 ILE CB C 174 37.280 37.280 37.102 0.178 18090 1815 1 5 . 1 1 48 48 ILE H H 174 7.150 7.150 7.340 -0.190 18090 1816 1 5 . 1 1 49 49 GLY N N 175 105.390 105.390 106.861 -1.471 18090 1817 1 5 . 1 1 49 49 GLY C C 175 174.220 174.220 176.250 -2.030 18090 1818 1 5 . 1 1 49 49 GLY CA C 175 46.700 46.700 47.117 -0.417 18090 1819 1 5 . 1 1 49 49 GLY H H 175 7.550 7.550 7.821 -0.271 18090 1820 1 5 . 1 1 50 50 GLN N N 176 116.230 116.230 118.447 -2.217 18090 1821 1 5 . 1 1 50 50 GLN HA H 176 4.210 4.210 4.714 -0.504 18090 1822 1 5 . 1 1 50 50 GLN C C 176 178.120 178.120 178.259 -0.139 18090 1823 1 5 . 1 1 50 50 GLN CA C 176 57.320 57.320 58.002 -0.682 18090 1824 1 5 . 1 1 50 50 GLN CB C 176 28.630 28.630 28.868 -0.238 18090 1825 1 5 . 1 1 50 50 GLN H H 176 7.390 7.390 8.017 -0.627 18090 1826 1 5 . 1 1 51 51 ASP N N 177 120.000 120.000 121.205 -1.205 18090 1827 1 5 . 1 1 51 51 ASP HA H 177 4.420 4.420 4.669 -0.249 18090 1828 1 5 . 1 1 51 51 ASP C C 177 177.950 177.950 178.450 -0.500 18090 1829 1 5 . 1 1 51 51 ASP CA C 177 55.840 55.840 56.070 -0.230 18090 1830 1 5 . 1 1 51 51 ASP CB C 177 40.310 40.310 40.907 -0.597 18090 1831 1 5 . 1 1 51 51 ASP H H 177 7.870 7.870 7.929 -0.059 18090 1832 1 5 . 1 1 52 52 LEU N N 178 120.010 120.010 120.325 -0.315 18090 1833 1 5 . 1 1 52 52 LEU HA H 178 3.650 3.650 3.985 -0.335 18090 1834 1 5 . 1 1 52 52 LEU C C 178 175.810 175.810 178.247 -2.437 18090 1835 1 5 . 1 1 52 52 LEU CA C 178 57.620 57.620 57.781 -0.161 18090 1836 1 5 . 1 1 52 52 LEU CB C 178 41.880 41.880 41.676 0.204 18090 1837 1 5 . 1 1 52 52 LEU H H 178 7.860 7.860 7.604 0.256 18090 1838 1 5 . 1 1 53 53 PHE N N 179 110.580 110.580 113.823 -3.243 18090 1839 1 5 . 1 1 53 53 PHE HA H 179 4.230 4.230 4.323 -0.093 18090 1840 1 5 . 1 1 53 53 PHE C C 179 176.370 176.370 178.016 -1.646 18090 1841 1 5 . 1 1 53 53 PHE CA C 179 58.730 58.730 60.495 -1.765 18090 1842 1 5 . 1 1 53 53 PHE CB C 179 38.720 38.720 38.902 -0.182 18090 1843 1 5 . 1 1 53 53 PHE H H 179 7.210 7.210 7.845 -0.635 18090 1844 1 5 . 1 1 54 54 THR N N 180 108.190 108.190 107.820 0.370 18090 1845 1 5 . 1 1 54 54 THR HA H 180 4.300 4.300 4.301 -0.001 18090 1846 1 5 . 1 1 54 54 THR C C 180 174.400 174.400 174.966 -0.566 18090 1847 1 5 . 1 1 54 54 THR CA C 180 62.020 62.020 62.861 -0.841 18090 1848 1 5 . 1 1 54 54 THR CB C 180 69.730 69.730 69.775 -0.045 18090 1849 1 5 . 1 1 54 54 THR H H 180 7.550 7.550 7.471 0.079 18090 1850 1 5 . 1 1 55 55 ASP N N 181 120.060 120.060 123.033 -2.973 18090 1851 1 5 . 1 1 55 55 ASP HA H 181 5.020 5.020 5.086 -0.066 18090 1852 1 5 . 1 1 55 55 ASP C C 181 174.120 174.120 175.228 -1.108 18090 1853 1 5 . 1 1 55 55 ASP CA C 181 50.560 50.560 50.469 0.091 18090 1854 1 5 . 1 1 55 55 ASP CB C 181 41.190 41.190 43.076 -1.886 18090 1855 1 5 . 1 1 55 55 ASP H H 181 7.480 7.480 8.002 -0.522 18090 1856 1 5 . 1 1 56 56 PRO HA H 182 4.320 4.320 4.332 -0.012 18090 1857 1 5 . 1 1 56 56 PRO CA C 182 64.280 64.280 64.884 -0.604 18090 1858 1 5 . 1 1 56 56 PRO CB C 182 31.980 31.980 32.640 -0.660 18090 1859 1 5 . 1 1 57 57 ARG N N 183 117.660 117.660 118.367 -0.707 18090 1860 1 5 . 1 1 57 57 ARG HA H 183 3.960 3.960 4.105 -0.145 18090 1861 1 5 . 1 1 57 57 ARG C C 183 179.030 179.030 178.684 0.346 18090 1862 1 5 . 1 1 57 57 ARG CA C 183 59.000 59.000 58.817 0.183 18090 1863 1 5 . 1 1 57 57 ARG CB C 183 29.750 29.750 29.378 0.371 18090 1864 1 5 . 1 1 57 57 ARG H H 183 7.920 7.920 7.994 -0.074 18090 1865 1 5 . 1 1 58 58 LEU N N 184 115.670 115.670 119.434 -3.764 18090 1866 1 5 . 1 1 58 58 LEU HA H 184 3.850 3.850 3.972 -0.122 18090 1867 1 5 . 1 1 58 58 LEU C C 184 178.770 178.770 179.107 -0.337 18090 1868 1 5 . 1 1 58 58 LEU CA C 184 57.110 57.110 57.718 -0.608 18090 1869 1 5 . 1 1 58 58 LEU CB C 184 41.310 41.310 41.592 -0.282 18090 1870 1 5 . 1 1 58 58 LEU H H 184 7.750 7.750 8.204 -0.454 18090 1871 1 5 . 1 1 59 59 MET N N 185 118.570 118.570 116.486 2.084 18090 1872 1 5 . 1 1 59 59 MET HA H 185 4.060 4.060 4.142 -0.082 18090 1873 1 5 . 1 1 59 59 MET C C 185 177.540 177.540 178.103 -0.563 18090 1874 1 5 . 1 1 59 59 MET CA C 185 58.090 58.090 59.334 -1.244 18090 1875 1 5 . 1 1 59 59 MET CB C 185 31.270 31.270 32.195 -0.925 18090 1876 1 5 . 1 1 59 59 MET H H 185 7.590 7.590 7.688 -0.098 18090 1877 1 5 . 1 1 60 60 THR N N 186 116.390 116.390 117.462 -1.072 18090 1878 1 5 . 1 1 60 60 THR HA H 186 3.680 3.680 3.997 -0.317 18090 1879 1 5 . 1 1 60 60 THR C C 186 177.440 177.440 176.386 1.054 18090 1880 1 5 . 1 1 60 60 THR CA C 186 66.940 66.940 67.269 -0.329 18090 1881 1 5 . 1 1 60 60 THR CB C 186 68.030 68.030 68.228 -0.198 18090 1882 1 5 . 1 1 60 60 THR H H 186 7.180 7.180 7.809 -0.629 18090 1883 1 5 . 1 1 61 61 ILE N N 187 123.840 123.840 122.124 1.716 18090 1884 1 5 . 1 1 61 61 ILE HA H 187 3.290 3.290 3.754 -0.464 18090 1885 1 5 . 1 1 61 61 ILE C C 187 176.660 176.660 178.038 -1.378 18090 1886 1 5 . 1 1 61 61 ILE CA C 187 65.850 65.850 65.511 0.339 18090 1887 1 5 . 1 1 61 61 ILE CB C 187 37.640 37.640 37.881 -0.241 18090 1888 1 5 . 1 1 61 61 ILE H H 187 8.010 8.010 7.815 0.195 18090 1889 1 5 . 1 1 62 62 MET N N 188 118.210 118.210 118.270 -0.060 18090 1890 1 5 . 1 1 62 62 MET HA H 188 3.910 3.910 4.000 -0.090 18090 1891 1 5 . 1 1 62 62 MET C C 188 177.540 177.540 178.446 -0.906 18090 1892 1 5 . 1 1 62 62 MET CA C 188 58.530 58.530 58.886 -0.356 18090 1893 1 5 . 1 1 62 62 MET CB C 188 31.200 31.200 31.516 -0.316 18090 1894 1 5 . 1 1 62 62 MET H H 188 8.560 8.560 7.424 1.136 18090 1895 1 5 . 1 1 63 63 ALA N N 189 119.850 119.850 122.438 -2.588 18090 1896 1 5 . 1 1 63 63 ALA HA H 189 3.730 3.730 3.886 -0.156 18090 1897 1 5 . 1 1 63 63 ALA C C 189 179.550 179.550 179.486 0.064 18090 1898 1 5 . 1 1 63 63 ALA CA C 189 55.470 55.470 55.530 -0.060 18090 1899 1 5 . 1 1 63 63 ALA CB C 189 17.640 17.640 18.178 -0.538 18090 1900 1 5 . 1 1 63 63 ALA H H 189 8.210 8.210 8.216 -0.006 18090 1901 1 5 . 1 1 64 64 THR N N 190 114.570 114.570 113.878 0.692 18090 1902 1 5 . 1 1 64 64 THR HA H 190 3.790 3.790 3.990 -0.200 18090 1903 1 5 . 1 1 64 64 THR C C 190 177.640 177.640 176.675 0.965 18090 1904 1 5 . 1 1 64 64 THR CA C 190 66.690 66.690 65.624 1.066 18090 1905 1 5 . 1 1 64 64 THR CB C 190 68.310 68.310 68.163 0.147 18090 1906 1 5 . 1 1 64 64 THR H H 190 7.740 7.740 7.675 0.065 18090 1907 1 5 . 1 1 65 65 LEU N N 191 122.410 122.410 122.579 -0.169 18090 1908 1 5 . 1 1 65 65 LEU HA H 191 3.930 3.930 3.963 -0.033 18090 1909 1 5 . 1 1 65 65 LEU C C 191 178.470 178.470 179.886 -1.416 18090 1910 1 5 . 1 1 65 65 LEU CA C 191 57.120 57.120 58.099 -0.979 18090 1911 1 5 . 1 1 65 65 LEU CB C 191 41.830 41.830 41.720 0.110 18090 1912 1 5 . 1 1 65 65 LEU H H 191 8.180 8.180 7.690 0.490 18090 1913 1 5 . 1 1 66 66 MET N N 192 115.320 115.320 117.166 -1.846 18090 1914 1 5 . 1 1 66 66 MET HA H 192 4.090 4.090 4.305 -0.215 18090 1915 1 5 . 1 1 66 66 MET C C 192 176.090 176.090 178.286 -2.196 18090 1916 1 5 . 1 1 66 66 MET CA C 192 56.390 56.390 57.375 -0.985 18090 1917 1 5 . 1 1 66 66 MET CB C 192 33.770 33.770 31.831 1.939 18090 1918 1 5 . 1 1 66 66 MET H H 192 7.880 7.880 8.449 -0.569 18090 1919 1 5 . 1 1 67 67 GLY N N 193 107.490 107.490 105.214 2.276 18090 1920 1 5 . 1 1 67 67 GLY C C 193 174.390 174.390 174.868 -0.478 18090 1921 1 5 . 1 1 67 67 GLY CA C 193 45.880 45.880 44.984 0.896 18090 1922 1 5 . 1 1 67 67 GLY H H 193 7.580 7.580 8.164 -0.584 18090 1923 1 5 . 1 1 68 68 VAL N N 194 118.520 118.520 116.661 1.859 18090 1924 1 5 . 1 1 68 68 VAL HA H 194 3.940 3.940 3.634 0.306 18090 1925 1 5 . 1 1 68 68 VAL C C 194 174.760 174.760 174.829 -0.069 18090 1926 1 5 . 1 1 68 68 VAL CA C 194 61.510 61.510 63.501 -1.990 18090 1927 1 5 . 1 1 68 68 VAL CB C 194 32.670 32.670 30.076 2.594 18090 1928 1 5 . 1 1 68 68 VAL H H 194 7.840 7.840 7.396 0.444 18090 1929 1 5 . 1 1 69 69 ASP N N 195 124.550 124.550 116.928 7.622 18090 1930 1 5 . 1 1 69 69 ASP HA H 195 4.430 4.430 4.317 0.113 18090 1931 1 5 . 1 1 69 69 ASP C C 195 175.140 175.140 176.217 -1.077 18090 1932 1 5 . 1 1 69 69 ASP CA C 195 53.760 53.760 55.938 -2.178 18090 1933 1 5 . 1 1 69 69 ASP CB C 195 40.920 40.920 39.891 1.029 18090 1934 1 5 . 1 1 69 69 ASP H H 195 8.400 8.400 8.038 0.362 18090 1935 1 5 . 1 1 70 70 LEU N N 196 123.930 123.930 118.777 5.153 18090 1936 1 5 . 1 1 70 70 LEU HA H 196 4.200 4.200 4.207 -0.007 18090 1937 1 5 . 1 1 70 70 LEU C C 196 175.950 175.950 177.967 -2.017 18090 1938 1 5 . 1 1 70 70 LEU CA C 196 54.380 54.380 56.166 -1.786 18090 1939 1 5 . 1 1 70 70 LEU CB C 196 41.610 41.610 42.530 -0.920 18090 1940 1 5 . 1 1 70 70 LEU H H 196 8.160 8.160 7.383 0.777 18090 1941 1 6 . 1 1 2 2 PRO HA H 128 4.220 4.220 4.596 -0.376 18090 1942 1 6 . 1 1 2 2 PRO CA C 128 63.320 63.320 62.751 0.569 18090 1943 1 6 . 1 1 2 2 PRO CB C 128 31.680 31.680 32.501 -0.821 18090 1944 1 6 . 1 1 3 3 ASP N N 129 119.320 119.320 120.037 -0.717 18090 1945 1 6 . 1 1 3 3 ASP HA H 129 4.400 4.400 4.623 -0.223 18090 1946 1 6 . 1 1 3 3 ASP C C 129 176.120 176.120 175.817 0.303 18090 1947 1 6 . 1 1 3 3 ASP CA C 129 54.050 54.050 54.012 0.038 18090 1948 1 6 . 1 1 3 3 ASP CB C 129 40.770 40.770 40.675 0.095 18090 1949 1 6 . 1 1 3 3 ASP H H 129 8.310 8.310 8.353 -0.043 18090 1950 1 6 . 1 1 4 4 LEU N N 130 122.280 122.280 117.169 5.111 18090 1951 1 6 . 1 1 4 4 LEU HA H 130 4.130 4.130 3.900 0.230 18090 1952 1 6 . 1 1 4 4 LEU C C 130 177.280 177.280 177.689 -0.409 18090 1953 1 6 . 1 1 4 4 LEU CA C 130 55.350 55.350 55.357 -0.007 18090 1954 1 6 . 1 1 4 4 LEU CB C 130 41.490 41.490 42.244 -0.754 18090 1955 1 6 . 1 1 4 4 LEU H H 130 8.080 8.080 7.554 0.526 18090 1956 1 6 . 1 1 5 5 GLY N N 131 107.830 107.830 106.470 1.360 18090 1957 1 6 . 1 1 5 5 GLY C C 131 175.120 175.120 172.966 2.154 18090 1958 1 6 . 1 1 5 5 GLY CA C 131 45.300 45.300 45.456 -0.156 18090 1959 1 6 . 1 1 5 5 GLY H H 131 8.180 8.180 8.319 -0.139 18090 1960 1 6 . 1 1 6 6 LEU N N 132 121.080 121.080 117.812 3.268 18090 1961 1 6 . 1 1 6 6 LEU HA H 132 3.870 3.870 4.441 -0.571 18090 1962 1 6 . 1 1 6 6 LEU C C 132 178.000 178.000 177.513 0.487 18090 1963 1 6 . 1 1 6 6 LEU CA C 132 57.180 57.180 53.470 3.710 18090 1964 1 6 . 1 1 6 6 LEU CB C 132 41.870 41.870 45.214 -3.344 18090 1965 1 6 . 1 1 6 6 LEU H H 132 8.150 8.150 7.685 0.465 18090 1966 1 6 . 1 1 7 7 THR N N 133 111.580 111.580 114.074 -2.494 18090 1967 1 6 . 1 1 7 7 THR HA H 133 3.730 3.730 4.043 -0.313 18090 1968 1 6 . 1 1 7 7 THR C C 133 176.530 176.530 176.022 0.508 18090 1969 1 6 . 1 1 7 7 THR CA C 133 65.940 65.940 66.109 -0.169 18090 1970 1 6 . 1 1 7 7 THR CB C 133 68.130 68.130 68.465 -0.335 18090 1971 1 6 . 1 1 7 7 THR H H 133 7.970 7.970 8.700 -0.730 18090 1972 1 6 . 1 1 8 8 GLN N N 134 119.490 119.490 121.512 -2.022 18090 1973 1 6 . 1 1 8 8 GLN HA H 134 3.990 3.990 3.914 0.076 18090 1974 1 6 . 1 1 8 8 GLN C C 134 178.190 178.190 178.319 -0.129 18090 1975 1 6 . 1 1 8 8 GLN CA C 134 57.930 57.930 58.760 -0.830 18090 1976 1 6 . 1 1 8 8 GLN CB C 134 27.850 27.850 27.843 0.007 18090 1977 1 6 . 1 1 8 8 GLN H H 134 7.890 7.890 8.347 -0.457 18090 1978 1 6 . 1 1 9 9 LEU N N 135 120.170 120.170 119.080 1.090 18090 1979 1 6 . 1 1 9 9 LEU HA H 135 3.820 3.820 3.922 -0.102 18090 1980 1 6 . 1 1 9 9 LEU C C 135 177.810 177.810 178.850 -1.040 18090 1981 1 6 . 1 1 9 9 LEU CA C 135 57.470 57.470 57.353 0.117 18090 1982 1 6 . 1 1 9 9 LEU CB C 135 41.640 41.640 41.652 -0.012 18090 1983 1 6 . 1 1 9 9 LEU H H 135 7.600 7.600 7.281 0.319 18090 1984 1 6 . 1 1 10 10 PHE N N 136 111.950 111.950 113.759 -1.809 18090 1985 1 6 . 1 1 10 10 PHE HA H 136 4.380 4.380 4.473 -0.093 18090 1986 1 6 . 1 1 10 10 PHE C C 136 174.990 174.990 177.433 -2.443 18090 1987 1 6 . 1 1 10 10 PHE CA C 136 58.450 58.450 57.649 0.801 18090 1988 1 6 . 1 1 10 10 PHE CB C 136 38.570 38.570 37.328 1.242 18090 1989 1 6 . 1 1 10 10 PHE H H 136 7.410 7.410 6.704 0.706 18090 1990 1 6 . 1 1 11 11 ALA N N 137 120.230 120.230 122.012 -1.782 18090 1991 1 6 . 1 1 11 11 ALA HA H 137 4.130 4.130 4.148 -0.018 18090 1992 1 6 . 1 1 11 11 ALA C C 137 177.090 177.090 178.195 -1.105 18090 1993 1 6 . 1 1 11 11 ALA CA C 137 52.580 52.580 53.545 -0.965 18090 1994 1 6 . 1 1 11 11 ALA CB C 137 18.660 18.660 18.731 -0.071 18090 1995 1 6 . 1 1 11 11 ALA H H 137 7.330 7.330 8.552 -1.222 18090 1996 1 6 . 1 1 12 12 ASP N N 138 119.830 119.830 120.779 -0.949 18090 1997 1 6 . 1 1 12 12 ASP HA H 138 4.510 4.510 4.688 -0.178 18090 1998 1 6 . 1 1 12 12 ASP C C 138 176.370 176.370 174.973 1.397 18090 1999 1 6 . 1 1 12 12 ASP CA C 138 51.960 51.960 53.010 -1.050 18090 2000 1 6 . 1 1 12 12 ASP CB C 138 41.990 41.990 41.579 0.411 18090 2001 1 6 . 1 1 12 12 ASP H H 138 6.980 6.980 7.644 -0.664 18090 2002 1 6 . 1 1 13 13 PRO HA H 139 4.260 4.260 4.421 -0.161 18090 2003 1 6 . 1 1 13 13 PRO CA C 139 64.350 64.350 63.067 1.283 18090 2004 1 6 . 1 1 13 13 PRO CB C 139 31.760 31.760 32.337 -0.577 18090 2005 1 6 . 1 1 14 14 ASN N N 140 116.840 116.840 118.107 -1.267 18090 2006 1 6 . 1 1 14 14 ASN HA H 140 4.840 4.840 4.471 0.369 18090 2007 1 6 . 1 1 14 14 ASN C C 140 173.840 173.840 175.634 -1.794 18090 2008 1 6 . 1 1 14 14 ASN CA C 140 52.380 52.380 54.051 -1.671 18090 2009 1 6 . 1 1 14 14 ASN CB C 140 38.330 38.330 36.811 1.519 18090 2010 1 6 . 1 1 14 14 ASN H H 140 8.670 8.670 8.728 -0.058 18090 2011 1 6 . 1 1 15 15 LEU N N 141 120.290 120.290 120.211 0.079 18090 2012 1 6 . 1 1 15 15 LEU HA H 141 3.790 3.790 4.540 -0.750 18090 2013 1 6 . 1 1 15 15 LEU C C 141 177.120 177.120 177.489 -0.369 18090 2014 1 6 . 1 1 15 15 LEU CA C 141 59.280 59.280 55.583 3.697 18090 2015 1 6 . 1 1 15 15 LEU CB C 141 42.980 42.980 43.167 -0.187 18090 2016 1 6 . 1 1 15 15 LEU H H 141 7.200 7.200 8.355 -1.155 18090 2017 1 6 . 1 1 16 16 ILE N N 142 115.290 115.290 120.720 -5.430 18090 2018 1 6 . 1 1 16 16 ILE HA H 142 3.480 3.480 3.667 -0.187 18090 2019 1 6 . 1 1 16 16 ILE C C 142 177.990 177.990 177.507 0.483 18090 2020 1 6 . 1 1 16 16 ILE CA C 142 62.690 62.690 65.444 -2.754 18090 2021 1 6 . 1 1 16 16 ILE CB C 142 34.620 34.620 37.772 -3.152 18090 2022 1 6 . 1 1 16 16 ILE H H 142 7.940 7.940 8.429 -0.489 18090 2023 1 6 . 1 1 17 17 GLU N N 143 119.600 119.600 119.062 0.538 18090 2024 1 6 . 1 1 17 17 GLU HA H 143 3.700 3.700 3.998 -0.298 18090 2025 1 6 . 1 1 17 17 GLU C C 143 179.170 179.170 178.784 0.386 18090 2026 1 6 . 1 1 17 17 GLU CA C 143 59.360 59.360 60.184 -0.824 18090 2027 1 6 . 1 1 17 17 GLU CB C 143 28.520 28.520 29.209 -0.689 18090 2028 1 6 . 1 1 17 17 GLU H H 143 7.970 7.970 8.578 -0.608 18090 2029 1 6 . 1 1 18 18 ASN N N 144 117.170 117.170 118.042 -0.872 18090 2030 1 6 . 1 1 18 18 ASN HA H 144 4.270 4.270 4.456 -0.186 18090 2031 1 6 . 1 1 18 18 ASN C C 144 179.120 179.120 177.802 1.318 18090 2032 1 6 . 1 1 18 18 ASN CA C 144 55.490 55.490 55.645 -0.155 18090 2033 1 6 . 1 1 18 18 ASN CB C 144 36.550 36.550 37.818 -1.268 18090 2034 1 6 . 1 1 18 18 ASN H H 144 8.450 8.450 8.363 0.087 18090 2035 1 6 . 1 1 19 19 LEU N N 145 121.060 121.060 120.302 0.758 18090 2036 1 6 . 1 1 19 19 LEU HA H 145 4.020 4.020 3.992 0.028 18090 2037 1 6 . 1 1 19 19 LEU C C 145 180.260 180.260 178.461 1.799 18090 2038 1 6 . 1 1 19 19 LEU CA C 145 56.620 56.620 57.483 -0.863 18090 2039 1 6 . 1 1 19 19 LEU CB C 145 41.780 41.780 41.572 0.208 18090 2040 1 6 . 1 1 19 19 LEU H H 145 7.990 7.990 7.656 0.334 18090 2041 1 6 . 1 1 20 20 LYS N N 146 118.960 118.960 118.120 0.840 18090 2042 1 6 . 1 1 20 20 LYS HA H 146 3.610 3.610 3.993 -0.383 18090 2043 1 6 . 1 1 20 20 LYS C C 146 177.390 177.390 178.361 -0.971 18090 2044 1 6 . 1 1 20 20 LYS CA C 146 59.640 59.640 59.252 0.388 18090 2045 1 6 . 1 1 20 20 LYS CB C 146 32.450 32.450 32.398 0.052 18090 2046 1 6 . 1 1 20 20 LYS H H 146 8.250 8.250 7.957 0.293 18090 2047 1 6 . 1 1 21 21 LYS N N 147 114.720 114.720 115.691 -0.971 18090 2048 1 6 . 1 1 21 21 LYS HA H 147 4.110 4.110 4.245 -0.135 18090 2049 1 6 . 1 1 21 21 LYS C C 147 175.880 175.880 177.651 -1.771 18090 2050 1 6 . 1 1 21 21 LYS CA C 147 56.210 56.210 58.232 -2.022 18090 2051 1 6 . 1 1 21 21 LYS CB C 147 33.000 33.000 32.981 0.019 18090 2052 1 6 . 1 1 21 21 LYS H H 147 7.130 7.130 7.626 -0.496 18090 2053 1 6 . 1 1 22 22 ASN N N 148 122.180 122.180 116.561 5.619 18090 2054 1 6 . 1 1 22 22 ASN HA H 148 4.740 4.740 4.930 -0.190 18090 2055 1 6 . 1 1 22 22 ASN C C 148 174.000 174.000 173.275 0.725 18090 2056 1 6 . 1 1 22 22 ASN CA C 148 50.970 50.970 53.041 -2.071 18090 2057 1 6 . 1 1 22 22 ASN CB C 148 38.670 38.670 39.712 -1.042 18090 2058 1 6 . 1 1 22 22 ASN H H 148 6.930 6.930 7.844 -0.914 18090 2059 1 6 . 1 1 23 23 PRO HA H 149 4.300 4.300 4.730 -0.430 18090 2060 1 6 . 1 1 23 23 PRO CA C 149 64.610 64.610 61.810 2.800 18090 2061 1 6 . 1 1 23 23 PRO CB C 149 32.000 32.000 34.543 -2.543 18090 2062 1 6 . 1 1 24 24 LYS N N 150 116.060 116.060 121.150 -5.090 18090 2063 1 6 . 1 1 24 24 LYS HA H 150 4.070 4.070 3.946 0.124 18090 2064 1 6 . 1 1 24 24 LYS C C 150 178.240 178.240 178.309 -0.069 18090 2065 1 6 . 1 1 24 24 LYS CA C 150 57.950 57.950 59.770 -1.820 18090 2066 1 6 . 1 1 24 24 LYS CB C 150 32.590 32.590 31.826 0.764 18090 2067 1 6 . 1 1 24 24 LYS H H 150 8.520 8.520 8.829 -0.309 18090 2068 1 6 . 1 1 25 25 THR N N 151 105.190 105.190 110.435 -5.245 18090 2069 1 6 . 1 1 25 25 THR HA H 151 4.390 4.390 4.105 0.285 18090 2070 1 6 . 1 1 25 25 THR C C 151 176.090 176.090 176.003 0.087 18090 2071 1 6 . 1 1 25 25 THR CA C 151 61.400 61.400 64.716 -3.316 18090 2072 1 6 . 1 1 25 25 THR CB C 151 69.440 69.440 67.692 1.748 18090 2073 1 6 . 1 1 25 25 THR H H 151 7.490 7.490 8.211 -0.721 18090 2074 1 6 . 1 1 26 26 SER N N 152 119.700 119.700 117.019 2.681 18090 2075 1 6 . 1 1 26 26 SER HA H 152 3.770 3.770 4.163 -0.393 18090 2076 1 6 . 1 1 26 26 SER C C 152 177.470 177.470 176.143 1.327 18090 2077 1 6 . 1 1 26 26 SER CA C 152 62.450 62.450 61.353 1.097 18090 2078 1 6 . 1 1 26 26 SER CB C 152 62.520 62.520 62.595 -0.075 18090 2079 1 6 . 1 1 26 26 SER H H 152 8.190 8.190 7.962 0.228 18090 2080 1 6 . 1 1 27 27 GLU N N 153 119.870 119.870 122.992 -3.122 18090 2081 1 6 . 1 1 27 27 GLU HA H 153 3.890 3.890 3.947 -0.057 18090 2082 1 6 . 1 1 27 27 GLU C C 153 180.040 180.040 178.701 1.339 18090 2083 1 6 . 1 1 27 27 GLU CA C 153 58.700 58.700 59.520 -0.820 18090 2084 1 6 . 1 1 27 27 GLU CB C 153 28.590 28.590 29.447 -0.857 18090 2085 1 6 . 1 1 27 27 GLU H H 153 8.350 8.350 7.775 0.575 18090 2086 1 6 . 1 1 28 28 MET N N 154 119.430 119.430 117.151 2.279 18090 2087 1 6 . 1 1 28 28 MET HA H 154 4.040 4.040 4.154 -0.114 18090 2088 1 6 . 1 1 28 28 MET C C 154 177.110 177.110 178.106 -0.996 18090 2089 1 6 . 1 1 28 28 MET CA C 154 58.510 58.510 58.796 -0.286 18090 2090 1 6 . 1 1 28 28 MET CB C 154 31.430 31.430 32.758 -1.328 18090 2091 1 6 . 1 1 28 28 MET H H 154 7.850 7.850 7.623 0.227 18090 2092 1 6 . 1 1 29 29 MET N N 155 112.640 112.640 114.551 -1.911 18090 2093 1 6 . 1 1 29 29 MET HA H 155 4.340 4.340 4.256 0.084 18090 2094 1 6 . 1 1 29 29 MET C C 155 175.530 175.530 177.904 -2.374 18090 2095 1 6 . 1 1 29 29 MET CA C 155 53.790 53.790 57.313 -3.523 18090 2096 1 6 . 1 1 29 29 MET CB C 155 30.380 30.380 31.862 -1.482 18090 2097 1 6 . 1 1 29 29 MET H H 155 7.200 7.200 7.362 -0.162 18090 2098 1 6 . 1 1 30 30 LYS N N 156 117.050 117.050 117.046 0.004 18090 2099 1 6 . 1 1 30 30 LYS HA H 156 3.960 3.960 4.251 -0.291 18090 2100 1 6 . 1 1 30 30 LYS C C 156 176.120 176.120 177.207 -1.087 18090 2101 1 6 . 1 1 30 30 LYS CA C 156 57.090 57.090 57.662 -0.572 18090 2102 1 6 . 1 1 30 30 LYS CB C 156 31.960 31.960 32.996 -1.036 18090 2103 1 6 . 1 1 30 30 LYS H H 156 7.130 7.130 7.696 -0.566 18090 2104 1 6 . 1 1 31 31 ASP N N 157 119.810 119.810 118.511 1.299 18090 2105 1 6 . 1 1 31 31 ASP HA H 157 4.860 4.860 4.981 -0.121 18090 2106 1 6 . 1 1 31 31 ASP C C 157 174.890 174.890 174.518 0.372 18090 2107 1 6 . 1 1 31 31 ASP CA C 157 50.520 50.520 54.381 -3.861 18090 2108 1 6 . 1 1 31 31 ASP CB C 157 41.010 41.010 40.737 0.273 18090 2109 1 6 . 1 1 31 31 ASP H H 157 7.340 7.340 7.733 -0.393 18090 2110 1 6 . 1 1 32 32 PRO HA H 158 4.130 4.130 4.467 -0.337 18090 2111 1 6 . 1 1 32 32 PRO CA C 158 64.270 64.270 62.963 1.307 18090 2112 1 6 . 1 1 32 32 PRO CB C 158 31.770 31.770 32.381 -0.611 18090 2113 1 6 . 1 1 33 33 GLN N N 159 117.760 117.760 120.261 -2.501 18090 2114 1 6 . 1 1 33 33 GLN HA H 159 4.000 4.000 4.039 -0.039 18090 2115 1 6 . 1 1 33 33 GLN C C 159 178.740 178.740 177.948 0.792 18090 2116 1 6 . 1 1 33 33 GLN CA C 159 58.220 58.220 58.064 0.156 18090 2117 1 6 . 1 1 33 33 GLN CB C 159 27.870 27.870 28.073 -0.203 18090 2118 1 6 . 1 1 33 33 GLN H H 159 8.150 8.150 8.771 -0.621 18090 2119 1 6 . 1 1 34 34 LEU N N 160 123.300 123.300 120.057 3.243 18090 2120 1 6 . 1 1 34 34 LEU HA H 160 3.970 3.970 4.009 -0.039 18090 2121 1 6 . 1 1 34 34 LEU C C 160 177.980 177.980 178.157 -0.177 18090 2122 1 6 . 1 1 34 34 LEU CA C 160 57.050 57.050 57.270 -0.220 18090 2123 1 6 . 1 1 34 34 LEU CB C 160 40.760 40.760 41.667 -0.907 18090 2124 1 6 . 1 1 34 34 LEU H H 160 7.110 7.110 7.981 -0.871 18090 2125 1 6 . 1 1 35 35 VAL N N 161 118.390 118.390 119.405 -1.015 18090 2126 1 6 . 1 1 35 35 VAL HA H 161 3.110 3.110 3.494 -0.384 18090 2127 1 6 . 1 1 35 35 VAL C C 161 176.840 176.840 177.657 -0.817 18090 2128 1 6 . 1 1 35 35 VAL CA C 161 67.700 67.700 66.989 0.711 18090 2129 1 6 . 1 1 35 35 VAL CB C 161 31.260 31.260 31.322 -0.062 18090 2130 1 6 . 1 1 35 35 VAL H H 161 7.430 7.430 7.421 0.009 18090 2131 1 6 . 1 1 36 36 ALA N N 162 117.600 117.600 121.229 -3.629 18090 2132 1 6 . 1 1 36 36 ALA HA H 162 3.810 3.810 3.950 -0.140 18090 2133 1 6 . 1 1 36 36 ALA C C 162 180.620 180.620 179.618 1.002 18090 2134 1 6 . 1 1 36 36 ALA CA C 162 54.720 54.720 55.325 -0.605 18090 2135 1 6 . 1 1 36 36 ALA CB C 162 17.490 17.490 18.108 -0.618 18090 2136 1 6 . 1 1 36 36 ALA H H 162 7.500 7.500 7.783 -0.283 18090 2137 1 6 . 1 1 37 37 LYS N N 163 119.880 119.880 118.546 1.334 18090 2138 1 6 . 1 1 37 37 LYS HA H 163 3.570 3.570 3.987 -0.417 18090 2139 1 6 . 1 1 37 37 LYS C C 163 177.800 177.800 179.106 -1.306 18090 2140 1 6 . 1 1 37 37 LYS CA C 163 58.880 58.880 58.945 -0.065 18090 2141 1 6 . 1 1 37 37 LYS CB C 163 31.610 31.610 32.037 -0.427 18090 2142 1 6 . 1 1 37 37 LYS H H 163 7.350 7.350 7.421 -0.071 18090 2143 1 6 . 1 1 38 38 LEU N N 164 118.020 118.020 119.700 -1.680 18090 2144 1 6 . 1 1 38 38 LEU HA H 164 3.670 3.670 4.033 -0.363 18090 2145 1 6 . 1 1 38 38 LEU C C 164 179.380 179.380 179.148 0.232 18090 2146 1 6 . 1 1 38 38 LEU CA C 164 57.340 57.340 57.808 -0.468 18090 2147 1 6 . 1 1 38 38 LEU CB C 164 41.660 41.660 41.665 -0.005 18090 2148 1 6 . 1 1 38 38 LEU H H 164 7.660 7.660 8.167 -0.507 18090 2149 1 6 . 1 1 39 39 ILE N N 165 118.070 118.070 119.394 -1.324 18090 2150 1 6 . 1 1 39 39 ILE HA H 165 3.510 3.510 3.621 -0.111 18090 2151 1 6 . 1 1 39 39 ILE C C 165 179.570 179.570 178.278 1.292 18090 2152 1 6 . 1 1 39 39 ILE CA C 165 64.450 64.450 65.616 -1.166 18090 2153 1 6 . 1 1 39 39 ILE CB C 165 37.310 37.310 37.502 -0.192 18090 2154 1 6 . 1 1 39 39 ILE H H 165 8.030 8.030 7.904 0.126 18090 2155 1 6 . 1 1 40 40 GLY N N 166 107.970 107.970 107.934 0.036 18090 2156 1 6 . 1 1 40 40 GLY C C 166 176.470 176.470 175.601 0.869 18090 2157 1 6 . 1 1 40 40 GLY CA C 166 46.410 46.410 47.038 -0.628 18090 2158 1 6 . 1 1 40 40 GLY H H 166 7.590 7.590 7.719 -0.129 18090 2159 1 6 . 1 1 41 41 TYR N N 167 121.270 121.270 122.329 -1.059 18090 2160 1 6 . 1 1 41 41 TYR HA H 167 4.190 4.190 4.213 -0.023 18090 2161 1 6 . 1 1 41 41 TYR C C 167 176.470 176.470 176.212 0.258 18090 2162 1 6 . 1 1 41 41 TYR CA C 167 57.130 57.130 60.418 -3.288 18090 2163 1 6 . 1 1 41 41 TYR CB C 167 35.950 35.950 38.232 -2.282 18090 2164 1 6 . 1 1 41 41 TYR H H 167 7.350 7.350 7.930 -0.580 18090 2165 1 6 . 1 1 42 42 LYS N N 168 116.520 116.520 116.137 0.383 18090 2166 1 6 . 1 1 42 42 LYS HA H 168 3.820 3.820 4.051 -0.231 18090 2167 1 6 . 1 1 42 42 LYS C C 168 177.810 177.810 177.902 -0.092 18090 2168 1 6 . 1 1 42 42 LYS CA C 168 59.390 59.390 58.393 0.997 18090 2169 1 6 . 1 1 42 42 LYS CB C 168 31.580 31.580 32.762 -1.182 18090 2170 1 6 . 1 1 42 42 LYS H H 168 7.460 7.460 8.254 -0.794 18090 2171 1 6 . 1 1 43 43 GLN N N 169 113.750 113.750 116.045 -2.295 18090 2172 1 6 . 1 1 43 43 GLN HA H 169 4.220 4.220 4.155 0.065 18090 2173 1 6 . 1 1 43 43 GLN C C 169 175.840 175.840 177.395 -1.555 18090 2174 1 6 . 1 1 43 43 GLN CA C 169 56.230 56.230 58.086 -1.856 18090 2175 1 6 . 1 1 43 43 GLN CB C 169 29.290 29.290 29.325 -0.035 18090 2176 1 6 . 1 1 43 43 GLN H H 169 7.220 7.220 7.637 -0.417 18090 2177 1 6 . 1 1 44 44 ASN N N 170 114.130 114.130 116.204 -2.074 18090 2178 1 6 . 1 1 44 44 ASN HA H 170 5.050 5.050 4.936 0.114 18090 2179 1 6 . 1 1 44 44 ASN C C 170 172.200 172.200 173.629 -1.429 18090 2180 1 6 . 1 1 44 44 ASN CA C 170 50.780 50.780 53.487 -2.707 18090 2181 1 6 . 1 1 44 44 ASN CB C 170 38.380 38.380 39.539 -1.159 18090 2182 1 6 . 1 1 44 44 ASN H H 170 7.580 7.580 7.679 -0.099 18090 2183 1 6 . 1 1 45 45 PRO HA H 171 4.130 4.130 4.680 -0.550 18090 2184 1 6 . 1 1 45 45 PRO CA C 171 64.800 64.800 62.076 2.724 18090 2185 1 6 . 1 1 45 45 PRO CB C 171 31.360 31.360 31.910 -0.550 18090 2186 1 6 . 1 1 46 46 GLN N N 172 115.570 115.570 124.823 -9.253 18090 2187 1 6 . 1 1 46 46 GLN HA H 172 3.770 3.770 3.832 -0.062 18090 2188 1 6 . 1 1 46 46 GLN C C 172 177.360 177.360 177.622 -0.262 18090 2189 1 6 . 1 1 46 46 GLN CA C 172 57.950 57.950 58.232 -0.282 18090 2190 1 6 . 1 1 46 46 GLN CB C 172 27.050 27.050 27.652 -0.602 18090 2191 1 6 . 1 1 46 46 GLN H H 172 8.160 8.160 8.556 -0.396 18090 2192 1 6 . 1 1 47 47 ALA N N 173 121.420 121.420 121.857 -0.437 18090 2193 1 6 . 1 1 47 47 ALA HA H 173 4.050 4.050 4.163 -0.113 18090 2194 1 6 . 1 1 47 47 ALA C C 173 178.090 178.090 179.518 -1.428 18090 2195 1 6 . 1 1 47 47 ALA CA C 173 53.490 53.490 53.925 -0.435 18090 2196 1 6 . 1 1 47 47 ALA CB C 173 18.450 18.450 17.632 0.818 18090 2197 1 6 . 1 1 47 47 ALA H H 173 7.470 7.470 8.102 -0.632 18090 2198 1 6 . 1 1 48 48 ILE N N 174 118.050 118.050 118.705 -0.655 18090 2199 1 6 . 1 1 48 48 ILE HA H 174 3.180 3.180 3.886 -0.706 18090 2200 1 6 . 1 1 48 48 ILE C C 174 176.250 176.250 177.869 -1.619 18090 2201 1 6 . 1 1 48 48 ILE CA C 174 64.030 64.030 64.068 -0.038 18090 2202 1 6 . 1 1 48 48 ILE CB C 174 37.280 37.280 37.069 0.211 18090 2203 1 6 . 1 1 48 48 ILE H H 174 7.150 7.150 7.337 -0.187 18090 2204 1 6 . 1 1 49 49 GLY N N 175 105.390 105.390 106.603 -1.213 18090 2205 1 6 . 1 1 49 49 GLY C C 175 174.220 174.220 176.027 -1.807 18090 2206 1 6 . 1 1 49 49 GLY CA C 175 46.700 46.700 47.044 -0.344 18090 2207 1 6 . 1 1 49 49 GLY H H 175 7.550 7.550 7.803 -0.253 18090 2208 1 6 . 1 1 50 50 GLN N N 176 116.230 116.230 118.717 -2.487 18090 2209 1 6 . 1 1 50 50 GLN HA H 176 4.210 4.210 4.540 -0.330 18090 2210 1 6 . 1 1 50 50 GLN C C 176 178.120 178.120 178.326 -0.206 18090 2211 1 6 . 1 1 50 50 GLN CA C 176 57.320 57.320 58.023 -0.703 18090 2212 1 6 . 1 1 50 50 GLN CB C 176 28.630 28.630 29.182 -0.552 18090 2213 1 6 . 1 1 50 50 GLN H H 176 7.390 7.390 8.006 -0.616 18090 2214 1 6 . 1 1 51 51 ASP N N 177 120.000 120.000 121.046 -1.046 18090 2215 1 6 . 1 1 51 51 ASP HA H 177 4.420 4.420 4.625 -0.205 18090 2216 1 6 . 1 1 51 51 ASP C C 177 177.950 177.950 178.325 -0.375 18090 2217 1 6 . 1 1 51 51 ASP CA C 177 55.840 55.840 56.042 -0.202 18090 2218 1 6 . 1 1 51 51 ASP CB C 177 40.310 40.310 40.806 -0.496 18090 2219 1 6 . 1 1 51 51 ASP H H 177 7.870 7.870 7.905 -0.035 18090 2220 1 6 . 1 1 52 52 LEU N N 178 120.010 120.010 120.368 -0.358 18090 2221 1 6 . 1 1 52 52 LEU HA H 178 3.650 3.650 4.022 -0.372 18090 2222 1 6 . 1 1 52 52 LEU C C 178 175.810 175.810 178.741 -2.931 18090 2223 1 6 . 1 1 52 52 LEU CA C 178 57.620 57.620 57.708 -0.088 18090 2224 1 6 . 1 1 52 52 LEU CB C 178 41.880 41.880 41.798 0.082 18090 2225 1 6 . 1 1 52 52 LEU H H 178 7.860 7.860 7.620 0.240 18090 2226 1 6 . 1 1 53 53 PHE N N 179 110.580 110.580 114.383 -3.803 18090 2227 1 6 . 1 1 53 53 PHE HA H 179 4.230 4.230 4.328 -0.098 18090 2228 1 6 . 1 1 53 53 PHE C C 179 176.370 176.370 177.846 -1.476 18090 2229 1 6 . 1 1 53 53 PHE CA C 179 58.730 58.730 60.451 -1.721 18090 2230 1 6 . 1 1 53 53 PHE CB C 179 38.720 38.720 38.925 -0.205 18090 2231 1 6 . 1 1 53 53 PHE H H 179 7.210 7.210 7.992 -0.782 18090 2232 1 6 . 1 1 54 54 THR N N 180 108.190 108.190 107.371 0.819 18090 2233 1 6 . 1 1 54 54 THR HA H 180 4.300 4.300 4.306 -0.006 18090 2234 1 6 . 1 1 54 54 THR C C 180 174.400 174.400 174.840 -0.440 18090 2235 1 6 . 1 1 54 54 THR CA C 180 62.020 62.020 62.829 -0.809 18090 2236 1 6 . 1 1 54 54 THR CB C 180 69.730 69.730 69.662 0.068 18090 2237 1 6 . 1 1 54 54 THR H H 180 7.550 7.550 7.413 0.137 18090 2238 1 6 . 1 1 55 55 ASP N N 181 120.060 120.060 123.069 -3.009 18090 2239 1 6 . 1 1 55 55 ASP HA H 181 5.020 5.020 5.112 -0.092 18090 2240 1 6 . 1 1 55 55 ASP C C 181 174.120 174.120 174.921 -0.801 18090 2241 1 6 . 1 1 55 55 ASP CA C 181 50.560 50.560 50.608 -0.048 18090 2242 1 6 . 1 1 55 55 ASP CB C 181 41.190 41.190 42.798 -1.608 18090 2243 1 6 . 1 1 55 55 ASP H H 181 7.480 7.480 7.863 -0.383 18090 2244 1 6 . 1 1 56 56 PRO HA H 182 4.320 4.320 4.272 0.048 18090 2245 1 6 . 1 1 56 56 PRO CA C 182 64.280 64.280 64.892 -0.613 18090 2246 1 6 . 1 1 56 56 PRO CB C 182 31.980 31.980 32.383 -0.403 18090 2247 1 6 . 1 1 57 57 ARG N N 183 117.660 117.660 117.582 0.078 18090 2248 1 6 . 1 1 57 57 ARG HA H 183 3.960 3.960 4.068 -0.108 18090 2249 1 6 . 1 1 57 57 ARG C C 183 179.030 179.030 178.582 0.448 18090 2250 1 6 . 1 1 57 57 ARG CA C 183 59.000 59.000 58.883 0.117 18090 2251 1 6 . 1 1 57 57 ARG CB C 183 29.750 29.750 29.516 0.234 18090 2252 1 6 . 1 1 57 57 ARG H H 183 7.920 7.920 7.974 -0.054 18090 2253 1 6 . 1 1 58 58 LEU N N 184 115.670 115.670 119.498 -3.828 18090 2254 1 6 . 1 1 58 58 LEU HA H 184 3.850 3.850 3.962 -0.112 18090 2255 1 6 . 1 1 58 58 LEU C C 184 178.770 178.770 179.151 -0.381 18090 2256 1 6 . 1 1 58 58 LEU CA C 184 57.110 57.110 57.772 -0.662 18090 2257 1 6 . 1 1 58 58 LEU CB C 184 41.310 41.310 41.622 -0.312 18090 2258 1 6 . 1 1 58 58 LEU H H 184 7.750 7.750 8.192 -0.442 18090 2259 1 6 . 1 1 59 59 MET N N 185 118.570 118.570 116.291 2.279 18090 2260 1 6 . 1 1 59 59 MET HA H 185 4.060 4.060 4.143 -0.083 18090 2261 1 6 . 1 1 59 59 MET C C 185 177.540 177.540 178.236 -0.696 18090 2262 1 6 . 1 1 59 59 MET CA C 185 58.090 58.090 59.229 -1.139 18090 2263 1 6 . 1 1 59 59 MET CB C 185 31.270 31.270 32.310 -1.040 18090 2264 1 6 . 1 1 59 59 MET H H 185 7.590 7.590 7.691 -0.101 18090 2265 1 6 . 1 1 60 60 THR N N 186 116.390 116.390 117.868 -1.478 18090 2266 1 6 . 1 1 60 60 THR HA H 186 3.680 3.680 3.935 -0.255 18090 2267 1 6 . 1 1 60 60 THR C C 186 177.440 177.440 176.400 1.040 18090 2268 1 6 . 1 1 60 60 THR CA C 186 66.940 66.940 66.941 -0.001 18090 2269 1 6 . 1 1 60 60 THR CB C 186 68.030 68.030 68.571 -0.541 18090 2270 1 6 . 1 1 60 60 THR H H 186 7.180 7.180 7.789 -0.609 18090 2271 1 6 . 1 1 61 61 ILE N N 187 123.840 123.840 122.537 1.303 18090 2272 1 6 . 1 1 61 61 ILE HA H 187 3.290 3.290 3.725 -0.435 18090 2273 1 6 . 1 1 61 61 ILE C C 187 176.660 176.660 178.176 -1.516 18090 2274 1 6 . 1 1 61 61 ILE CA C 187 65.850 65.850 65.326 0.524 18090 2275 1 6 . 1 1 61 61 ILE CB C 187 37.640 37.640 37.746 -0.106 18090 2276 1 6 . 1 1 61 61 ILE H H 187 8.010 8.010 8.015 -0.005 18090 2277 1 6 . 1 1 62 62 MET N N 188 118.210 118.210 118.466 -0.256 18090 2278 1 6 . 1 1 62 62 MET HA H 188 3.910 3.910 4.033 -0.123 18090 2279 1 6 . 1 1 62 62 MET C C 188 177.540 177.540 178.386 -0.846 18090 2280 1 6 . 1 1 62 62 MET CA C 188 58.530 58.530 57.460 1.070 18090 2281 1 6 . 1 1 62 62 MET CB C 188 31.200 31.200 31.258 -0.058 18090 2282 1 6 . 1 1 62 62 MET H H 188 8.560 8.560 7.545 1.015 18090 2283 1 6 . 1 1 63 63 ALA N N 189 119.850 119.850 122.060 -2.210 18090 2284 1 6 . 1 1 63 63 ALA HA H 189 3.730 3.730 3.926 -0.196 18090 2285 1 6 . 1 1 63 63 ALA C C 189 179.550 179.550 179.422 0.128 18090 2286 1 6 . 1 1 63 63 ALA CA C 189 55.470 55.470 55.848 -0.378 18090 2287 1 6 . 1 1 63 63 ALA CB C 189 17.640 17.640 18.156 -0.516 18090 2288 1 6 . 1 1 63 63 ALA H H 189 8.210 8.210 8.207 0.003 18090 2289 1 6 . 1 1 64 64 THR N N 190 114.570 114.570 113.843 0.727 18090 2290 1 6 . 1 1 64 64 THR HA H 190 3.790 3.790 4.227 -0.437 18090 2291 1 6 . 1 1 64 64 THR C C 190 177.640 177.640 176.622 1.018 18090 2292 1 6 . 1 1 64 64 THR CA C 190 66.690 66.690 65.817 0.873 18090 2293 1 6 . 1 1 64 64 THR CB C 190 68.310 68.310 68.463 -0.153 18090 2294 1 6 . 1 1 64 64 THR H H 190 7.740 7.740 7.603 0.137 18090 2295 1 6 . 1 1 65 65 LEU N N 191 122.410 122.410 121.697 0.713 18090 2296 1 6 . 1 1 65 65 LEU HA H 191 3.930 3.930 4.013 -0.083 18090 2297 1 6 . 1 1 65 65 LEU C C 191 178.470 178.470 179.834 -1.364 18090 2298 1 6 . 1 1 65 65 LEU CA C 191 57.120 57.120 57.783 -0.663 18090 2299 1 6 . 1 1 65 65 LEU CB C 191 41.830 41.830 41.901 -0.071 18090 2300 1 6 . 1 1 65 65 LEU H H 191 8.180 8.180 7.639 0.541 18090 2301 1 6 . 1 1 66 66 MET N N 192 115.320 115.320 117.362 -2.042 18090 2302 1 6 . 1 1 66 66 MET HA H 192 4.090 4.090 4.293 -0.203 18090 2303 1 6 . 1 1 66 66 MET C C 192 176.090 176.090 178.311 -2.221 18090 2304 1 6 . 1 1 66 66 MET CA C 192 56.390 56.390 57.622 -1.232 18090 2305 1 6 . 1 1 66 66 MET CB C 192 33.770 33.770 32.026 1.744 18090 2306 1 6 . 1 1 66 66 MET H H 192 7.880 7.880 8.622 -0.742 18090 2307 1 6 . 1 1 67 67 GLY N N 193 107.490 107.490 104.912 2.578 18090 2308 1 6 . 1 1 67 67 GLY C C 193 174.390 174.390 175.124 -0.734 18090 2309 1 6 . 1 1 67 67 GLY CA C 193 45.880 45.880 44.928 0.952 18090 2310 1 6 . 1 1 67 67 GLY H H 193 7.580 7.580 7.983 -0.403 18090 2311 1 6 . 1 1 68 68 VAL N N 194 118.520 118.520 117.061 1.459 18090 2312 1 6 . 1 1 68 68 VAL HA H 194 3.940 3.940 3.605 0.335 18090 2313 1 6 . 1 1 68 68 VAL C C 194 174.760 174.760 174.814 -0.054 18090 2314 1 6 . 1 1 68 68 VAL CA C 194 61.510 61.510 64.059 -2.549 18090 2315 1 6 . 1 1 68 68 VAL CB C 194 32.670 32.670 30.626 2.044 18090 2316 1 6 . 1 1 68 68 VAL H H 194 7.840 7.840 7.531 0.309 18090 2317 1 6 . 1 1 69 69 ASP N N 195 124.550 124.550 117.995 6.555 18090 2318 1 6 . 1 1 69 69 ASP HA H 195 4.430 4.430 4.785 -0.355 18090 2319 1 6 . 1 1 69 69 ASP C C 195 175.140 175.140 175.574 -0.434 18090 2320 1 6 . 1 1 69 69 ASP CA C 195 53.760 53.760 54.938 -1.178 18090 2321 1 6 . 1 1 69 69 ASP CB C 195 40.920 40.920 42.082 -1.162 18090 2322 1 6 . 1 1 69 69 ASP H H 195 8.400 8.400 7.960 0.440 18090 2323 1 6 . 1 1 70 70 LEU N N 196 123.930 123.930 118.918 5.012 18090 2324 1 6 . 1 1 70 70 LEU HA H 196 4.200 4.200 4.418 -0.218 18090 2325 1 6 . 1 1 70 70 LEU C C 196 175.950 175.950 175.480 0.470 18090 2326 1 6 . 1 1 70 70 LEU CA C 196 54.380 54.380 55.500 -1.120 18090 2327 1 6 . 1 1 70 70 LEU CB C 196 41.610 41.610 43.206 -1.596 18090 2328 1 6 . 1 1 70 70 LEU H H 196 8.160 8.160 8.182 -0.022 18090 2329 1 7 . 1 1 2 2 PRO HA H 128 4.220 4.220 4.351 -0.131 18090 2330 1 7 . 1 1 2 2 PRO CA C 128 63.320 63.320 63.686 -0.366 18090 2331 1 7 . 1 1 2 2 PRO CB C 128 31.680 31.680 32.165 -0.485 18090 2332 1 7 . 1 1 3 3 ASP N N 129 119.320 119.320 118.152 1.168 18090 2333 1 7 . 1 1 3 3 ASP HA H 129 4.400 4.400 4.332 0.068 18090 2334 1 7 . 1 1 3 3 ASP C C 129 176.120 176.120 175.386 0.734 18090 2335 1 7 . 1 1 3 3 ASP CA C 129 54.050 54.050 54.675 -0.625 18090 2336 1 7 . 1 1 3 3 ASP CB C 129 40.770 40.770 40.283 0.486 18090 2337 1 7 . 1 1 3 3 ASP H H 129 8.310 8.310 8.381 -0.071 18090 2338 1 7 . 1 1 4 4 LEU N N 130 122.280 122.280 115.578 6.702 18090 2339 1 7 . 1 1 4 4 LEU HA H 130 4.130 4.130 3.955 0.175 18090 2340 1 7 . 1 1 4 4 LEU C C 130 177.280 177.280 177.628 -0.348 18090 2341 1 7 . 1 1 4 4 LEU CA C 130 55.350 55.350 55.818 -0.468 18090 2342 1 7 . 1 1 4 4 LEU CB C 130 41.490 41.490 42.170 -0.680 18090 2343 1 7 . 1 1 4 4 LEU H H 130 8.080 8.080 7.713 0.367 18090 2344 1 7 . 1 1 5 5 GLY N N 131 107.830 107.830 106.037 1.793 18090 2345 1 7 . 1 1 5 5 GLY C C 131 175.120 175.120 173.217 1.903 18090 2346 1 7 . 1 1 5 5 GLY CA C 131 45.300 45.300 45.316 -0.016 18090 2347 1 7 . 1 1 5 5 GLY H H 131 8.180 8.180 8.362 -0.182 18090 2348 1 7 . 1 1 6 6 LEU N N 132 121.080 121.080 116.173 4.907 18090 2349 1 7 . 1 1 6 6 LEU HA H 132 3.870 3.870 4.484 -0.614 18090 2350 1 7 . 1 1 6 6 LEU C C 132 178.000 178.000 177.642 0.358 18090 2351 1 7 . 1 1 6 6 LEU CA C 132 57.180 57.180 53.463 3.717 18090 2352 1 7 . 1 1 6 6 LEU CB C 132 41.870 41.870 44.781 -2.910 18090 2353 1 7 . 1 1 6 6 LEU H H 132 8.150 8.150 7.428 0.722 18090 2354 1 7 . 1 1 7 7 THR N N 133 111.580 111.580 113.834 -2.254 18090 2355 1 7 . 1 1 7 7 THR HA H 133 3.730 3.730 4.008 -0.278 18090 2356 1 7 . 1 1 7 7 THR C C 133 176.530 176.530 176.009 0.521 18090 2357 1 7 . 1 1 7 7 THR CA C 133 65.940 65.940 66.038 -0.098 18090 2358 1 7 . 1 1 7 7 THR CB C 133 68.130 68.130 68.546 -0.416 18090 2359 1 7 . 1 1 7 7 THR H H 133 7.970 7.970 8.705 -0.735 18090 2360 1 7 . 1 1 8 8 GLN N N 134 119.490 119.490 121.312 -1.822 18090 2361 1 7 . 1 1 8 8 GLN HA H 134 3.990 3.990 3.912 0.078 18090 2362 1 7 . 1 1 8 8 GLN C C 134 178.190 178.190 178.291 -0.101 18090 2363 1 7 . 1 1 8 8 GLN CA C 134 57.930 57.930 58.734 -0.804 18090 2364 1 7 . 1 1 8 8 GLN CB C 134 27.850 27.850 27.917 -0.067 18090 2365 1 7 . 1 1 8 8 GLN H H 134 7.890 7.890 8.340 -0.450 18090 2366 1 7 . 1 1 9 9 LEU N N 135 120.170 120.170 118.059 2.111 18090 2367 1 7 . 1 1 9 9 LEU HA H 135 3.820 3.820 3.942 -0.122 18090 2368 1 7 . 1 1 9 9 LEU C C 135 177.810 177.810 178.342 -0.532 18090 2369 1 7 . 1 1 9 9 LEU CA C 135 57.470 57.470 57.158 0.312 18090 2370 1 7 . 1 1 9 9 LEU CB C 135 41.640 41.640 41.923 -0.283 18090 2371 1 7 . 1 1 9 9 LEU H H 135 7.600 7.600 7.261 0.339 18090 2372 1 7 . 1 1 10 10 PHE N N 136 111.950 111.950 113.088 -1.138 18090 2373 1 7 . 1 1 10 10 PHE HA H 136 4.380 4.380 4.412 -0.032 18090 2374 1 7 . 1 1 10 10 PHE C C 136 174.990 174.990 176.932 -1.942 18090 2375 1 7 . 1 1 10 10 PHE CA C 136 58.450 58.450 57.421 1.029 18090 2376 1 7 . 1 1 10 10 PHE CB C 136 38.570 38.570 37.954 0.616 18090 2377 1 7 . 1 1 10 10 PHE H H 136 7.410 7.410 6.557 0.853 18090 2378 1 7 . 1 1 11 11 ALA N N 137 120.230 120.230 122.209 -1.979 18090 2379 1 7 . 1 1 11 11 ALA HA H 137 4.130 4.130 4.064 0.066 18090 2380 1 7 . 1 1 11 11 ALA C C 137 177.090 177.090 178.265 -1.175 18090 2381 1 7 . 1 1 11 11 ALA CA C 137 52.580 52.580 53.563 -0.983 18090 2382 1 7 . 1 1 11 11 ALA CB C 137 18.660 18.660 18.752 -0.092 18090 2383 1 7 . 1 1 11 11 ALA H H 137 7.330 7.330 8.540 -1.210 18090 2384 1 7 . 1 1 12 12 ASP N N 138 119.830 119.830 120.590 -0.760 18090 2385 1 7 . 1 1 12 12 ASP HA H 138 4.510 4.510 4.714 -0.204 18090 2386 1 7 . 1 1 12 12 ASP C C 138 176.370 176.370 174.846 1.524 18090 2387 1 7 . 1 1 12 12 ASP CA C 138 51.960 51.960 52.800 -0.840 18090 2388 1 7 . 1 1 12 12 ASP CB C 138 41.990 41.990 41.583 0.408 18090 2389 1 7 . 1 1 12 12 ASP H H 138 6.980 6.980 7.644 -0.664 18090 2390 1 7 . 1 1 13 13 PRO HA H 139 4.260 4.260 4.427 -0.167 18090 2391 1 7 . 1 1 13 13 PRO CA C 139 64.350 64.350 63.204 1.146 18090 2392 1 7 . 1 1 13 13 PRO CB C 139 31.760 31.760 32.285 -0.525 18090 2393 1 7 . 1 1 14 14 ASN N N 140 116.840 116.840 118.089 -1.249 18090 2394 1 7 . 1 1 14 14 ASN HA H 140 4.840 4.840 4.473 0.367 18090 2395 1 7 . 1 1 14 14 ASN C C 140 173.840 173.840 175.631 -1.791 18090 2396 1 7 . 1 1 14 14 ASN CA C 140 52.380 52.380 54.032 -1.653 18090 2397 1 7 . 1 1 14 14 ASN CB C 140 38.330 38.330 36.806 1.524 18090 2398 1 7 . 1 1 14 14 ASN H H 140 8.670 8.670 8.725 -0.055 18090 2399 1 7 . 1 1 15 15 LEU N N 141 120.290 120.290 120.159 0.131 18090 2400 1 7 . 1 1 15 15 LEU HA H 141 3.790 3.790 4.536 -0.746 18090 2401 1 7 . 1 1 15 15 LEU C C 141 177.120 177.120 177.512 -0.392 18090 2402 1 7 . 1 1 15 15 LEU CA C 141 59.280 59.280 55.518 3.762 18090 2403 1 7 . 1 1 15 15 LEU CB C 141 42.980 42.980 43.157 -0.177 18090 2404 1 7 . 1 1 15 15 LEU H H 141 7.200 7.200 8.364 -1.164 18090 2405 1 7 . 1 1 16 16 ILE N N 142 115.290 115.290 120.600 -5.310 18090 2406 1 7 . 1 1 16 16 ILE HA H 142 3.480 3.480 3.666 -0.186 18090 2407 1 7 . 1 1 16 16 ILE C C 142 177.990 177.990 177.468 0.522 18090 2408 1 7 . 1 1 16 16 ILE CA C 142 62.690 62.690 65.328 -2.638 18090 2409 1 7 . 1 1 16 16 ILE CB C 142 34.620 34.620 37.752 -3.132 18090 2410 1 7 . 1 1 16 16 ILE H H 142 7.940 7.940 8.422 -0.482 18090 2411 1 7 . 1 1 17 17 GLU N N 143 119.600 119.600 119.096 0.504 18090 2412 1 7 . 1 1 17 17 GLU HA H 143 3.700 3.700 3.993 -0.292 18090 2413 1 7 . 1 1 17 17 GLU C C 143 179.170 179.170 178.774 0.396 18090 2414 1 7 . 1 1 17 17 GLU CA C 143 59.360 59.360 60.150 -0.790 18090 2415 1 7 . 1 1 17 17 GLU CB C 143 28.520 28.520 29.202 -0.682 18090 2416 1 7 . 1 1 17 17 GLU H H 143 7.970 7.970 8.567 -0.597 18090 2417 1 7 . 1 1 18 18 ASN N N 144 117.170 117.170 117.899 -0.729 18090 2418 1 7 . 1 1 18 18 ASN HA H 144 4.270 4.270 4.453 -0.183 18090 2419 1 7 . 1 1 18 18 ASN C C 144 179.120 179.120 177.814 1.306 18090 2420 1 7 . 1 1 18 18 ASN CA C 144 55.490 55.490 55.645 -0.155 18090 2421 1 7 . 1 1 18 18 ASN CB C 144 36.550 36.550 37.822 -1.272 18090 2422 1 7 . 1 1 18 18 ASN H H 144 8.450 8.450 8.375 0.075 18090 2423 1 7 . 1 1 19 19 LEU N N 145 121.060 121.060 120.149 0.911 18090 2424 1 7 . 1 1 19 19 LEU HA H 145 4.020 4.020 3.994 0.026 18090 2425 1 7 . 1 1 19 19 LEU C C 145 180.260 180.260 178.532 1.728 18090 2426 1 7 . 1 1 19 19 LEU CA C 145 56.620 56.620 57.395 -0.775 18090 2427 1 7 . 1 1 19 19 LEU CB C 145 41.780 41.780 41.552 0.228 18090 2428 1 7 . 1 1 19 19 LEU H H 145 7.990 7.990 7.545 0.445 18090 2429 1 7 . 1 1 20 20 LYS N N 146 118.960 118.960 118.191 0.769 18090 2430 1 7 . 1 1 20 20 LYS HA H 146 3.610 3.610 3.954 -0.344 18090 2431 1 7 . 1 1 20 20 LYS C C 146 177.390 177.390 178.257 -0.867 18090 2432 1 7 . 1 1 20 20 LYS CA C 146 59.640 59.640 59.345 0.295 18090 2433 1 7 . 1 1 20 20 LYS CB C 146 32.450 32.450 32.426 0.024 18090 2434 1 7 . 1 1 20 20 LYS H H 146 8.250 8.250 7.950 0.300 18090 2435 1 7 . 1 1 21 21 LYS N N 147 114.720 114.720 116.241 -1.521 18090 2436 1 7 . 1 1 21 21 LYS HA H 147 4.110 4.110 4.224 -0.114 18090 2437 1 7 . 1 1 21 21 LYS C C 147 175.880 175.880 178.449 -2.569 18090 2438 1 7 . 1 1 21 21 LYS CA C 147 56.210 56.210 58.156 -1.946 18090 2439 1 7 . 1 1 21 21 LYS CB C 147 33.000 33.000 32.810 0.190 18090 2440 1 7 . 1 1 21 21 LYS H H 147 7.130 7.130 7.579 -0.449 18090 2441 1 7 . 1 1 22 22 ASN N N 148 122.180 122.180 115.486 6.694 18090 2442 1 7 . 1 1 22 22 ASN HA H 148 4.740 4.740 4.906 -0.166 18090 2443 1 7 . 1 1 22 22 ASN C C 148 174.000 174.000 173.528 0.472 18090 2444 1 7 . 1 1 22 22 ASN CA C 148 50.970 50.970 52.796 -1.826 18090 2445 1 7 . 1 1 22 22 ASN CB C 148 38.670 38.670 38.923 -0.253 18090 2446 1 7 . 1 1 22 22 ASN H H 148 6.930 6.930 7.856 -0.926 18090 2447 1 7 . 1 1 23 23 PRO HA H 149 4.300 4.300 4.734 -0.434 18090 2448 1 7 . 1 1 23 23 PRO CA C 149 64.610 64.610 61.800 2.810 18090 2449 1 7 . 1 1 23 23 PRO CB C 149 32.000 32.000 34.504 -2.503 18090 2450 1 7 . 1 1 24 24 LYS N N 150 116.060 116.060 121.187 -5.127 18090 2451 1 7 . 1 1 24 24 LYS HA H 150 4.070 4.070 3.942 0.128 18090 2452 1 7 . 1 1 24 24 LYS C C 150 178.240 178.240 178.561 -0.321 18090 2453 1 7 . 1 1 24 24 LYS CA C 150 57.950 57.950 59.679 -1.729 18090 2454 1 7 . 1 1 24 24 LYS CB C 150 32.590 32.590 31.900 0.690 18090 2455 1 7 . 1 1 24 24 LYS H H 150 8.520 8.520 8.821 -0.301 18090 2456 1 7 . 1 1 25 25 THR N N 151 105.190 105.190 109.975 -4.785 18090 2457 1 7 . 1 1 25 25 THR HA H 151 4.390 4.390 4.046 0.344 18090 2458 1 7 . 1 1 25 25 THR C C 151 176.090 176.090 176.373 -0.283 18090 2459 1 7 . 1 1 25 25 THR CA C 151 61.400 61.400 64.663 -3.263 18090 2460 1 7 . 1 1 25 25 THR CB C 151 69.440 69.440 67.796 1.644 18090 2461 1 7 . 1 1 25 25 THR H H 151 7.490 7.490 8.152 -0.662 18090 2462 1 7 . 1 1 26 26 SER N N 152 119.700 119.700 116.435 3.265 18090 2463 1 7 . 1 1 26 26 SER HA H 152 3.770 3.770 4.141 -0.371 18090 2464 1 7 . 1 1 26 26 SER C C 152 177.470 177.470 175.997 1.473 18090 2465 1 7 . 1 1 26 26 SER CA C 152 62.450 62.450 61.320 1.130 18090 2466 1 7 . 1 1 26 26 SER CB C 152 62.520 62.520 62.713 -0.193 18090 2467 1 7 . 1 1 26 26 SER H H 152 8.190 8.190 7.926 0.264 18090 2468 1 7 . 1 1 27 27 GLU N N 153 119.870 119.870 122.773 -2.903 18090 2469 1 7 . 1 1 27 27 GLU HA H 153 3.890 3.890 3.959 -0.069 18090 2470 1 7 . 1 1 27 27 GLU C C 153 180.040 180.040 178.709 1.331 18090 2471 1 7 . 1 1 27 27 GLU CA C 153 58.700 58.700 59.356 -0.656 18090 2472 1 7 . 1 1 27 27 GLU CB C 153 28.590 28.590 29.454 -0.864 18090 2473 1 7 . 1 1 27 27 GLU H H 153 8.350 8.350 7.793 0.557 18090 2474 1 7 . 1 1 28 28 MET N N 154 119.430 119.430 116.996 2.434 18090 2475 1 7 . 1 1 28 28 MET HA H 154 4.040 4.040 4.169 -0.129 18090 2476 1 7 . 1 1 28 28 MET C C 154 177.110 177.110 178.147 -1.037 18090 2477 1 7 . 1 1 28 28 MET CA C 154 58.510 58.510 58.627 -0.117 18090 2478 1 7 . 1 1 28 28 MET CB C 154 31.430 31.430 32.740 -1.310 18090 2479 1 7 . 1 1 28 28 MET H H 154 7.850 7.850 7.638 0.212 18090 2480 1 7 . 1 1 29 29 MET N N 155 112.640 112.640 114.334 -1.694 18090 2481 1 7 . 1 1 29 29 MET HA H 155 4.340 4.340 4.253 0.088 18090 2482 1 7 . 1 1 29 29 MET C C 155 175.530 175.530 177.806 -2.276 18090 2483 1 7 . 1 1 29 29 MET CA C 155 53.790 53.790 57.161 -3.371 18090 2484 1 7 . 1 1 29 29 MET CB C 155 30.380 30.380 32.068 -1.688 18090 2485 1 7 . 1 1 29 29 MET H H 155 7.200 7.200 7.345 -0.145 18090 2486 1 7 . 1 1 30 30 LYS N N 156 117.050 117.050 116.637 0.413 18090 2487 1 7 . 1 1 30 30 LYS HA H 156 3.960 3.960 4.276 -0.316 18090 2488 1 7 . 1 1 30 30 LYS C C 156 176.120 176.120 177.128 -1.008 18090 2489 1 7 . 1 1 30 30 LYS CA C 156 57.090 57.090 57.283 -0.193 18090 2490 1 7 . 1 1 30 30 LYS CB C 156 31.960 31.960 32.982 -1.022 18090 2491 1 7 . 1 1 30 30 LYS H H 156 7.130 7.130 7.623 -0.493 18090 2492 1 7 . 1 1 31 31 ASP N N 157 119.810 119.810 118.568 1.242 18090 2493 1 7 . 1 1 31 31 ASP HA H 157 4.860 4.860 4.982 -0.122 18090 2494 1 7 . 1 1 31 31 ASP C C 157 174.890 174.890 174.520 0.370 18090 2495 1 7 . 1 1 31 31 ASP CA C 157 50.520 50.520 54.264 -3.744 18090 2496 1 7 . 1 1 31 31 ASP CB C 157 41.010 41.010 40.544 0.466 18090 2497 1 7 . 1 1 31 31 ASP H H 157 7.340 7.340 7.742 -0.402 18090 2498 1 7 . 1 1 32 32 PRO HA H 158 4.130 4.130 4.472 -0.342 18090 2499 1 7 . 1 1 32 32 PRO CA C 158 64.270 64.270 62.935 1.335 18090 2500 1 7 . 1 1 32 32 PRO CB C 158 31.770 31.770 32.395 -0.625 18090 2501 1 7 . 1 1 33 33 GLN N N 159 117.760 117.760 120.259 -2.499 18090 2502 1 7 . 1 1 33 33 GLN HA H 159 4.000 4.000 4.039 -0.039 18090 2503 1 7 . 1 1 33 33 GLN C C 159 178.740 178.740 177.951 0.789 18090 2504 1 7 . 1 1 33 33 GLN CA C 159 58.220 58.220 58.058 0.162 18090 2505 1 7 . 1 1 33 33 GLN CB C 159 27.870 27.870 28.077 -0.207 18090 2506 1 7 . 1 1 33 33 GLN H H 159 8.150 8.150 8.770 -0.620 18090 2507 1 7 . 1 1 34 34 LEU N N 160 123.300 123.300 120.004 3.296 18090 2508 1 7 . 1 1 34 34 LEU HA H 160 3.970 3.970 4.012 -0.042 18090 2509 1 7 . 1 1 34 34 LEU C C 160 177.980 177.980 178.186 -0.206 18090 2510 1 7 . 1 1 34 34 LEU CA C 160 57.050 57.050 57.463 -0.413 18090 2511 1 7 . 1 1 34 34 LEU CB C 160 40.760 40.760 41.593 -0.833 18090 2512 1 7 . 1 1 34 34 LEU H H 160 7.110 7.110 7.973 -0.863 18090 2513 1 7 . 1 1 35 35 VAL N N 161 118.390 118.390 119.754 -1.364 18090 2514 1 7 . 1 1 35 35 VAL HA H 161 3.110 3.110 3.563 -0.453 18090 2515 1 7 . 1 1 35 35 VAL C C 161 176.840 176.840 177.752 -0.912 18090 2516 1 7 . 1 1 35 35 VAL CA C 161 67.700 67.700 66.629 1.071 18090 2517 1 7 . 1 1 35 35 VAL CB C 161 31.260 31.260 30.741 0.519 18090 2518 1 7 . 1 1 35 35 VAL H H 161 7.430 7.430 7.416 0.014 18090 2519 1 7 . 1 1 36 36 ALA N N 162 117.600 117.600 121.310 -3.710 18090 2520 1 7 . 1 1 36 36 ALA HA H 162 3.810 3.810 3.950 -0.140 18090 2521 1 7 . 1 1 36 36 ALA C C 162 180.620 180.620 179.736 0.884 18090 2522 1 7 . 1 1 36 36 ALA CA C 162 54.720 54.720 55.364 -0.644 18090 2523 1 7 . 1 1 36 36 ALA CB C 162 17.490 17.490 18.115 -0.625 18090 2524 1 7 . 1 1 36 36 ALA H H 162 7.500 7.500 7.774 -0.274 18090 2525 1 7 . 1 1 37 37 LYS N N 163 119.880 119.880 118.515 1.365 18090 2526 1 7 . 1 1 37 37 LYS HA H 163 3.570 3.570 3.987 -0.417 18090 2527 1 7 . 1 1 37 37 LYS C C 163 177.800 177.800 179.117 -1.317 18090 2528 1 7 . 1 1 37 37 LYS CA C 163 58.880 58.880 58.940 -0.060 18090 2529 1 7 . 1 1 37 37 LYS CB C 163 31.610 31.610 32.039 -0.429 18090 2530 1 7 . 1 1 37 37 LYS H H 163 7.350 7.350 7.419 -0.069 18090 2531 1 7 . 1 1 38 38 LEU N N 164 118.020 118.020 120.014 -1.994 18090 2532 1 7 . 1 1 38 38 LEU HA H 164 3.670 3.670 4.068 -0.398 18090 2533 1 7 . 1 1 38 38 LEU C C 164 179.380 179.380 179.229 0.151 18090 2534 1 7 . 1 1 38 38 LEU CA C 164 57.340 57.340 57.754 -0.414 18090 2535 1 7 . 1 1 38 38 LEU CB C 164 41.660 41.660 41.708 -0.048 18090 2536 1 7 . 1 1 38 38 LEU H H 164 7.660 7.660 8.166 -0.506 18090 2537 1 7 . 1 1 39 39 ILE N N 165 118.070 118.070 119.406 -1.336 18090 2538 1 7 . 1 1 39 39 ILE HA H 165 3.510 3.510 3.613 -0.103 18090 2539 1 7 . 1 1 39 39 ILE C C 165 179.570 179.570 178.290 1.280 18090 2540 1 7 . 1 1 39 39 ILE CA C 165 64.450 64.450 65.628 -1.178 18090 2541 1 7 . 1 1 39 39 ILE CB C 165 37.310 37.310 37.505 -0.195 18090 2542 1 7 . 1 1 39 39 ILE H H 165 8.030 8.030 7.960 0.070 18090 2543 1 7 . 1 1 40 40 GLY N N 166 107.970 107.970 107.856 0.114 18090 2544 1 7 . 1 1 40 40 GLY C C 166 176.470 176.470 175.605 0.865 18090 2545 1 7 . 1 1 40 40 GLY CA C 166 46.410 46.410 47.042 -0.632 18090 2546 1 7 . 1 1 40 40 GLY H H 166 7.590 7.590 7.708 -0.118 18090 2547 1 7 . 1 1 41 41 TYR N N 167 121.270 121.270 122.370 -1.100 18090 2548 1 7 . 1 1 41 41 TYR HA H 167 4.190 4.190 4.210 -0.020 18090 2549 1 7 . 1 1 41 41 TYR C C 167 176.470 176.470 176.241 0.229 18090 2550 1 7 . 1 1 41 41 TYR CA C 167 57.130 57.130 60.439 -3.309 18090 2551 1 7 . 1 1 41 41 TYR CB C 167 35.950 35.950 38.235 -2.285 18090 2552 1 7 . 1 1 41 41 TYR H H 167 7.350 7.350 7.894 -0.544 18090 2553 1 7 . 1 1 42 42 LYS N N 168 116.520 116.520 116.105 0.415 18090 2554 1 7 . 1 1 42 42 LYS HA H 168 3.820 3.820 4.049 -0.229 18090 2555 1 7 . 1 1 42 42 LYS C C 168 177.810 177.810 177.934 -0.124 18090 2556 1 7 . 1 1 42 42 LYS CA C 168 59.390 59.390 58.434 0.956 18090 2557 1 7 . 1 1 42 42 LYS CB C 168 31.580 31.580 32.745 -1.165 18090 2558 1 7 . 1 1 42 42 LYS H H 168 7.460 7.460 8.279 -0.819 18090 2559 1 7 . 1 1 43 43 GLN N N 169 113.750 113.750 115.960 -2.210 18090 2560 1 7 . 1 1 43 43 GLN HA H 169 4.220 4.220 4.160 0.060 18090 2561 1 7 . 1 1 43 43 GLN C C 169 175.840 175.840 177.112 -1.272 18090 2562 1 7 . 1 1 43 43 GLN CA C 169 56.230 56.230 58.176 -1.946 18090 2563 1 7 . 1 1 43 43 GLN CB C 169 29.290 29.290 29.453 -0.163 18090 2564 1 7 . 1 1 43 43 GLN H H 169 7.220 7.220 7.602 -0.382 18090 2565 1 7 . 1 1 44 44 ASN N N 170 114.130 114.130 116.086 -1.956 18090 2566 1 7 . 1 1 44 44 ASN HA H 170 5.050 5.050 4.992 0.059 18090 2567 1 7 . 1 1 44 44 ASN C C 170 172.200 172.200 173.643 -1.443 18090 2568 1 7 . 1 1 44 44 ASN CA C 170 50.780 50.780 53.408 -2.628 18090 2569 1 7 . 1 1 44 44 ASN CB C 170 38.380 38.380 39.977 -1.597 18090 2570 1 7 . 1 1 44 44 ASN H H 170 7.580 7.580 7.617 -0.037 18090 2571 1 7 . 1 1 45 45 PRO HA H 171 4.130 4.130 4.690 -0.560 18090 2572 1 7 . 1 1 45 45 PRO CA C 171 64.800 64.800 62.221 2.579 18090 2573 1 7 . 1 1 45 45 PRO CB C 171 31.360 31.360 31.800 -0.440 18090 2574 1 7 . 1 1 46 46 GLN N N 172 115.570 115.570 122.970 -7.400 18090 2575 1 7 . 1 1 46 46 GLN HA H 172 3.770 3.770 3.774 -0.004 18090 2576 1 7 . 1 1 46 46 GLN C C 172 177.360 177.360 177.606 -0.246 18090 2577 1 7 . 1 1 46 46 GLN CA C 172 57.950 57.950 58.165 -0.215 18090 2578 1 7 . 1 1 46 46 GLN CB C 172 27.050 27.050 27.895 -0.845 18090 2579 1 7 . 1 1 46 46 GLN H H 172 8.160 8.160 8.701 -0.541 18090 2580 1 7 . 1 1 47 47 ALA N N 173 121.420 121.420 121.598 -0.178 18090 2581 1 7 . 1 1 47 47 ALA HA H 173 4.050 4.050 4.170 -0.120 18090 2582 1 7 . 1 1 47 47 ALA C C 173 178.090 178.090 179.473 -1.383 18090 2583 1 7 . 1 1 47 47 ALA CA C 173 53.490 53.490 54.326 -0.836 18090 2584 1 7 . 1 1 47 47 ALA CB C 173 18.450 18.450 17.638 0.812 18090 2585 1 7 . 1 1 47 47 ALA H H 173 7.470 7.470 8.271 -0.801 18090 2586 1 7 . 1 1 48 48 ILE N N 174 118.050 118.050 118.693 -0.643 18090 2587 1 7 . 1 1 48 48 ILE HA H 174 3.180 3.180 3.877 -0.697 18090 2588 1 7 . 1 1 48 48 ILE C C 174 176.250 176.250 177.876 -1.626 18090 2589 1 7 . 1 1 48 48 ILE CA C 174 64.030 64.030 64.053 -0.023 18090 2590 1 7 . 1 1 48 48 ILE CB C 174 37.280 37.280 37.091 0.189 18090 2591 1 7 . 1 1 48 48 ILE H H 174 7.150 7.150 7.340 -0.190 18090 2592 1 7 . 1 1 49 49 GLY N N 175 105.390 105.390 106.852 -1.462 18090 2593 1 7 . 1 1 49 49 GLY C C 175 174.220 174.220 176.244 -2.024 18090 2594 1 7 . 1 1 49 49 GLY CA C 175 46.700 46.700 47.125 -0.425 18090 2595 1 7 . 1 1 49 49 GLY H H 175 7.550 7.550 7.830 -0.280 18090 2596 1 7 . 1 1 50 50 GLN N N 176 116.230 116.230 118.439 -2.209 18090 2597 1 7 . 1 1 50 50 GLN HA H 176 4.210 4.210 4.711 -0.501 18090 2598 1 7 . 1 1 50 50 GLN C C 176 178.120 178.120 178.263 -0.143 18090 2599 1 7 . 1 1 50 50 GLN CA C 176 57.320 57.320 57.994 -0.674 18090 2600 1 7 . 1 1 50 50 GLN CB C 176 28.630 28.630 28.865 -0.235 18090 2601 1 7 . 1 1 50 50 GLN H H 176 7.390 7.390 7.999 -0.609 18090 2602 1 7 . 1 1 51 51 ASP N N 177 120.000 120.000 121.302 -1.302 18090 2603 1 7 . 1 1 51 51 ASP HA H 177 4.420 4.420 4.675 -0.255 18090 2604 1 7 . 1 1 51 51 ASP C C 177 177.950 177.950 178.448 -0.498 18090 2605 1 7 . 1 1 51 51 ASP CA C 177 55.840 55.840 56.066 -0.226 18090 2606 1 7 . 1 1 51 51 ASP CB C 177 40.310 40.310 40.903 -0.593 18090 2607 1 7 . 1 1 51 51 ASP H H 177 7.870 7.870 7.929 -0.059 18090 2608 1 7 . 1 1 52 52 LEU N N 178 120.010 120.010 120.368 -0.358 18090 2609 1 7 . 1 1 52 52 LEU HA H 178 3.650 3.650 3.975 -0.325 18090 2610 1 7 . 1 1 52 52 LEU C C 178 175.810 175.810 178.238 -2.428 18090 2611 1 7 . 1 1 52 52 LEU CA C 178 57.620 57.620 57.830 -0.210 18090 2612 1 7 . 1 1 52 52 LEU CB C 178 41.880 41.880 41.662 0.218 18090 2613 1 7 . 1 1 52 52 LEU H H 178 7.860 7.860 7.650 0.210 18090 2614 1 7 . 1 1 53 53 PHE N N 179 110.580 110.580 113.562 -2.982 18090 2615 1 7 . 1 1 53 53 PHE HA H 179 4.230 4.230 4.322 -0.092 18090 2616 1 7 . 1 1 53 53 PHE C C 179 176.370 176.370 177.953 -1.583 18090 2617 1 7 . 1 1 53 53 PHE CA C 179 58.730 58.730 60.453 -1.723 18090 2618 1 7 . 1 1 53 53 PHE CB C 179 38.720 38.720 38.911 -0.191 18090 2619 1 7 . 1 1 53 53 PHE H H 179 7.210 7.210 7.868 -0.658 18090 2620 1 7 . 1 1 54 54 THR N N 180 108.190 108.190 108.195 -0.005 18090 2621 1 7 . 1 1 54 54 THR HA H 180 4.300 4.300 4.296 0.004 18090 2622 1 7 . 1 1 54 54 THR C C 180 174.400 174.400 174.997 -0.597 18090 2623 1 7 . 1 1 54 54 THR CA C 180 62.020 62.020 62.819 -0.799 18090 2624 1 7 . 1 1 54 54 THR CB C 180 69.730 69.730 69.815 -0.085 18090 2625 1 7 . 1 1 54 54 THR H H 180 7.550 7.550 7.533 0.017 18090 2626 1 7 . 1 1 55 55 ASP N N 181 120.060 120.060 122.986 -2.926 18090 2627 1 7 . 1 1 55 55 ASP HA H 181 5.020 5.020 5.085 -0.065 18090 2628 1 7 . 1 1 55 55 ASP C C 181 174.120 174.120 175.173 -1.053 18090 2629 1 7 . 1 1 55 55 ASP CA C 181 50.560 50.560 50.441 0.119 18090 2630 1 7 . 1 1 55 55 ASP CB C 181 41.190 41.190 43.066 -1.876 18090 2631 1 7 . 1 1 55 55 ASP H H 181 7.480 7.480 7.969 -0.489 18090 2632 1 7 . 1 1 56 56 PRO HA H 182 4.320 4.320 4.341 -0.021 18090 2633 1 7 . 1 1 56 56 PRO CA C 182 64.280 64.280 64.859 -0.579 18090 2634 1 7 . 1 1 56 56 PRO CB C 182 31.980 31.980 32.498 -0.518 18090 2635 1 7 . 1 1 57 57 ARG N N 183 117.660 117.660 118.479 -0.819 18090 2636 1 7 . 1 1 57 57 ARG HA H 183 3.960 3.960 4.092 -0.132 18090 2637 1 7 . 1 1 57 57 ARG C C 183 179.030 179.030 178.574 0.456 18090 2638 1 7 . 1 1 57 57 ARG CA C 183 59.000 59.000 58.775 0.225 18090 2639 1 7 . 1 1 57 57 ARG CB C 183 29.750 29.750 29.306 0.444 18090 2640 1 7 . 1 1 57 57 ARG H H 183 7.920 7.920 8.321 -0.401 18090 2641 1 7 . 1 1 58 58 LEU N N 184 115.670 115.670 119.141 -3.471 18090 2642 1 7 . 1 1 58 58 LEU HA H 184 3.850 3.850 3.940 -0.090 18090 2643 1 7 . 1 1 58 58 LEU C C 184 178.770 178.770 179.019 -0.249 18090 2644 1 7 . 1 1 58 58 LEU CA C 184 57.110 57.110 57.690 -0.580 18090 2645 1 7 . 1 1 58 58 LEU CB C 184 41.310 41.310 41.496 -0.186 18090 2646 1 7 . 1 1 58 58 LEU H H 184 7.750 7.750 8.158 -0.408 18090 2647 1 7 . 1 1 59 59 MET N N 185 118.570 118.570 116.297 2.273 18090 2648 1 7 . 1 1 59 59 MET HA H 185 4.060 4.060 4.120 -0.060 18090 2649 1 7 . 1 1 59 59 MET C C 185 177.540 177.540 178.247 -0.707 18090 2650 1 7 . 1 1 59 59 MET CA C 185 58.090 58.090 59.329 -1.239 18090 2651 1 7 . 1 1 59 59 MET CB C 185 31.270 31.270 32.255 -0.985 18090 2652 1 7 . 1 1 59 59 MET H H 185 7.590 7.590 7.701 -0.111 18090 2653 1 7 . 1 1 60 60 THR N N 186 116.390 116.390 117.813 -1.423 18090 2654 1 7 . 1 1 60 60 THR HA H 186 3.680 3.680 3.952 -0.272 18090 2655 1 7 . 1 1 60 60 THR C C 186 177.440 177.440 176.607 0.833 18090 2656 1 7 . 1 1 60 60 THR CA C 186 66.940 66.940 66.648 0.292 18090 2657 1 7 . 1 1 60 60 THR CB C 186 68.030 68.030 68.465 -0.435 18090 2658 1 7 . 1 1 60 60 THR H H 186 7.180 7.180 7.704 -0.524 18090 2659 1 7 . 1 1 61 61 ILE N N 187 123.840 123.840 121.974 1.866 18090 2660 1 7 . 1 1 61 61 ILE HA H 187 3.290 3.290 3.755 -0.465 18090 2661 1 7 . 1 1 61 61 ILE C C 187 176.660 176.660 178.234 -1.574 18090 2662 1 7 . 1 1 61 61 ILE CA C 187 65.850 65.850 65.533 0.317 18090 2663 1 7 . 1 1 61 61 ILE CB C 187 37.640 37.640 37.840 -0.201 18090 2664 1 7 . 1 1 61 61 ILE H H 187 8.010 8.010 7.885 0.125 18090 2665 1 7 . 1 1 62 62 MET N N 188 118.210 118.210 118.358 -0.148 18090 2666 1 7 . 1 1 62 62 MET HA H 188 3.910 3.910 4.011 -0.101 18090 2667 1 7 . 1 1 62 62 MET C C 188 177.540 177.540 178.413 -0.873 18090 2668 1 7 . 1 1 62 62 MET CA C 188 58.530 58.530 58.916 -0.386 18090 2669 1 7 . 1 1 62 62 MET CB C 188 31.200 31.200 31.576 -0.376 18090 2670 1 7 . 1 1 62 62 MET H H 188 8.560 8.560 7.412 1.148 18090 2671 1 7 . 1 1 63 63 ALA N N 189 119.850 119.850 122.102 -2.252 18090 2672 1 7 . 1 1 63 63 ALA HA H 189 3.730 3.730 3.907 -0.177 18090 2673 1 7 . 1 1 63 63 ALA C C 189 179.550 179.550 179.430 0.120 18090 2674 1 7 . 1 1 63 63 ALA CA C 189 55.470 55.470 55.734 -0.264 18090 2675 1 7 . 1 1 63 63 ALA CB C 189 17.640 17.640 18.146 -0.506 18090 2676 1 7 . 1 1 63 63 ALA H H 189 8.210 8.210 8.186 0.024 18090 2677 1 7 . 1 1 64 64 THR N N 190 114.570 114.570 113.708 0.862 18090 2678 1 7 . 1 1 64 64 THR HA H 190 3.790 3.790 4.013 -0.223 18090 2679 1 7 . 1 1 64 64 THR C C 190 177.640 177.640 176.658 0.982 18090 2680 1 7 . 1 1 64 64 THR CA C 190 66.690 66.690 65.573 1.117 18090 2681 1 7 . 1 1 64 64 THR CB C 190 68.310 68.310 68.139 0.170 18090 2682 1 7 . 1 1 64 64 THR H H 190 7.740 7.740 7.673 0.067 18090 2683 1 7 . 1 1 65 65 LEU N N 191 122.410 122.410 122.527 -0.117 18090 2684 1 7 . 1 1 65 65 LEU HA H 191 3.930 3.930 3.961 -0.031 18090 2685 1 7 . 1 1 65 65 LEU C C 191 178.470 178.470 179.818 -1.348 18090 2686 1 7 . 1 1 65 65 LEU CA C 191 57.120 57.120 58.113 -0.993 18090 2687 1 7 . 1 1 65 65 LEU CB C 191 41.830 41.830 41.726 0.104 18090 2688 1 7 . 1 1 65 65 LEU H H 191 8.180 8.180 7.573 0.607 18090 2689 1 7 . 1 1 66 66 MET N N 192 115.320 115.320 117.247 -1.927 18090 2690 1 7 . 1 1 66 66 MET HA H 192 4.090 4.090 4.302 -0.212 18090 2691 1 7 . 1 1 66 66 MET C C 192 176.090 176.090 178.303 -2.213 18090 2692 1 7 . 1 1 66 66 MET CA C 192 56.390 56.390 57.415 -1.025 18090 2693 1 7 . 1 1 66 66 MET CB C 192 33.770 33.770 31.869 1.901 18090 2694 1 7 . 1 1 66 66 MET H H 192 7.880 7.880 8.544 -0.664 18090 2695 1 7 . 1 1 67 67 GLY N N 193 107.490 107.490 105.431 2.059 18090 2696 1 7 . 1 1 67 67 GLY C C 193 174.390 174.390 174.689 -0.299 18090 2697 1 7 . 1 1 67 67 GLY CA C 193 45.880 45.880 45.016 0.864 18090 2698 1 7 . 1 1 67 67 GLY H H 193 7.580 7.580 8.207 -0.627 18090 2699 1 7 . 1 1 68 68 VAL N N 194 118.520 118.520 116.984 1.536 18090 2700 1 7 . 1 1 68 68 VAL HA H 194 3.940 3.940 3.622 0.318 18090 2701 1 7 . 1 1 68 68 VAL C C 194 174.760 174.760 175.058 -0.298 18090 2702 1 7 . 1 1 68 68 VAL CA C 194 61.510 61.510 63.327 -1.817 18090 2703 1 7 . 1 1 68 68 VAL CB C 194 32.670 32.670 30.289 2.381 18090 2704 1 7 . 1 1 68 68 VAL H H 194 7.840 7.840 7.408 0.432 18090 2705 1 7 . 1 1 69 69 ASP N N 195 124.550 124.550 117.432 7.118 18090 2706 1 7 . 1 1 69 69 ASP HA H 195 4.430 4.430 4.309 0.121 18090 2707 1 7 . 1 1 69 69 ASP C C 195 175.140 175.140 176.265 -1.125 18090 2708 1 7 . 1 1 69 69 ASP CA C 195 53.760 53.760 55.932 -2.172 18090 2709 1 7 . 1 1 69 69 ASP CB C 195 40.920 40.920 39.720 1.200 18090 2710 1 7 . 1 1 69 69 ASP H H 195 8.400 8.400 8.046 0.353 18090 2711 1 7 . 1 1 70 70 LEU N N 196 123.930 123.930 118.206 5.724 18090 2712 1 7 . 1 1 70 70 LEU HA H 196 4.200 4.200 4.169 0.031 18090 2713 1 7 . 1 1 70 70 LEU C C 196 175.950 175.950 177.309 -1.359 18090 2714 1 7 . 1 1 70 70 LEU CA C 196 54.380 54.380 56.614 -2.234 18090 2715 1 7 . 1 1 70 70 LEU CB C 196 41.610 41.610 42.754 -1.144 18090 2716 1 7 . 1 1 70 70 LEU H H 196 8.160 8.160 7.598 0.562 18090 2717 1 8 . 1 1 2 2 PRO HA H 128 4.220 4.220 4.460 -0.240 18090 2718 1 8 . 1 1 2 2 PRO CA C 128 63.320 63.320 63.701 -0.381 18090 2719 1 8 . 1 1 2 2 PRO CB C 128 31.680 31.680 31.849 -0.169 18090 2720 1 8 . 1 1 3 3 ASP N N 129 119.320 119.320 119.402 -0.082 18090 2721 1 8 . 1 1 3 3 ASP HA H 129 4.400 4.400 4.451 -0.051 18090 2722 1 8 . 1 1 3 3 ASP C C 129 176.120 176.120 175.363 0.757 18090 2723 1 8 . 1 1 3 3 ASP CA C 129 54.050 54.050 54.495 -0.445 18090 2724 1 8 . 1 1 3 3 ASP CB C 129 40.770 40.770 40.913 -0.143 18090 2725 1 8 . 1 1 3 3 ASP H H 129 8.310 8.310 8.299 0.011 18090 2726 1 8 . 1 1 4 4 LEU N N 130 122.280 122.280 121.175 1.105 18090 2727 1 8 . 1 1 4 4 LEU HA H 130 4.130 4.130 4.361 -0.231 18090 2728 1 8 . 1 1 4 4 LEU C C 130 177.280 177.280 177.796 -0.516 18090 2729 1 8 . 1 1 4 4 LEU CA C 130 55.350 55.350 54.447 0.903 18090 2730 1 8 . 1 1 4 4 LEU CB C 130 41.490 41.490 42.751 -1.260 18090 2731 1 8 . 1 1 4 4 LEU H H 130 8.080 8.080 8.070 0.010 18090 2732 1 8 . 1 1 5 5 GLY N N 131 107.830 107.830 109.489 -1.659 18090 2733 1 8 . 1 1 5 5 GLY C C 131 175.120 175.120 173.281 1.839 18090 2734 1 8 . 1 1 5 5 GLY CA C 131 45.300 45.300 45.423 -0.123 18090 2735 1 8 . 1 1 5 5 GLY H H 131 8.180 8.180 8.434 -0.254 18090 2736 1 8 . 1 1 6 6 LEU N N 132 121.080 121.080 116.531 4.549 18090 2737 1 8 . 1 1 6 6 LEU HA H 132 3.870 3.870 4.484 -0.614 18090 2738 1 8 . 1 1 6 6 LEU C C 132 178.000 178.000 177.631 0.369 18090 2739 1 8 . 1 1 6 6 LEU CA C 132 57.180 57.180 53.398 3.782 18090 2740 1 8 . 1 1 6 6 LEU CB C 132 41.870 41.870 44.498 -2.628 18090 2741 1 8 . 1 1 6 6 LEU H H 132 8.150 8.150 7.385 0.765 18090 2742 1 8 . 1 1 7 7 THR N N 133 111.580 111.580 113.127 -1.547 18090 2743 1 8 . 1 1 7 7 THR HA H 133 3.730 3.730 3.992 -0.262 18090 2744 1 8 . 1 1 7 7 THR C C 133 176.530 176.530 176.029 0.501 18090 2745 1 8 . 1 1 7 7 THR CA C 133 65.940 65.940 66.628 -0.688 18090 2746 1 8 . 1 1 7 7 THR CB C 133 68.130 68.130 68.742 -0.612 18090 2747 1 8 . 1 1 7 7 THR H H 133 7.970 7.970 8.601 -0.631 18090 2748 1 8 . 1 1 8 8 GLN N N 134 119.490 119.490 119.925 -0.435 18090 2749 1 8 . 1 1 8 8 GLN HA H 134 3.990 3.990 3.955 0.035 18090 2750 1 8 . 1 1 8 8 GLN C C 134 178.190 178.190 178.567 -0.377 18090 2751 1 8 . 1 1 8 8 GLN CA C 134 57.930 57.930 59.004 -1.074 18090 2752 1 8 . 1 1 8 8 GLN CB C 134 27.850 27.850 28.137 -0.287 18090 2753 1 8 . 1 1 8 8 GLN H H 134 7.890 7.890 8.469 -0.579 18090 2754 1 8 . 1 1 9 9 LEU N N 135 120.170 120.170 119.339 0.831 18090 2755 1 8 . 1 1 9 9 LEU HA H 135 3.820 3.820 3.921 -0.101 18090 2756 1 8 . 1 1 9 9 LEU C C 135 177.810 177.810 178.862 -1.052 18090 2757 1 8 . 1 1 9 9 LEU CA C 135 57.470 57.470 57.383 0.087 18090 2758 1 8 . 1 1 9 9 LEU CB C 135 41.640 41.640 41.674 -0.034 18090 2759 1 8 . 1 1 9 9 LEU H H 135 7.600 7.600 7.316 0.284 18090 2760 1 8 . 1 1 10 10 PHE N N 136 111.950 111.950 113.892 -1.942 18090 2761 1 8 . 1 1 10 10 PHE HA H 136 4.380 4.380 4.467 -0.087 18090 2762 1 8 . 1 1 10 10 PHE C C 136 174.990 174.990 177.411 -2.421 18090 2763 1 8 . 1 1 10 10 PHE CA C 136 58.450 58.450 57.782 0.668 18090 2764 1 8 . 1 1 10 10 PHE CB C 136 38.570 38.570 37.520 1.050 18090 2765 1 8 . 1 1 10 10 PHE H H 136 7.410 7.410 6.726 0.684 18090 2766 1 8 . 1 1 11 11 ALA N N 137 120.230 120.230 122.259 -2.029 18090 2767 1 8 . 1 1 11 11 ALA HA H 137 4.130 4.130 4.192 -0.062 18090 2768 1 8 . 1 1 11 11 ALA C C 137 177.090 177.090 178.040 -0.950 18090 2769 1 8 . 1 1 11 11 ALA CA C 137 52.580 52.580 53.440 -0.859 18090 2770 1 8 . 1 1 11 11 ALA CB C 137 18.660 18.660 19.011 -0.351 18090 2771 1 8 . 1 1 11 11 ALA H H 137 7.330 7.330 8.455 -1.125 18090 2772 1 8 . 1 1 12 12 ASP N N 138 119.830 119.830 120.564 -0.734 18090 2773 1 8 . 1 1 12 12 ASP HA H 138 4.510 4.510 4.648 -0.138 18090 2774 1 8 . 1 1 12 12 ASP C C 138 176.370 176.370 174.969 1.401 18090 2775 1 8 . 1 1 12 12 ASP CA C 138 51.960 51.960 53.175 -1.215 18090 2776 1 8 . 1 1 12 12 ASP CB C 138 41.990 41.990 41.494 0.496 18090 2777 1 8 . 1 1 12 12 ASP H H 138 6.980 6.980 7.633 -0.653 18090 2778 1 8 . 1 1 13 13 PRO HA H 139 4.260 4.260 4.358 -0.098 18090 2779 1 8 . 1 1 13 13 PRO CA C 139 64.350 64.350 62.773 1.577 18090 2780 1 8 . 1 1 13 13 PRO CB C 139 31.760 31.760 32.385 -0.624 18090 2781 1 8 . 1 1 14 14 ASN N N 140 116.840 116.840 117.640 -0.800 18090 2782 1 8 . 1 1 14 14 ASN HA H 140 4.840 4.840 4.482 0.358 18090 2783 1 8 . 1 1 14 14 ASN C C 140 173.840 173.840 175.379 -1.539 18090 2784 1 8 . 1 1 14 14 ASN CA C 140 52.380 52.380 54.187 -1.807 18090 2785 1 8 . 1 1 14 14 ASN CB C 140 38.330 38.330 37.049 1.281 18090 2786 1 8 . 1 1 14 14 ASN H H 140 8.670 8.670 8.674 -0.004 18090 2787 1 8 . 1 1 15 15 LEU N N 141 120.290 120.290 120.679 -0.389 18090 2788 1 8 . 1 1 15 15 LEU HA H 141 3.790 3.790 4.537 -0.747 18090 2789 1 8 . 1 1 15 15 LEU C C 141 177.120 177.120 177.530 -0.410 18090 2790 1 8 . 1 1 15 15 LEU CA C 141 59.280 59.280 55.604 3.676 18090 2791 1 8 . 1 1 15 15 LEU CB C 141 42.980 42.980 43.168 -0.188 18090 2792 1 8 . 1 1 15 15 LEU H H 141 7.200 7.200 8.449 -1.249 18090 2793 1 8 . 1 1 16 16 ILE N N 142 115.290 115.290 120.226 -4.936 18090 2794 1 8 . 1 1 16 16 ILE HA H 142 3.480 3.480 3.724 -0.244 18090 2795 1 8 . 1 1 16 16 ILE C C 142 177.990 177.990 177.503 0.487 18090 2796 1 8 . 1 1 16 16 ILE CA C 142 62.690 62.690 65.353 -2.663 18090 2797 1 8 . 1 1 16 16 ILE CB C 142 34.620 34.620 37.653 -3.033 18090 2798 1 8 . 1 1 16 16 ILE H H 142 7.940 7.940 8.286 -0.346 18090 2799 1 8 . 1 1 17 17 GLU N N 143 119.600 119.600 119.009 0.591 18090 2800 1 8 . 1 1 17 17 GLU HA H 143 3.700 3.700 3.998 -0.298 18090 2801 1 8 . 1 1 17 17 GLU C C 143 179.170 179.170 178.723 0.447 18090 2802 1 8 . 1 1 17 17 GLU CA C 143 59.360 59.360 60.086 -0.725 18090 2803 1 8 . 1 1 17 17 GLU CB C 143 28.520 28.520 29.223 -0.703 18090 2804 1 8 . 1 1 17 17 GLU H H 143 7.970 7.970 8.539 -0.569 18090 2805 1 8 . 1 1 18 18 ASN N N 144 117.170 117.170 117.874 -0.704 18090 2806 1 8 . 1 1 18 18 ASN HA H 144 4.270 4.270 4.449 -0.179 18090 2807 1 8 . 1 1 18 18 ASN C C 144 179.120 179.120 177.790 1.330 18090 2808 1 8 . 1 1 18 18 ASN CA C 144 55.490 55.490 55.633 -0.142 18090 2809 1 8 . 1 1 18 18 ASN CB C 144 36.550 36.550 37.798 -1.248 18090 2810 1 8 . 1 1 18 18 ASN H H 144 8.450 8.450 8.363 0.087 18090 2811 1 8 . 1 1 19 19 LEU N N 145 121.060 121.060 119.101 1.959 18090 2812 1 8 . 1 1 19 19 LEU HA H 145 4.020 4.020 4.019 0.001 18090 2813 1 8 . 1 1 19 19 LEU C C 145 180.260 180.260 178.136 2.124 18090 2814 1 8 . 1 1 19 19 LEU CA C 145 56.620 56.620 57.066 -0.446 18090 2815 1 8 . 1 1 19 19 LEU CB C 145 41.780 41.780 41.524 0.256 18090 2816 1 8 . 1 1 19 19 LEU H H 145 7.990 7.990 7.567 0.423 18090 2817 1 8 . 1 1 20 20 LYS N N 146 118.960 118.960 117.304 1.656 18090 2818 1 8 . 1 1 20 20 LYS HA H 146 3.610 3.610 3.967 -0.357 18090 2819 1 8 . 1 1 20 20 LYS C C 146 177.390 177.390 178.062 -0.672 18090 2820 1 8 . 1 1 20 20 LYS CA C 146 59.640 59.640 59.088 0.552 18090 2821 1 8 . 1 1 20 20 LYS CB C 146 32.450 32.450 32.373 0.077 18090 2822 1 8 . 1 1 20 20 LYS H H 146 8.250 8.250 7.823 0.427 18090 2823 1 8 . 1 1 21 21 LYS N N 147 114.720 114.720 116.455 -1.735 18090 2824 1 8 . 1 1 21 21 LYS HA H 147 4.110 4.110 4.217 -0.107 18090 2825 1 8 . 1 1 21 21 LYS C C 147 175.880 175.880 178.334 -2.454 18090 2826 1 8 . 1 1 21 21 LYS CA C 147 56.210 56.210 58.095 -1.885 18090 2827 1 8 . 1 1 21 21 LYS CB C 147 33.000 33.000 32.712 0.288 18090 2828 1 8 . 1 1 21 21 LYS H H 147 7.130 7.130 7.633 -0.503 18090 2829 1 8 . 1 1 22 22 ASN N N 148 122.180 122.180 115.328 6.852 18090 2830 1 8 . 1 1 22 22 ASN HA H 148 4.740 4.740 4.918 -0.178 18090 2831 1 8 . 1 1 22 22 ASN C C 148 174.000 174.000 173.506 0.494 18090 2832 1 8 . 1 1 22 22 ASN CA C 148 50.970 50.970 52.705 -1.735 18090 2833 1 8 . 1 1 22 22 ASN CB C 148 38.670 38.670 38.983 -0.313 18090 2834 1 8 . 1 1 22 22 ASN H H 148 6.930 6.930 7.881 -0.951 18090 2835 1 8 . 1 1 23 23 PRO HA H 149 4.300 4.300 4.699 -0.399 18090 2836 1 8 . 1 1 23 23 PRO CA C 149 64.610 64.610 61.993 2.617 18090 2837 1 8 . 1 1 23 23 PRO CB C 149 32.000 32.000 34.137 -2.137 18090 2838 1 8 . 1 1 24 24 LYS N N 150 116.060 116.060 121.153 -5.093 18090 2839 1 8 . 1 1 24 24 LYS HA H 150 4.070 4.070 3.943 0.127 18090 2840 1 8 . 1 1 24 24 LYS C C 150 178.240 178.240 178.293 -0.053 18090 2841 1 8 . 1 1 24 24 LYS CA C 150 57.950 57.950 59.665 -1.715 18090 2842 1 8 . 1 1 24 24 LYS CB C 150 32.590 32.590 31.871 0.719 18090 2843 1 8 . 1 1 24 24 LYS H H 150 8.520 8.520 8.820 -0.300 18090 2844 1 8 . 1 1 25 25 THR N N 151 105.190 105.190 110.468 -5.278 18090 2845 1 8 . 1 1 25 25 THR HA H 151 4.390 4.390 4.058 0.332 18090 2846 1 8 . 1 1 25 25 THR C C 151 176.090 176.090 176.354 -0.264 18090 2847 1 8 . 1 1 25 25 THR CA C 151 61.400 61.400 64.647 -3.247 18090 2848 1 8 . 1 1 25 25 THR CB C 151 69.440 69.440 67.145 2.295 18090 2849 1 8 . 1 1 25 25 THR H H 151 7.490 7.490 8.157 -0.667 18090 2850 1 8 . 1 1 26 26 SER N N 152 119.700 119.700 116.665 3.035 18090 2851 1 8 . 1 1 26 26 SER HA H 152 3.770 3.770 4.127 -0.357 18090 2852 1 8 . 1 1 26 26 SER C C 152 177.470 177.470 175.955 1.515 18090 2853 1 8 . 1 1 26 26 SER CA C 152 62.450 62.450 61.536 0.914 18090 2854 1 8 . 1 1 26 26 SER CB C 152 62.520 62.520 62.624 -0.104 18090 2855 1 8 . 1 1 26 26 SER H H 152 8.190 8.190 7.961 0.229 18090 2856 1 8 . 1 1 27 27 GLU N N 153 119.870 119.870 122.675 -2.805 18090 2857 1 8 . 1 1 27 27 GLU HA H 153 3.890 3.890 3.970 -0.080 18090 2858 1 8 . 1 1 27 27 GLU C C 153 180.040 180.040 178.708 1.332 18090 2859 1 8 . 1 1 27 27 GLU CA C 153 58.700 58.700 59.388 -0.688 18090 2860 1 8 . 1 1 27 27 GLU CB C 153 28.590 28.590 29.446 -0.856 18090 2861 1 8 . 1 1 27 27 GLU H H 153 8.350 8.350 7.846 0.504 18090 2862 1 8 . 1 1 28 28 MET N N 154 119.430 119.430 117.017 2.413 18090 2863 1 8 . 1 1 28 28 MET HA H 154 4.040 4.040 4.165 -0.125 18090 2864 1 8 . 1 1 28 28 MET C C 154 177.110 177.110 178.112 -1.002 18090 2865 1 8 . 1 1 28 28 MET CA C 154 58.510 58.510 58.679 -0.169 18090 2866 1 8 . 1 1 28 28 MET CB C 154 31.430 31.430 32.738 -1.308 18090 2867 1 8 . 1 1 28 28 MET H H 154 7.850 7.850 7.572 0.278 18090 2868 1 8 . 1 1 29 29 MET N N 155 112.640 112.640 114.195 -1.555 18090 2869 1 8 . 1 1 29 29 MET HA H 155 4.340 4.340 4.256 0.084 18090 2870 1 8 . 1 1 29 29 MET C C 155 175.530 175.530 177.833 -2.303 18090 2871 1 8 . 1 1 29 29 MET CA C 155 53.790 53.790 57.162 -3.372 18090 2872 1 8 . 1 1 29 29 MET CB C 155 30.380 30.380 32.061 -1.681 18090 2873 1 8 . 1 1 29 29 MET H H 155 7.200 7.200 7.368 -0.168 18090 2874 1 8 . 1 1 30 30 LYS N N 156 117.050 117.050 116.924 0.126 18090 2875 1 8 . 1 1 30 30 LYS HA H 156 3.960 3.960 4.267 -0.307 18090 2876 1 8 . 1 1 30 30 LYS C C 156 176.120 176.120 177.084 -0.964 18090 2877 1 8 . 1 1 30 30 LYS CA C 156 57.090 57.090 57.315 -0.225 18090 2878 1 8 . 1 1 30 30 LYS CB C 156 31.960 31.960 32.977 -1.017 18090 2879 1 8 . 1 1 30 30 LYS H H 156 7.130 7.130 7.645 -0.515 18090 2880 1 8 . 1 1 31 31 ASP N N 157 119.810 119.810 118.269 1.541 18090 2881 1 8 . 1 1 31 31 ASP HA H 157 4.860 4.860 4.903 -0.043 18090 2882 1 8 . 1 1 31 31 ASP C C 157 174.890 174.890 174.379 0.511 18090 2883 1 8 . 1 1 31 31 ASP CA C 157 50.520 50.520 54.394 -3.874 18090 2884 1 8 . 1 1 31 31 ASP CB C 157 41.010 41.010 40.523 0.487 18090 2885 1 8 . 1 1 31 31 ASP H H 157 7.340 7.340 7.779 -0.439 18090 2886 1 8 . 1 1 32 32 PRO HA H 158 4.130 4.130 4.461 -0.331 18090 2887 1 8 . 1 1 32 32 PRO CA C 158 64.270 64.270 62.815 1.455 18090 2888 1 8 . 1 1 32 32 PRO CB C 158 31.770 31.770 32.425 -0.655 18090 2889 1 8 . 1 1 33 33 GLN N N 159 117.760 117.760 120.278 -2.518 18090 2890 1 8 . 1 1 33 33 GLN HA H 159 4.000 4.000 4.043 -0.043 18090 2891 1 8 . 1 1 33 33 GLN C C 159 178.740 178.740 177.933 0.807 18090 2892 1 8 . 1 1 33 33 GLN CA C 159 58.220 58.220 58.023 0.197 18090 2893 1 8 . 1 1 33 33 GLN CB C 159 27.870 27.870 28.089 -0.219 18090 2894 1 8 . 1 1 33 33 GLN H H 159 8.150 8.150 8.768 -0.618 18090 2895 1 8 . 1 1 34 34 LEU N N 160 123.300 123.300 120.020 3.280 18090 2896 1 8 . 1 1 34 34 LEU HA H 160 3.970 3.970 4.011 -0.041 18090 2897 1 8 . 1 1 34 34 LEU C C 160 177.980 177.980 178.192 -0.212 18090 2898 1 8 . 1 1 34 34 LEU CA C 160 57.050 57.050 57.290 -0.240 18090 2899 1 8 . 1 1 34 34 LEU CB C 160 40.760 40.760 41.671 -0.911 18090 2900 1 8 . 1 1 34 34 LEU H H 160 7.110 7.110 7.989 -0.879 18090 2901 1 8 . 1 1 35 35 VAL N N 161 118.390 118.390 119.385 -0.995 18090 2902 1 8 . 1 1 35 35 VAL HA H 161 3.110 3.110 3.496 -0.386 18090 2903 1 8 . 1 1 35 35 VAL C C 161 176.840 176.840 177.669 -0.829 18090 2904 1 8 . 1 1 35 35 VAL CA C 161 67.700 67.700 66.983 0.717 18090 2905 1 8 . 1 1 35 35 VAL CB C 161 31.260 31.260 31.314 -0.054 18090 2906 1 8 . 1 1 35 35 VAL H H 161 7.430 7.430 7.409 0.021 18090 2907 1 8 . 1 1 36 36 ALA N N 162 117.600 117.600 121.384 -3.784 18090 2908 1 8 . 1 1 36 36 ALA HA H 162 3.810 3.810 3.951 -0.141 18090 2909 1 8 . 1 1 36 36 ALA C C 162 180.620 180.620 179.609 1.011 18090 2910 1 8 . 1 1 36 36 ALA CA C 162 54.720 54.720 55.345 -0.625 18090 2911 1 8 . 1 1 36 36 ALA CB C 162 17.490 17.490 18.103 -0.613 18090 2912 1 8 . 1 1 36 36 ALA H H 162 7.500 7.500 7.777 -0.277 18090 2913 1 8 . 1 1 37 37 LYS N N 163 119.880 119.880 118.458 1.422 18090 2914 1 8 . 1 1 37 37 LYS HA H 163 3.570 3.570 3.985 -0.415 18090 2915 1 8 . 1 1 37 37 LYS C C 163 177.800 177.800 179.186 -1.386 18090 2916 1 8 . 1 1 37 37 LYS CA C 163 58.880 58.880 58.920 -0.040 18090 2917 1 8 . 1 1 37 37 LYS CB C 163 31.610 31.610 32.019 -0.409 18090 2918 1 8 . 1 1 37 37 LYS H H 163 7.350 7.350 7.416 -0.066 18090 2919 1 8 . 1 1 38 38 LEU N N 164 118.020 118.020 120.176 -2.156 18090 2920 1 8 . 1 1 38 38 LEU HA H 164 3.670 3.670 4.003 -0.333 18090 2921 1 8 . 1 1 38 38 LEU C C 164 179.380 179.380 179.043 0.337 18090 2922 1 8 . 1 1 38 38 LEU CA C 164 57.340 57.340 57.919 -0.579 18090 2923 1 8 . 1 1 38 38 LEU CB C 164 41.660 41.660 41.769 -0.109 18090 2924 1 8 . 1 1 38 38 LEU H H 164 7.660 7.660 8.229 -0.569 18090 2925 1 8 . 1 1 39 39 ILE N N 165 118.070 118.070 119.259 -1.189 18090 2926 1 8 . 1 1 39 39 ILE HA H 165 3.510 3.510 3.601 -0.091 18090 2927 1 8 . 1 1 39 39 ILE C C 165 179.570 179.570 178.233 1.337 18090 2928 1 8 . 1 1 39 39 ILE CA C 165 64.450 64.450 65.543 -1.093 18090 2929 1 8 . 1 1 39 39 ILE CB C 165 37.310 37.310 37.529 -0.219 18090 2930 1 8 . 1 1 39 39 ILE H H 165 8.030 8.030 8.053 -0.023 18090 2931 1 8 . 1 1 40 40 GLY N N 166 107.970 107.970 107.758 0.212 18090 2932 1 8 . 1 1 40 40 GLY C C 166 176.470 176.470 175.548 0.922 18090 2933 1 8 . 1 1 40 40 GLY CA C 166 46.410 46.410 47.065 -0.655 18090 2934 1 8 . 1 1 40 40 GLY H H 166 7.590 7.590 7.706 -0.116 18090 2935 1 8 . 1 1 41 41 TYR N N 167 121.270 121.270 122.264 -0.994 18090 2936 1 8 . 1 1 41 41 TYR HA H 167 4.190 4.190 4.216 -0.026 18090 2937 1 8 . 1 1 41 41 TYR C C 167 176.470 176.470 176.195 0.275 18090 2938 1 8 . 1 1 41 41 TYR CA C 167 57.130 57.130 60.423 -3.293 18090 2939 1 8 . 1 1 41 41 TYR CB C 167 35.950 35.950 38.274 -2.324 18090 2940 1 8 . 1 1 41 41 TYR H H 167 7.350 7.350 7.726 -0.376 18090 2941 1 8 . 1 1 42 42 LYS N N 168 116.520 116.520 116.427 0.093 18090 2942 1 8 . 1 1 42 42 LYS HA H 168 3.820 3.820 4.005 -0.185 18090 2943 1 8 . 1 1 42 42 LYS C C 168 177.810 177.810 177.963 -0.153 18090 2944 1 8 . 1 1 42 42 LYS CA C 168 59.390 59.390 58.674 0.716 18090 2945 1 8 . 1 1 42 42 LYS CB C 168 31.580 31.580 32.606 -1.026 18090 2946 1 8 . 1 1 42 42 LYS H H 168 7.460 7.460 8.252 -0.792 18090 2947 1 8 . 1 1 43 43 GLN N N 169 113.750 113.750 115.630 -1.880 18090 2948 1 8 . 1 1 43 43 GLN HA H 169 4.220 4.220 4.157 0.063 18090 2949 1 8 . 1 1 43 43 GLN C C 169 175.840 175.840 177.304 -1.464 18090 2950 1 8 . 1 1 43 43 GLN CA C 169 56.230 56.230 58.141 -1.911 18090 2951 1 8 . 1 1 43 43 GLN CB C 169 29.290 29.290 29.376 -0.086 18090 2952 1 8 . 1 1 43 43 GLN H H 169 7.220 7.220 7.701 -0.481 18090 2953 1 8 . 1 1 44 44 ASN N N 170 114.130 114.130 116.188 -2.058 18090 2954 1 8 . 1 1 44 44 ASN HA H 170 5.050 5.050 4.978 0.072 18090 2955 1 8 . 1 1 44 44 ASN C C 170 172.200 172.200 173.662 -1.462 18090 2956 1 8 . 1 1 44 44 ASN CA C 170 50.780 50.780 53.307 -2.527 18090 2957 1 8 . 1 1 44 44 ASN CB C 170 38.380 38.380 39.704 -1.324 18090 2958 1 8 . 1 1 44 44 ASN H H 170 7.580 7.580 7.638 -0.058 18090 2959 1 8 . 1 1 45 45 PRO HA H 171 4.130 4.130 4.712 -0.582 18090 2960 1 8 . 1 1 45 45 PRO CA C 171 64.800 64.800 62.213 2.587 18090 2961 1 8 . 1 1 45 45 PRO CB C 171 31.360 31.360 31.820 -0.459 18090 2962 1 8 . 1 1 46 46 GLN N N 172 115.570 115.570 122.914 -7.344 18090 2963 1 8 . 1 1 46 46 GLN HA H 172 3.770 3.770 3.774 -0.004 18090 2964 1 8 . 1 1 46 46 GLN C C 172 177.360 177.360 177.638 -0.278 18090 2965 1 8 . 1 1 46 46 GLN CA C 172 57.950 57.950 58.177 -0.227 18090 2966 1 8 . 1 1 46 46 GLN CB C 172 27.050 27.050 27.903 -0.853 18090 2967 1 8 . 1 1 46 46 GLN H H 172 8.160 8.160 8.680 -0.520 18090 2968 1 8 . 1 1 47 47 ALA N N 173 121.420 121.420 121.645 -0.225 18090 2969 1 8 . 1 1 47 47 ALA HA H 173 4.050 4.050 4.168 -0.118 18090 2970 1 8 . 1 1 47 47 ALA C C 173 178.090 178.090 179.448 -1.358 18090 2971 1 8 . 1 1 47 47 ALA CA C 173 53.490 53.490 54.326 -0.836 18090 2972 1 8 . 1 1 47 47 ALA CB C 173 18.450 18.450 17.637 0.813 18090 2973 1 8 . 1 1 47 47 ALA H H 173 7.470 7.470 8.268 -0.798 18090 2974 1 8 . 1 1 48 48 ILE N N 174 118.050 118.050 118.606 -0.556 18090 2975 1 8 . 1 1 48 48 ILE HA H 174 3.180 3.180 3.888 -0.708 18090 2976 1 8 . 1 1 48 48 ILE C C 174 176.250 176.250 177.863 -1.613 18090 2977 1 8 . 1 1 48 48 ILE CA C 174 64.030 64.030 64.024 0.006 18090 2978 1 8 . 1 1 48 48 ILE CB C 174 37.280 37.280 37.074 0.206 18090 2979 1 8 . 1 1 48 48 ILE H H 174 7.150 7.150 7.359 -0.209 18090 2980 1 8 . 1 1 49 49 GLY N N 175 105.390 105.390 106.747 -1.357 18090 2981 1 8 . 1 1 49 49 GLY C C 175 174.220 174.220 175.924 -1.704 18090 2982 1 8 . 1 1 49 49 GLY CA C 175 46.700 46.700 47.036 -0.336 18090 2983 1 8 . 1 1 49 49 GLY H H 175 7.550 7.550 7.775 -0.225 18090 2984 1 8 . 1 1 50 50 GLN N N 176 116.230 116.230 118.520 -2.290 18090 2985 1 8 . 1 1 50 50 GLN HA H 176 4.210 4.210 4.601 -0.391 18090 2986 1 8 . 1 1 50 50 GLN C C 176 178.120 178.120 178.244 -0.124 18090 2987 1 8 . 1 1 50 50 GLN CA C 176 57.320 57.320 57.944 -0.624 18090 2988 1 8 . 1 1 50 50 GLN CB C 176 28.630 28.630 29.244 -0.614 18090 2989 1 8 . 1 1 50 50 GLN H H 176 7.390 7.390 7.985 -0.595 18090 2990 1 8 . 1 1 51 51 ASP N N 177 120.000 120.000 121.104 -1.104 18090 2991 1 8 . 1 1 51 51 ASP HA H 177 4.420 4.420 4.652 -0.232 18090 2992 1 8 . 1 1 51 51 ASP C C 177 177.950 177.950 178.308 -0.358 18090 2993 1 8 . 1 1 51 51 ASP CA C 177 55.840 55.840 56.012 -0.172 18090 2994 1 8 . 1 1 51 51 ASP CB C 177 40.310 40.310 40.859 -0.549 18090 2995 1 8 . 1 1 51 51 ASP H H 177 7.870 7.870 7.871 -0.001 18090 2996 1 8 . 1 1 52 52 LEU N N 178 120.010 120.010 120.541 -0.531 18090 2997 1 8 . 1 1 52 52 LEU HA H 178 3.650 3.650 4.052 -0.402 18090 2998 1 8 . 1 1 52 52 LEU C C 178 175.810 175.810 178.494 -2.684 18090 2999 1 8 . 1 1 52 52 LEU CA C 178 57.620 57.620 57.845 -0.225 18090 3000 1 8 . 1 1 52 52 LEU CB C 178 41.880 41.880 41.670 0.210 18090 3001 1 8 . 1 1 52 52 LEU H H 178 7.860 7.860 7.643 0.217 18090 3002 1 8 . 1 1 53 53 PHE N N 179 110.580 110.580 114.092 -3.512 18090 3003 1 8 . 1 1 53 53 PHE HA H 179 4.230 4.230 4.324 -0.094 18090 3004 1 8 . 1 1 53 53 PHE C C 179 176.370 176.370 177.992 -1.622 18090 3005 1 8 . 1 1 53 53 PHE CA C 179 58.730 58.730 60.724 -1.994 18090 3006 1 8 . 1 1 53 53 PHE CB C 179 38.720 38.720 38.898 -0.178 18090 3007 1 8 . 1 1 53 53 PHE H H 179 7.210 7.210 7.844 -0.634 18090 3008 1 8 . 1 1 54 54 THR N N 180 108.190 108.190 109.979 -1.789 18090 3009 1 8 . 1 1 54 54 THR HA H 180 4.300 4.300 4.293 0.007 18090 3010 1 8 . 1 1 54 54 THR C C 180 174.400 174.400 175.414 -1.014 18090 3011 1 8 . 1 1 54 54 THR CA C 180 62.020 62.020 62.277 -0.257 18090 3012 1 8 . 1 1 54 54 THR CB C 180 69.730 69.730 70.070 -0.340 18090 3013 1 8 . 1 1 54 54 THR H H 180 7.550 7.550 7.658 -0.108 18090 3014 1 8 . 1 1 55 55 ASP N N 181 120.060 120.060 122.876 -2.816 18090 3015 1 8 . 1 1 55 55 ASP HA H 181 5.020 5.020 5.087 -0.067 18090 3016 1 8 . 1 1 55 55 ASP C C 181 174.120 174.120 175.274 -1.154 18090 3017 1 8 . 1 1 55 55 ASP CA C 181 50.560 50.560 50.835 -0.275 18090 3018 1 8 . 1 1 55 55 ASP CB C 181 41.190 41.190 43.045 -1.855 18090 3019 1 8 . 1 1 55 55 ASP H H 181 7.480 7.480 8.169 -0.689 18090 3020 1 8 . 1 1 56 56 PRO HA H 182 4.320 4.320 4.369 -0.049 18090 3021 1 8 . 1 1 56 56 PRO CA C 182 64.280 64.280 64.647 -0.367 18090 3022 1 8 . 1 1 56 56 PRO CB C 182 31.980 31.980 32.800 -0.820 18090 3023 1 8 . 1 1 57 57 ARG N N 183 117.660 117.660 118.468 -0.808 18090 3024 1 8 . 1 1 57 57 ARG HA H 183 3.960 3.960 4.101 -0.141 18090 3025 1 8 . 1 1 57 57 ARG C C 183 179.030 179.030 178.630 0.400 18090 3026 1 8 . 1 1 57 57 ARG CA C 183 59.000 59.000 58.831 0.169 18090 3027 1 8 . 1 1 57 57 ARG CB C 183 29.750 29.750 29.321 0.429 18090 3028 1 8 . 1 1 57 57 ARG H H 183 7.920 7.920 8.077 -0.157 18090 3029 1 8 . 1 1 58 58 LEU N N 184 115.670 115.670 119.458 -3.788 18090 3030 1 8 . 1 1 58 58 LEU HA H 184 3.850 3.850 3.969 -0.119 18090 3031 1 8 . 1 1 58 58 LEU C C 184 178.770 178.770 179.073 -0.303 18090 3032 1 8 . 1 1 58 58 LEU CA C 184 57.110 57.110 57.692 -0.582 18090 3033 1 8 . 1 1 58 58 LEU CB C 184 41.310 41.310 41.606 -0.296 18090 3034 1 8 . 1 1 58 58 LEU H H 184 7.750 7.750 8.200 -0.450 18090 3035 1 8 . 1 1 59 59 MET N N 185 118.570 118.570 116.306 2.264 18090 3036 1 8 . 1 1 59 59 MET HA H 185 4.060 4.060 4.132 -0.072 18090 3037 1 8 . 1 1 59 59 MET C C 185 177.540 177.540 178.186 -0.646 18090 3038 1 8 . 1 1 59 59 MET CA C 185 58.090 58.090 59.312 -1.222 18090 3039 1 8 . 1 1 59 59 MET CB C 185 31.270 31.270 32.180 -0.910 18090 3040 1 8 . 1 1 59 59 MET H H 185 7.590 7.590 7.693 -0.103 18090 3041 1 8 . 1 1 60 60 THR N N 186 116.390 116.390 117.379 -0.989 18090 3042 1 8 . 1 1 60 60 THR HA H 186 3.680 3.680 4.002 -0.322 18090 3043 1 8 . 1 1 60 60 THR C C 186 177.440 177.440 176.718 0.722 18090 3044 1 8 . 1 1 60 60 THR CA C 186 66.940 66.940 66.466 0.475 18090 3045 1 8 . 1 1 60 60 THR CB C 186 68.030 68.030 68.196 -0.166 18090 3046 1 8 . 1 1 60 60 THR H H 186 7.180 7.180 7.777 -0.597 18090 3047 1 8 . 1 1 61 61 ILE N N 187 123.840 123.840 122.137 1.703 18090 3048 1 8 . 1 1 61 61 ILE HA H 187 3.290 3.290 3.771 -0.481 18090 3049 1 8 . 1 1 61 61 ILE C C 187 176.660 176.660 178.245 -1.585 18090 3050 1 8 . 1 1 61 61 ILE CA C 187 65.850 65.850 65.449 0.401 18090 3051 1 8 . 1 1 61 61 ILE CB C 187 37.640 37.640 37.750 -0.110 18090 3052 1 8 . 1 1 61 61 ILE H H 187 8.010 8.010 7.820 0.190 18090 3053 1 8 . 1 1 62 62 MET N N 188 118.210 118.210 118.267 -0.057 18090 3054 1 8 . 1 1 62 62 MET HA H 188 3.910 3.910 4.006 -0.096 18090 3055 1 8 . 1 1 62 62 MET C C 188 177.540 177.540 178.474 -0.934 18090 3056 1 8 . 1 1 62 62 MET CA C 188 58.530 58.530 58.887 -0.357 18090 3057 1 8 . 1 1 62 62 MET CB C 188 31.200 31.200 31.502 -0.302 18090 3058 1 8 . 1 1 62 62 MET H H 188 8.560 8.560 7.426 1.134 18090 3059 1 8 . 1 1 63 63 ALA N N 189 119.850 119.850 122.026 -2.176 18090 3060 1 8 . 1 1 63 63 ALA HA H 189 3.730 3.730 3.925 -0.195 18090 3061 1 8 . 1 1 63 63 ALA C C 189 179.550 179.550 179.262 0.288 18090 3062 1 8 . 1 1 63 63 ALA CA C 189 55.470 55.470 55.365 0.105 18090 3063 1 8 . 1 1 63 63 ALA CB C 189 17.640 17.640 18.227 -0.587 18090 3064 1 8 . 1 1 63 63 ALA H H 189 8.210 8.210 8.197 0.013 18090 3065 1 8 . 1 1 64 64 THR N N 190 114.570 114.570 113.691 0.879 18090 3066 1 8 . 1 1 64 64 THR HA H 190 3.790 3.790 3.923 -0.133 18090 3067 1 8 . 1 1 64 64 THR C C 190 177.640 177.640 176.857 0.783 18090 3068 1 8 . 1 1 64 64 THR CA C 190 66.690 66.690 66.044 0.645 18090 3069 1 8 . 1 1 64 64 THR CB C 190 68.310 68.310 68.505 -0.195 18090 3070 1 8 . 1 1 64 64 THR H H 190 7.740 7.740 7.600 0.140 18090 3071 1 8 . 1 1 65 65 LEU N N 191 122.410 122.410 122.021 0.389 18090 3072 1 8 . 1 1 65 65 LEU HA H 191 3.930 3.930 3.907 0.023 18090 3073 1 8 . 1 1 65 65 LEU C C 191 178.470 178.470 179.401 -0.931 18090 3074 1 8 . 1 1 65 65 LEU CA C 191 57.120 57.120 58.238 -1.118 18090 3075 1 8 . 1 1 65 65 LEU CB C 191 41.830 41.830 41.668 0.162 18090 3076 1 8 . 1 1 65 65 LEU H H 191 8.180 8.180 7.631 0.549 18090 3077 1 8 . 1 1 66 66 MET N N 192 115.320 115.320 117.089 -1.769 18090 3078 1 8 . 1 1 66 66 MET HA H 192 4.090 4.090 4.310 -0.220 18090 3079 1 8 . 1 1 66 66 MET C C 192 176.090 176.090 178.257 -2.167 18090 3080 1 8 . 1 1 66 66 MET CA C 192 56.390 56.390 57.325 -0.935 18090 3081 1 8 . 1 1 66 66 MET CB C 192 33.770 33.770 31.845 1.925 18090 3082 1 8 . 1 1 66 66 MET H H 192 7.880 7.880 8.388 -0.508 18090 3083 1 8 . 1 1 67 67 GLY N N 193 107.490 107.490 105.439 2.051 18090 3084 1 8 . 1 1 67 67 GLY C C 193 174.390 174.390 174.657 -0.267 18090 3085 1 8 . 1 1 67 67 GLY CA C 193 45.880 45.880 45.095 0.785 18090 3086 1 8 . 1 1 67 67 GLY H H 193 7.580 7.580 8.147 -0.567 18090 3087 1 8 . 1 1 68 68 VAL N N 194 118.520 118.520 116.841 1.679 18090 3088 1 8 . 1 1 68 68 VAL HA H 194 3.940 3.940 3.631 0.309 18090 3089 1 8 . 1 1 68 68 VAL C C 194 174.760 174.760 176.076 -1.316 18090 3090 1 8 . 1 1 68 68 VAL CA C 194 61.510 61.510 63.685 -2.175 18090 3091 1 8 . 1 1 68 68 VAL CB C 194 32.670 32.670 29.832 2.838 18090 3092 1 8 . 1 1 68 68 VAL H H 194 7.840 7.840 7.481 0.359 18090 3093 1 8 . 1 1 69 69 ASP N N 195 124.550 124.550 118.922 5.628 18090 3094 1 8 . 1 1 69 69 ASP HA H 195 4.430 4.430 4.605 -0.175 18090 3095 1 8 . 1 1 69 69 ASP C C 195 175.140 175.140 175.893 -0.753 18090 3096 1 8 . 1 1 69 69 ASP CA C 195 53.760 53.760 55.568 -1.808 18090 3097 1 8 . 1 1 69 69 ASP CB C 195 40.920 40.920 41.087 -0.167 18090 3098 1 8 . 1 1 69 69 ASP H H 195 8.400 8.400 8.026 0.374 18090 3099 1 8 . 1 1 70 70 LEU N N 196 123.930 123.930 119.311 4.619 18090 3100 1 8 . 1 1 70 70 LEU HA H 196 4.200 4.200 4.503 -0.303 18090 3101 1 8 . 1 1 70 70 LEU C C 196 175.950 175.950 175.249 0.701 18090 3102 1 8 . 1 1 70 70 LEU CA C 196 54.380 54.380 53.734 0.646 18090 3103 1 8 . 1 1 70 70 LEU CB C 196 41.610 41.610 44.426 -2.816 18090 3104 1 8 . 1 1 70 70 LEU H H 196 8.160 8.160 7.440 0.720 18090 3105 1 9 . 1 1 2 2 PRO HA H 128 4.220 4.220 4.334 -0.114 18090 3106 1 9 . 1 1 2 2 PRO CA C 128 63.320 63.320 63.903 -0.583 18090 3107 1 9 . 1 1 2 2 PRO CB C 128 31.680 31.680 31.922 -0.242 18090 3108 1 9 . 1 1 3 3 ASP N N 129 119.320 119.320 121.134 -1.814 18090 3109 1 9 . 1 1 3 3 ASP HA H 129 4.400 4.400 4.719 -0.319 18090 3110 1 9 . 1 1 3 3 ASP C C 129 176.120 176.120 175.292 0.828 18090 3111 1 9 . 1 1 3 3 ASP CA C 129 54.050 54.050 54.446 -0.396 18090 3112 1 9 . 1 1 3 3 ASP CB C 129 40.770 40.770 39.372 1.398 18090 3113 1 9 . 1 1 3 3 ASP H H 129 8.310 8.310 8.365 -0.055 18090 3114 1 9 . 1 1 4 4 LEU N N 130 122.280 122.280 121.891 0.389 18090 3115 1 9 . 1 1 4 4 LEU HA H 130 4.130 4.130 4.499 -0.369 18090 3116 1 9 . 1 1 4 4 LEU C C 130 177.280 177.280 175.540 1.740 18090 3117 1 9 . 1 1 4 4 LEU CA C 130 55.350 55.350 53.894 1.456 18090 3118 1 9 . 1 1 4 4 LEU CB C 130 41.490 41.490 46.639 -5.149 18090 3119 1 9 . 1 1 4 4 LEU H H 130 8.080 8.080 7.659 0.421 18090 3120 1 9 . 1 1 5 5 GLY N N 131 107.830 107.830 109.333 -1.503 18090 3121 1 9 . 1 1 5 5 GLY C C 131 175.120 175.120 174.207 0.913 18090 3122 1 9 . 1 1 5 5 GLY CA C 131 45.300 45.300 44.496 0.804 18090 3123 1 9 . 1 1 5 5 GLY H H 131 8.180 8.180 8.383 -0.203 18090 3124 1 9 . 1 1 6 6 LEU N N 132 121.080 121.080 126.507 -5.427 18090 3125 1 9 . 1 1 6 6 LEU HA H 132 3.870 3.870 4.052 -0.182 18090 3126 1 9 . 1 1 6 6 LEU C C 132 178.000 178.000 178.358 -0.358 18090 3127 1 9 . 1 1 6 6 LEU CA C 132 57.180 57.180 56.677 0.503 18090 3128 1 9 . 1 1 6 6 LEU CB C 132 41.870 41.870 42.047 -0.177 18090 3129 1 9 . 1 1 6 6 LEU H H 132 8.150 8.150 8.023 0.127 18090 3130 1 9 . 1 1 7 7 THR N N 133 111.580 111.580 111.223 0.357 18090 3131 1 9 . 1 1 7 7 THR HA H 133 3.730 3.730 4.003 -0.273 18090 3132 1 9 . 1 1 7 7 THR C C 133 176.530 176.530 176.458 0.072 18090 3133 1 9 . 1 1 7 7 THR CA C 133 65.940 65.940 65.709 0.231 18090 3134 1 9 . 1 1 7 7 THR CB C 133 68.130 68.130 68.501 -0.371 18090 3135 1 9 . 1 1 7 7 THR H H 133 7.970 7.970 8.454 -0.484 18090 3136 1 9 . 1 1 8 8 GLN N N 134 119.490 119.490 121.370 -1.880 18090 3137 1 9 . 1 1 8 8 GLN HA H 134 3.990 3.990 3.926 0.064 18090 3138 1 9 . 1 1 8 8 GLN C C 134 178.190 178.190 178.282 -0.092 18090 3139 1 9 . 1 1 8 8 GLN CA C 134 57.930 57.930 58.721 -0.791 18090 3140 1 9 . 1 1 8 8 GLN CB C 134 27.850 27.850 27.919 -0.069 18090 3141 1 9 . 1 1 8 8 GLN H H 134 7.890 7.890 8.408 -0.518 18090 3142 1 9 . 1 1 9 9 LEU N N 135 120.170 120.170 118.009 2.161 18090 3143 1 9 . 1 1 9 9 LEU HA H 135 3.820 3.820 3.931 -0.111 18090 3144 1 9 . 1 1 9 9 LEU C C 135 177.810 177.810 178.435 -0.625 18090 3145 1 9 . 1 1 9 9 LEU CA C 135 57.470 57.470 57.156 0.314 18090 3146 1 9 . 1 1 9 9 LEU CB C 135 41.640 41.640 41.931 -0.291 18090 3147 1 9 . 1 1 9 9 LEU H H 135 7.600 7.600 7.297 0.303 18090 3148 1 9 . 1 1 10 10 PHE N N 136 111.950 111.950 113.034 -1.084 18090 3149 1 9 . 1 1 10 10 PHE HA H 136 4.380 4.380 4.383 -0.003 18090 3150 1 9 . 1 1 10 10 PHE C C 136 174.990 174.990 177.168 -2.178 18090 3151 1 9 . 1 1 10 10 PHE CA C 136 58.450 58.450 57.415 1.035 18090 3152 1 9 . 1 1 10 10 PHE CB C 136 38.570 38.570 37.928 0.642 18090 3153 1 9 . 1 1 10 10 PHE H H 136 7.410 7.410 6.586 0.824 18090 3154 1 9 . 1 1 11 11 ALA N N 137 120.230 120.230 122.290 -2.060 18090 3155 1 9 . 1 1 11 11 ALA HA H 137 4.130 4.130 4.059 0.071 18090 3156 1 9 . 1 1 11 11 ALA C C 137 177.090 177.090 178.252 -1.162 18090 3157 1 9 . 1 1 11 11 ALA CA C 137 52.580 52.580 53.564 -0.984 18090 3158 1 9 . 1 1 11 11 ALA CB C 137 18.660 18.660 18.760 -0.100 18090 3159 1 9 . 1 1 11 11 ALA H H 137 7.330 7.330 8.464 -1.134 18090 3160 1 9 . 1 1 12 12 ASP N N 138 119.830 119.830 120.274 -0.444 18090 3161 1 9 . 1 1 12 12 ASP HA H 138 4.510 4.510 4.667 -0.157 18090 3162 1 9 . 1 1 12 12 ASP C C 138 176.370 176.370 174.914 1.456 18090 3163 1 9 . 1 1 12 12 ASP CA C 138 51.960 51.960 52.918 -0.958 18090 3164 1 9 . 1 1 12 12 ASP CB C 138 41.990 41.990 41.546 0.444 18090 3165 1 9 . 1 1 12 12 ASP H H 138 6.980 6.980 7.646 -0.666 18090 3166 1 9 . 1 1 13 13 PRO HA H 139 4.260 4.260 4.423 -0.163 18090 3167 1 9 . 1 1 13 13 PRO CA C 139 64.350 64.350 63.095 1.255 18090 3168 1 9 . 1 1 13 13 PRO CB C 139 31.760 31.760 32.318 -0.558 18090 3169 1 9 . 1 1 14 14 ASN N N 140 116.840 116.840 118.168 -1.328 18090 3170 1 9 . 1 1 14 14 ASN HA H 140 4.840 4.840 4.474 0.366 18090 3171 1 9 . 1 1 14 14 ASN C C 140 173.840 173.840 175.677 -1.837 18090 3172 1 9 . 1 1 14 14 ASN CA C 140 52.380 52.380 54.032 -1.651 18090 3173 1 9 . 1 1 14 14 ASN CB C 140 38.330 38.330 36.846 1.484 18090 3174 1 9 . 1 1 14 14 ASN H H 140 8.670 8.670 8.714 -0.044 18090 3175 1 9 . 1 1 15 15 LEU N N 141 120.290 120.290 120.369 -0.079 18090 3176 1 9 . 1 1 15 15 LEU HA H 141 3.790 3.790 4.535 -0.745 18090 3177 1 9 . 1 1 15 15 LEU C C 141 177.120 177.120 177.532 -0.412 18090 3178 1 9 . 1 1 15 15 LEU CA C 141 59.280 59.280 55.587 3.693 18090 3179 1 9 . 1 1 15 15 LEU CB C 141 42.980 42.980 43.164 -0.184 18090 3180 1 9 . 1 1 15 15 LEU H H 141 7.200 7.200 8.420 -1.220 18090 3181 1 9 . 1 1 16 16 ILE N N 142 115.290 115.290 120.182 -4.892 18090 3182 1 9 . 1 1 16 16 ILE HA H 142 3.480 3.480 3.723 -0.243 18090 3183 1 9 . 1 1 16 16 ILE C C 142 177.990 177.990 177.501 0.489 18090 3184 1 9 . 1 1 16 16 ILE CA C 142 62.690 62.690 65.413 -2.723 18090 3185 1 9 . 1 1 16 16 ILE CB C 142 34.620 34.620 37.614 -2.994 18090 3186 1 9 . 1 1 16 16 ILE H H 142 7.940 7.940 8.285 -0.345 18090 3187 1 9 . 1 1 17 17 GLU N N 143 119.600 119.600 119.005 0.595 18090 3188 1 9 . 1 1 17 17 GLU HA H 143 3.700 3.700 3.987 -0.287 18090 3189 1 9 . 1 1 17 17 GLU C C 143 179.170 179.170 178.758 0.412 18090 3190 1 9 . 1 1 17 17 GLU CA C 143 59.360 59.360 60.100 -0.740 18090 3191 1 9 . 1 1 17 17 GLU CB C 143 28.520 28.520 29.209 -0.689 18090 3192 1 9 . 1 1 17 17 GLU H H 143 7.970 7.970 8.549 -0.579 18090 3193 1 9 . 1 1 18 18 ASN N N 144 117.170 117.170 117.829 -0.659 18090 3194 1 9 . 1 1 18 18 ASN HA H 144 4.270 4.270 4.447 -0.177 18090 3195 1 9 . 1 1 18 18 ASN C C 144 179.120 179.120 177.813 1.307 18090 3196 1 9 . 1 1 18 18 ASN CA C 144 55.490 55.490 55.636 -0.146 18090 3197 1 9 . 1 1 18 18 ASN CB C 144 36.550 36.550 37.805 -1.255 18090 3198 1 9 . 1 1 18 18 ASN H H 144 8.450 8.450 8.366 0.084 18090 3199 1 9 . 1 1 19 19 LEU N N 145 121.060 121.060 118.934 2.126 18090 3200 1 9 . 1 1 19 19 LEU HA H 145 4.020 4.020 4.035 -0.015 18090 3201 1 9 . 1 1 19 19 LEU C C 145 180.260 180.260 178.257 2.003 18090 3202 1 9 . 1 1 19 19 LEU CA C 145 56.620 56.620 57.013 -0.393 18090 3203 1 9 . 1 1 19 19 LEU CB C 145 41.780 41.780 41.549 0.231 18090 3204 1 9 . 1 1 19 19 LEU H H 145 7.990 7.990 7.533 0.457 18090 3205 1 9 . 1 1 20 20 LYS N N 146 118.960 118.960 117.791 1.169 18090 3206 1 9 . 1 1 20 20 LYS HA H 146 3.610 3.610 3.926 -0.316 18090 3207 1 9 . 1 1 20 20 LYS C C 146 177.390 177.390 178.653 -1.263 18090 3208 1 9 . 1 1 20 20 LYS CA C 146 59.640 59.640 59.355 0.285 18090 3209 1 9 . 1 1 20 20 LYS CB C 146 32.450 32.450 32.366 0.084 18090 3210 1 9 . 1 1 20 20 LYS H H 146 8.250 8.250 7.831 0.419 18090 3211 1 9 . 1 1 21 21 LYS N N 147 114.720 114.720 117.201 -2.481 18090 3212 1 9 . 1 1 21 21 LYS HA H 147 4.110 4.110 4.155 -0.045 18090 3213 1 9 . 1 1 21 21 LYS C C 147 175.880 175.880 178.622 -2.742 18090 3214 1 9 . 1 1 21 21 LYS CA C 147 56.210 56.210 58.426 -2.216 18090 3215 1 9 . 1 1 21 21 LYS CB C 147 33.000 33.000 32.619 0.381 18090 3216 1 9 . 1 1 21 21 LYS H H 147 7.130 7.130 7.597 -0.467 18090 3217 1 9 . 1 1 22 22 ASN N N 148 122.180 122.180 115.405 6.775 18090 3218 1 9 . 1 1 22 22 ASN HA H 148 4.740 4.740 4.918 -0.178 18090 3219 1 9 . 1 1 22 22 ASN C C 148 174.000 174.000 173.527 0.473 18090 3220 1 9 . 1 1 22 22 ASN CA C 148 50.970 50.970 52.690 -1.720 18090 3221 1 9 . 1 1 22 22 ASN CB C 148 38.670 38.670 38.951 -0.281 18090 3222 1 9 . 1 1 22 22 ASN H H 148 6.930 6.930 7.905 -0.975 18090 3223 1 9 . 1 1 23 23 PRO HA H 149 4.300 4.300 4.697 -0.397 18090 3224 1 9 . 1 1 23 23 PRO CA C 149 64.610 64.610 61.992 2.618 18090 3225 1 9 . 1 1 23 23 PRO CB C 149 32.000 32.000 34.094 -2.094 18090 3226 1 9 . 1 1 24 24 LYS N N 150 116.060 116.060 121.151 -5.091 18090 3227 1 9 . 1 1 24 24 LYS HA H 150 4.070 4.070 3.935 0.135 18090 3228 1 9 . 1 1 24 24 LYS C C 150 178.240 178.240 178.552 -0.312 18090 3229 1 9 . 1 1 24 24 LYS CA C 150 57.950 57.950 59.690 -1.740 18090 3230 1 9 . 1 1 24 24 LYS CB C 150 32.590 32.590 31.889 0.701 18090 3231 1 9 . 1 1 24 24 LYS H H 150 8.520 8.520 8.824 -0.304 18090 3232 1 9 . 1 1 25 25 THR N N 151 105.190 105.190 109.921 -4.731 18090 3233 1 9 . 1 1 25 25 THR HA H 151 4.390 4.390 4.056 0.334 18090 3234 1 9 . 1 1 25 25 THR C C 151 176.090 176.090 176.367 -0.277 18090 3235 1 9 . 1 1 25 25 THR CA C 151 61.400 61.400 64.600 -3.200 18090 3236 1 9 . 1 1 25 25 THR CB C 151 69.440 69.440 67.817 1.623 18090 3237 1 9 . 1 1 25 25 THR H H 151 7.490 7.490 8.146 -0.656 18090 3238 1 9 . 1 1 26 26 SER N N 152 119.700 119.700 116.523 3.177 18090 3239 1 9 . 1 1 26 26 SER HA H 152 3.770 3.770 4.143 -0.373 18090 3240 1 9 . 1 1 26 26 SER C C 152 177.470 177.470 176.027 1.443 18090 3241 1 9 . 1 1 26 26 SER CA C 152 62.450 62.450 61.405 1.045 18090 3242 1 9 . 1 1 26 26 SER CB C 152 62.520 62.520 62.738 -0.218 18090 3243 1 9 . 1 1 26 26 SER H H 152 8.190 8.190 7.959 0.231 18090 3244 1 9 . 1 1 27 27 GLU N N 153 119.870 119.870 122.692 -2.822 18090 3245 1 9 . 1 1 27 27 GLU HA H 153 3.890 3.890 3.971 -0.081 18090 3246 1 9 . 1 1 27 27 GLU C C 153 180.040 180.040 178.748 1.292 18090 3247 1 9 . 1 1 27 27 GLU CA C 153 58.700 58.700 59.353 -0.653 18090 3248 1 9 . 1 1 27 27 GLU CB C 153 28.590 28.590 29.440 -0.850 18090 3249 1 9 . 1 1 27 27 GLU H H 153 8.350 8.350 7.850 0.500 18090 3250 1 9 . 1 1 28 28 MET N N 154 119.430 119.430 116.897 2.533 18090 3251 1 9 . 1 1 28 28 MET HA H 154 4.040 4.040 4.168 -0.128 18090 3252 1 9 . 1 1 28 28 MET C C 154 177.110 177.110 178.044 -0.934 18090 3253 1 9 . 1 1 28 28 MET CA C 154 58.510 58.510 58.594 -0.084 18090 3254 1 9 . 1 1 28 28 MET CB C 154 31.430 31.430 32.729 -1.299 18090 3255 1 9 . 1 1 28 28 MET H H 154 7.850 7.850 7.578 0.272 18090 3256 1 9 . 1 1 29 29 MET N N 155 112.640 112.640 114.325 -1.685 18090 3257 1 9 . 1 1 29 29 MET HA H 155 4.340 4.340 4.257 0.083 18090 3258 1 9 . 1 1 29 29 MET C C 155 175.530 175.530 177.847 -2.317 18090 3259 1 9 . 1 1 29 29 MET CA C 155 53.790 53.790 57.176 -3.386 18090 3260 1 9 . 1 1 29 29 MET CB C 155 30.380 30.380 32.117 -1.737 18090 3261 1 9 . 1 1 29 29 MET H H 155 7.200 7.200 7.344 -0.144 18090 3262 1 9 . 1 1 30 30 LYS N N 156 117.050 117.050 116.709 0.341 18090 3263 1 9 . 1 1 30 30 LYS HA H 156 3.960 3.960 4.274 -0.314 18090 3264 1 9 . 1 1 30 30 LYS C C 156 176.120 176.120 177.166 -1.046 18090 3265 1 9 . 1 1 30 30 LYS CA C 156 57.090 57.090 57.283 -0.193 18090 3266 1 9 . 1 1 30 30 LYS CB C 156 31.960 31.960 32.973 -1.013 18090 3267 1 9 . 1 1 30 30 LYS H H 156 7.130 7.130 7.662 -0.532 18090 3268 1 9 . 1 1 31 31 ASP N N 157 119.810 119.810 118.790 1.020 18090 3269 1 9 . 1 1 31 31 ASP HA H 157 4.860 4.860 4.969 -0.109 18090 3270 1 9 . 1 1 31 31 ASP C C 157 174.890 174.890 174.573 0.317 18090 3271 1 9 . 1 1 31 31 ASP CA C 157 50.520 50.520 54.586 -4.066 18090 3272 1 9 . 1 1 31 31 ASP CB C 157 41.010 41.010 40.790 0.220 18090 3273 1 9 . 1 1 31 31 ASP H H 157 7.340 7.340 7.742 -0.402 18090 3274 1 9 . 1 1 32 32 PRO HA H 158 4.130 4.130 4.457 -0.328 18090 3275 1 9 . 1 1 32 32 PRO CA C 158 64.270 64.270 63.006 1.264 18090 3276 1 9 . 1 1 32 32 PRO CB C 158 31.770 31.770 32.360 -0.590 18090 3277 1 9 . 1 1 33 33 GLN N N 159 117.760 117.760 120.287 -2.527 18090 3278 1 9 . 1 1 33 33 GLN HA H 159 4.000 4.000 4.051 -0.051 18090 3279 1 9 . 1 1 33 33 GLN C C 159 178.740 178.740 177.935 0.805 18090 3280 1 9 . 1 1 33 33 GLN CA C 159 58.220 58.220 57.972 0.248 18090 3281 1 9 . 1 1 33 33 GLN CB C 159 27.870 27.870 28.102 -0.232 18090 3282 1 9 . 1 1 33 33 GLN H H 159 8.150 8.150 8.767 -0.617 18090 3283 1 9 . 1 1 34 34 LEU N N 160 123.300 123.300 120.091 3.209 18090 3284 1 9 . 1 1 34 34 LEU HA H 160 3.970 3.970 4.023 -0.053 18090 3285 1 9 . 1 1 34 34 LEU C C 160 177.980 177.980 178.127 -0.147 18090 3286 1 9 . 1 1 34 34 LEU CA C 160 57.050 57.050 57.185 -0.135 18090 3287 1 9 . 1 1 34 34 LEU CB C 160 40.760 40.760 41.669 -0.909 18090 3288 1 9 . 1 1 34 34 LEU H H 160 7.110 7.110 7.990 -0.880 18090 3289 1 9 . 1 1 35 35 VAL N N 161 118.390 118.390 119.390 -1.000 18090 3290 1 9 . 1 1 35 35 VAL HA H 161 3.110 3.110 3.487 -0.377 18090 3291 1 9 . 1 1 35 35 VAL C C 161 176.840 176.840 177.706 -0.866 18090 3292 1 9 . 1 1 35 35 VAL CA C 161 67.700 67.700 66.868 0.832 18090 3293 1 9 . 1 1 35 35 VAL CB C 161 31.260 31.260 31.195 0.065 18090 3294 1 9 . 1 1 35 35 VAL H H 161 7.430 7.430 7.389 0.041 18090 3295 1 9 . 1 1 36 36 ALA N N 162 117.600 117.600 121.382 -3.782 18090 3296 1 9 . 1 1 36 36 ALA HA H 162 3.810 3.810 3.938 -0.128 18090 3297 1 9 . 1 1 36 36 ALA C C 162 180.620 180.620 179.609 1.011 18090 3298 1 9 . 1 1 36 36 ALA CA C 162 54.720 54.720 55.361 -0.641 18090 3299 1 9 . 1 1 36 36 ALA CB C 162 17.490 17.490 18.114 -0.624 18090 3300 1 9 . 1 1 36 36 ALA H H 162 7.500 7.500 7.793 -0.293 18090 3301 1 9 . 1 1 37 37 LYS N N 163 119.880 119.880 118.462 1.418 18090 3302 1 9 . 1 1 37 37 LYS HA H 163 3.570 3.570 3.981 -0.411 18090 3303 1 9 . 1 1 37 37 LYS C C 163 177.800 177.800 179.121 -1.321 18090 3304 1 9 . 1 1 37 37 LYS CA C 163 58.880 58.880 58.922 -0.042 18090 3305 1 9 . 1 1 37 37 LYS CB C 163 31.610 31.610 32.018 -0.408 18090 3306 1 9 . 1 1 37 37 LYS H H 163 7.350 7.350 7.397 -0.047 18090 3307 1 9 . 1 1 38 38 LEU N N 164 118.020 118.020 119.950 -1.930 18090 3308 1 9 . 1 1 38 38 LEU HA H 164 3.670 3.670 4.022 -0.352 18090 3309 1 9 . 1 1 38 38 LEU C C 164 179.380 179.380 179.099 0.281 18090 3310 1 9 . 1 1 38 38 LEU CA C 164 57.340 57.340 57.931 -0.591 18090 3311 1 9 . 1 1 38 38 LEU CB C 164 41.660 41.660 41.687 -0.027 18090 3312 1 9 . 1 1 38 38 LEU H H 164 7.660 7.660 8.227 -0.567 18090 3313 1 9 . 1 1 39 39 ILE N N 165 118.070 118.070 118.244 -0.174 18090 3314 1 9 . 1 1 39 39 ILE HA H 165 3.510 3.510 3.636 -0.126 18090 3315 1 9 . 1 1 39 39 ILE C C 165 179.570 179.570 178.271 1.299 18090 3316 1 9 . 1 1 39 39 ILE CA C 165 64.450 64.450 65.543 -1.093 18090 3317 1 9 . 1 1 39 39 ILE CB C 165 37.310 37.310 37.448 -0.138 18090 3318 1 9 . 1 1 39 39 ILE H H 165 8.030 8.030 8.071 -0.041 18090 3319 1 9 . 1 1 40 40 GLY N N 166 107.970 107.970 107.866 0.104 18090 3320 1 9 . 1 1 40 40 GLY C C 166 176.470 176.470 175.711 0.759 18090 3321 1 9 . 1 1 40 40 GLY CA C 166 46.410 46.410 46.953 -0.543 18090 3322 1 9 . 1 1 40 40 GLY H H 166 7.590 7.590 7.619 -0.029 18090 3323 1 9 . 1 1 41 41 TYR N N 167 121.270 121.270 122.358 -1.088 18090 3324 1 9 . 1 1 41 41 TYR HA H 167 4.190 4.190 4.205 -0.015 18090 3325 1 9 . 1 1 41 41 TYR C C 167 176.470 176.470 176.221 0.249 18090 3326 1 9 . 1 1 41 41 TYR CA C 167 57.130 57.130 60.413 -3.283 18090 3327 1 9 . 1 1 41 41 TYR CB C 167 35.950 35.950 38.221 -2.271 18090 3328 1 9 . 1 1 41 41 TYR H H 167 7.350 7.350 7.838 -0.488 18090 3329 1 9 . 1 1 42 42 LYS N N 168 116.520 116.520 115.929 0.591 18090 3330 1 9 . 1 1 42 42 LYS HA H 168 3.820 3.820 4.064 -0.244 18090 3331 1 9 . 1 1 42 42 LYS C C 168 177.810 177.810 177.917 -0.107 18090 3332 1 9 . 1 1 42 42 LYS CA C 168 59.390 59.390 58.338 1.052 18090 3333 1 9 . 1 1 42 42 LYS CB C 168 31.580 31.580 32.756 -1.176 18090 3334 1 9 . 1 1 42 42 LYS H H 168 7.460 7.460 8.292 -0.832 18090 3335 1 9 . 1 1 43 43 GLN N N 169 113.750 113.750 116.029 -2.279 18090 3336 1 9 . 1 1 43 43 GLN HA H 169 4.220 4.220 4.150 0.070 18090 3337 1 9 . 1 1 43 43 GLN C C 169 175.840 175.840 177.312 -1.472 18090 3338 1 9 . 1 1 43 43 GLN CA C 169 56.230 56.230 58.191 -1.962 18090 3339 1 9 . 1 1 43 43 GLN CB C 169 29.290 29.290 29.499 -0.209 18090 3340 1 9 . 1 1 43 43 GLN H H 169 7.220 7.220 7.636 -0.416 18090 3341 1 9 . 1 1 44 44 ASN N N 170 114.130 114.130 116.223 -2.093 18090 3342 1 9 . 1 1 44 44 ASN HA H 170 5.050 5.050 4.964 0.086 18090 3343 1 9 . 1 1 44 44 ASN C C 170 172.200 172.200 173.542 -1.342 18090 3344 1 9 . 1 1 44 44 ASN CA C 170 50.780 50.780 53.982 -3.202 18090 3345 1 9 . 1 1 44 44 ASN CB C 170 38.380 38.380 39.818 -1.438 18090 3346 1 9 . 1 1 44 44 ASN H H 170 7.580 7.580 7.629 -0.049 18090 3347 1 9 . 1 1 45 45 PRO HA H 171 4.130 4.130 4.654 -0.524 18090 3348 1 9 . 1 1 45 45 PRO CA C 171 64.800 64.800 62.077 2.723 18090 3349 1 9 . 1 1 45 45 PRO CB C 171 31.360 31.360 31.903 -0.543 18090 3350 1 9 . 1 1 46 46 GLN N N 172 115.570 115.570 122.948 -7.378 18090 3351 1 9 . 1 1 46 46 GLN HA H 172 3.770 3.770 3.777 -0.007 18090 3352 1 9 . 1 1 46 46 GLN C C 172 177.360 177.360 177.585 -0.225 18090 3353 1 9 . 1 1 46 46 GLN CA C 172 57.950 57.950 58.147 -0.197 18090 3354 1 9 . 1 1 46 46 GLN CB C 172 27.050 27.050 27.898 -0.848 18090 3355 1 9 . 1 1 46 46 GLN H H 172 8.160 8.160 8.682 -0.522 18090 3356 1 9 . 1 1 47 47 ALA N N 173 121.420 121.420 121.564 -0.144 18090 3357 1 9 . 1 1 47 47 ALA HA H 173 4.050 4.050 4.165 -0.115 18090 3358 1 9 . 1 1 47 47 ALA C C 173 178.090 178.090 179.425 -1.335 18090 3359 1 9 . 1 1 47 47 ALA CA C 173 53.490 53.490 54.291 -0.801 18090 3360 1 9 . 1 1 47 47 ALA CB C 173 18.450 18.450 17.608 0.842 18090 3361 1 9 . 1 1 47 47 ALA H H 173 7.470 7.470 8.269 -0.799 18090 3362 1 9 . 1 1 48 48 ILE N N 174 118.050 118.050 118.777 -0.727 18090 3363 1 9 . 1 1 48 48 ILE HA H 174 3.180 3.180 3.844 -0.664 18090 3364 1 9 . 1 1 48 48 ILE C C 174 176.250 176.250 177.886 -1.636 18090 3365 1 9 . 1 1 48 48 ILE CA C 174 64.030 64.030 64.085 -0.055 18090 3366 1 9 . 1 1 48 48 ILE CB C 174 37.280 37.280 37.082 0.198 18090 3367 1 9 . 1 1 48 48 ILE H H 174 7.150 7.150 7.343 -0.193 18090 3368 1 9 . 1 1 49 49 GLY N N 175 105.390 105.390 106.574 -1.184 18090 3369 1 9 . 1 1 49 49 GLY C C 175 174.220 174.220 176.089 -1.869 18090 3370 1 9 . 1 1 49 49 GLY CA C 175 46.700 46.700 47.032 -0.333 18090 3371 1 9 . 1 1 49 49 GLY H H 175 7.550 7.550 7.776 -0.226 18090 3372 1 9 . 1 1 50 50 GLN N N 176 116.230 116.230 118.694 -2.464 18090 3373 1 9 . 1 1 50 50 GLN HA H 176 4.210 4.210 4.650 -0.440 18090 3374 1 9 . 1 1 50 50 GLN C C 176 178.120 178.120 178.083 0.037 18090 3375 1 9 . 1 1 50 50 GLN CA C 176 57.320 57.320 57.990 -0.670 18090 3376 1 9 . 1 1 50 50 GLN CB C 176 28.630 28.630 29.176 -0.546 18090 3377 1 9 . 1 1 50 50 GLN H H 176 7.390 7.390 8.014 -0.624 18090 3378 1 9 . 1 1 51 51 ASP N N 177 120.000 120.000 120.997 -0.997 18090 3379 1 9 . 1 1 51 51 ASP HA H 177 4.420 4.420 4.707 -0.287 18090 3380 1 9 . 1 1 51 51 ASP C C 177 177.950 177.950 178.265 -0.315 18090 3381 1 9 . 1 1 51 51 ASP CA C 177 55.840 55.840 55.928 -0.088 18090 3382 1 9 . 1 1 51 51 ASP CB C 177 40.310 40.310 41.062 -0.752 18090 3383 1 9 . 1 1 51 51 ASP H H 177 7.870 7.870 8.009 -0.139 18090 3384 1 9 . 1 1 52 52 LEU N N 178 120.010 120.010 120.059 -0.049 18090 3385 1 9 . 1 1 52 52 LEU HA H 178 3.650 3.650 3.964 -0.314 18090 3386 1 9 . 1 1 52 52 LEU C C 178 175.810 175.810 178.223 -2.413 18090 3387 1 9 . 1 1 52 52 LEU CA C 178 57.620 57.620 57.831 -0.211 18090 3388 1 9 . 1 1 52 52 LEU CB C 178 41.880 41.880 41.566 0.314 18090 3389 1 9 . 1 1 52 52 LEU H H 178 7.860 7.860 7.800 0.060 18090 3390 1 9 . 1 1 53 53 PHE N N 179 110.580 110.580 113.588 -3.008 18090 3391 1 9 . 1 1 53 53 PHE HA H 179 4.230 4.230 4.335 -0.105 18090 3392 1 9 . 1 1 53 53 PHE C C 179 176.370 176.370 178.016 -1.646 18090 3393 1 9 . 1 1 53 53 PHE CA C 179 58.730 58.730 60.374 -1.644 18090 3394 1 9 . 1 1 53 53 PHE CB C 179 38.720 38.720 38.848 -0.128 18090 3395 1 9 . 1 1 53 53 PHE H H 179 7.210 7.210 8.304 -1.094 18090 3396 1 9 . 1 1 54 54 THR N N 180 108.190 108.190 110.501 -2.311 18090 3397 1 9 . 1 1 54 54 THR HA H 180 4.300 4.300 4.317 -0.017 18090 3398 1 9 . 1 1 54 54 THR C C 180 174.400 174.400 175.298 -0.898 18090 3399 1 9 . 1 1 54 54 THR CA C 180 62.020 62.020 62.798 -0.778 18090 3400 1 9 . 1 1 54 54 THR CB C 180 69.730 69.730 70.107 -0.377 18090 3401 1 9 . 1 1 54 54 THR H H 180 7.550 7.550 7.705 -0.155 18090 3402 1 9 . 1 1 55 55 ASP N N 181 120.060 120.060 122.847 -2.787 18090 3403 1 9 . 1 1 55 55 ASP HA H 181 5.020 5.020 5.097 -0.077 18090 3404 1 9 . 1 1 55 55 ASP C C 181 174.120 174.120 174.945 -0.825 18090 3405 1 9 . 1 1 55 55 ASP CA C 181 50.560 50.560 50.866 -0.306 18090 3406 1 9 . 1 1 55 55 ASP CB C 181 41.190 41.190 42.559 -1.369 18090 3407 1 9 . 1 1 55 55 ASP H H 181 7.480 7.480 8.085 -0.605 18090 3408 1 9 . 1 1 56 56 PRO HA H 182 4.320 4.320 4.292 0.028 18090 3409 1 9 . 1 1 56 56 PRO CA C 182 64.280 64.280 64.802 -0.522 18090 3410 1 9 . 1 1 56 56 PRO CB C 182 31.980 31.980 32.384 -0.404 18090 3411 1 9 . 1 1 57 57 ARG N N 183 117.660 117.660 117.310 0.350 18090 3412 1 9 . 1 1 57 57 ARG HA H 183 3.960 3.960 4.087 -0.127 18090 3413 1 9 . 1 1 57 57 ARG C C 183 179.030 179.030 178.489 0.541 18090 3414 1 9 . 1 1 57 57 ARG CA C 183 59.000 59.000 58.835 0.165 18090 3415 1 9 . 1 1 57 57 ARG CB C 183 29.750 29.750 29.766 -0.016 18090 3416 1 9 . 1 1 57 57 ARG H H 183 7.920 7.920 8.053 -0.133 18090 3417 1 9 . 1 1 58 58 LEU N N 184 115.670 115.670 119.310 -3.640 18090 3418 1 9 . 1 1 58 58 LEU HA H 184 3.850 3.850 3.943 -0.093 18090 3419 1 9 . 1 1 58 58 LEU C C 184 178.770 178.770 179.033 -0.263 18090 3420 1 9 . 1 1 58 58 LEU CA C 184 57.110 57.110 57.716 -0.606 18090 3421 1 9 . 1 1 58 58 LEU CB C 184 41.310 41.310 41.624 -0.314 18090 3422 1 9 . 1 1 58 58 LEU H H 184 7.750 7.750 7.740 0.010 18090 3423 1 9 . 1 1 59 59 MET N N 185 118.570 118.570 116.080 2.490 18090 3424 1 9 . 1 1 59 59 MET HA H 185 4.060 4.060 4.093 -0.033 18090 3425 1 9 . 1 1 59 59 MET C C 185 177.540 177.540 178.340 -0.800 18090 3426 1 9 . 1 1 59 59 MET CA C 185 58.090 58.090 59.517 -1.427 18090 3427 1 9 . 1 1 59 59 MET CB C 185 31.270 31.270 32.240 -0.970 18090 3428 1 9 . 1 1 59 59 MET H H 185 7.590 7.590 7.698 -0.108 18090 3429 1 9 . 1 1 60 60 THR N N 186 116.390 116.390 117.387 -0.997 18090 3430 1 9 . 1 1 60 60 THR HA H 186 3.680 3.680 4.029 -0.349 18090 3431 1 9 . 1 1 60 60 THR C C 186 177.440 177.440 176.628 0.812 18090 3432 1 9 . 1 1 60 60 THR CA C 186 66.940 66.940 66.260 0.680 18090 3433 1 9 . 1 1 60 60 THR CB C 186 68.030 68.030 68.090 -0.060 18090 3434 1 9 . 1 1 60 60 THR H H 186 7.180 7.180 7.758 -0.578 18090 3435 1 9 . 1 1 61 61 ILE N N 187 123.840 123.840 122.507 1.333 18090 3436 1 9 . 1 1 61 61 ILE HA H 187 3.290 3.290 3.775 -0.485 18090 3437 1 9 . 1 1 61 61 ILE C C 187 176.660 176.660 178.178 -1.518 18090 3438 1 9 . 1 1 61 61 ILE CA C 187 65.850 65.850 65.449 0.401 18090 3439 1 9 . 1 1 61 61 ILE CB C 187 37.640 37.640 37.800 -0.160 18090 3440 1 9 . 1 1 61 61 ILE H H 187 8.010 8.010 7.893 0.117 18090 3441 1 9 . 1 1 62 62 MET N N 188 118.210 118.210 118.319 -0.109 18090 3442 1 9 . 1 1 62 62 MET HA H 188 3.910 3.910 4.069 -0.159 18090 3443 1 9 . 1 1 62 62 MET C C 188 177.540 177.540 178.502 -0.962 18090 3444 1 9 . 1 1 62 62 MET CA C 188 58.530 58.530 58.105 0.425 18090 3445 1 9 . 1 1 62 62 MET CB C 188 31.200 31.200 31.095 0.106 18090 3446 1 9 . 1 1 62 62 MET H H 188 8.560 8.560 7.451 1.109 18090 3447 1 9 . 1 1 63 63 ALA N N 189 119.850 119.850 122.559 -2.709 18090 3448 1 9 . 1 1 63 63 ALA HA H 189 3.730 3.730 3.892 -0.162 18090 3449 1 9 . 1 1 63 63 ALA C C 189 179.550 179.550 179.467 0.083 18090 3450 1 9 . 1 1 63 63 ALA CA C 189 55.470 55.470 55.573 -0.103 18090 3451 1 9 . 1 1 63 63 ALA CB C 189 17.640 17.640 18.183 -0.543 18090 3452 1 9 . 1 1 63 63 ALA H H 189 8.210 8.210 8.152 0.058 18090 3453 1 9 . 1 1 64 64 THR N N 190 114.570 114.570 114.051 0.519 18090 3454 1 9 . 1 1 64 64 THR HA H 190 3.790 3.790 3.973 -0.183 18090 3455 1 9 . 1 1 64 64 THR C C 190 177.640 177.640 176.696 0.944 18090 3456 1 9 . 1 1 64 64 THR CA C 190 66.690 66.690 65.646 1.044 18090 3457 1 9 . 1 1 64 64 THR CB C 190 68.310 68.310 68.182 0.128 18090 3458 1 9 . 1 1 64 64 THR H H 190 7.740 7.740 7.739 0.001 18090 3459 1 9 . 1 1 65 65 LEU N N 191 122.410 122.410 122.605 -0.195 18090 3460 1 9 . 1 1 65 65 LEU HA H 191 3.930 3.930 3.961 -0.031 18090 3461 1 9 . 1 1 65 65 LEU C C 191 178.470 178.470 179.949 -1.479 18090 3462 1 9 . 1 1 65 65 LEU CA C 191 57.120 57.120 58.084 -0.964 18090 3463 1 9 . 1 1 65 65 LEU CB C 191 41.830 41.830 41.706 0.124 18090 3464 1 9 . 1 1 65 65 LEU H H 191 8.180 8.180 7.751 0.429 18090 3465 1 9 . 1 1 66 66 MET N N 192 115.320 115.320 117.144 -1.824 18090 3466 1 9 . 1 1 66 66 MET HA H 192 4.090 4.090 4.305 -0.215 18090 3467 1 9 . 1 1 66 66 MET C C 192 176.090 176.090 178.243 -2.153 18090 3468 1 9 . 1 1 66 66 MET CA C 192 56.390 56.390 57.474 -1.084 18090 3469 1 9 . 1 1 66 66 MET CB C 192 33.770 33.770 31.908 1.862 18090 3470 1 9 . 1 1 66 66 MET H H 192 7.880 7.880 8.573 -0.693 18090 3471 1 9 . 1 1 67 67 GLY N N 193 107.490 107.490 105.034 2.456 18090 3472 1 9 . 1 1 67 67 GLY C C 193 174.390 174.390 174.631 -0.241 18090 3473 1 9 . 1 1 67 67 GLY CA C 193 45.880 45.880 44.865 1.015 18090 3474 1 9 . 1 1 67 67 GLY H H 193 7.580 7.580 8.035 -0.455 18090 3475 1 9 . 1 1 68 68 VAL N N 194 118.520 118.520 116.482 2.038 18090 3476 1 9 . 1 1 68 68 VAL HA H 194 3.940 3.940 3.662 0.278 18090 3477 1 9 . 1 1 68 68 VAL C C 194 174.760 174.760 175.043 -0.283 18090 3478 1 9 . 1 1 68 68 VAL CA C 194 61.510 61.510 63.292 -1.782 18090 3479 1 9 . 1 1 68 68 VAL CB C 194 32.670 32.670 30.921 1.749 18090 3480 1 9 . 1 1 68 68 VAL H H 194 7.840 7.840 7.344 0.496 18090 3481 1 9 . 1 1 69 69 ASP N N 195 124.550 124.550 117.923 6.627 18090 3482 1 9 . 1 1 69 69 ASP HA H 195 4.430 4.430 4.357 0.073 18090 3483 1 9 . 1 1 69 69 ASP C C 195 175.140 175.140 175.058 0.082 18090 3484 1 9 . 1 1 69 69 ASP CA C 195 53.760 53.760 55.741 -1.981 18090 3485 1 9 . 1 1 69 69 ASP CB C 195 40.920 40.920 39.913 1.007 18090 3486 1 9 . 1 1 69 69 ASP H H 195 8.400 8.400 8.115 0.285 18090 3487 1 9 . 1 1 70 70 LEU N N 196 123.930 123.930 117.334 6.596 18090 3488 1 9 . 1 1 70 70 LEU HA H 196 4.200 4.200 4.539 -0.339 18090 3489 1 9 . 1 1 70 70 LEU C C 196 175.950 175.950 175.273 0.677 18090 3490 1 9 . 1 1 70 70 LEU CA C 196 54.380 54.380 53.904 0.476 18090 3491 1 9 . 1 1 70 70 LEU CB C 196 41.610 41.610 44.789 -3.179 18090 3492 1 9 . 1 1 70 70 LEU H H 196 8.160 8.160 7.430 0.730 18090 3493 1 10 . 1 1 2 2 PRO HA H 128 4.220 4.220 4.385 -0.165 18090 3494 1 10 . 1 1 2 2 PRO CA C 128 63.320 63.320 64.403 -1.083 18090 3495 1 10 . 1 1 2 2 PRO CB C 128 31.680 31.680 31.903 -0.223 18090 3496 1 10 . 1 1 3 3 ASP N N 129 119.320 119.320 118.535 0.785 18090 3497 1 10 . 1 1 3 3 ASP HA H 129 4.400 4.400 4.534 -0.134 18090 3498 1 10 . 1 1 3 3 ASP C C 129 176.120 176.120 174.871 1.249 18090 3499 1 10 . 1 1 3 3 ASP CA C 129 54.050 54.050 53.826 0.224 18090 3500 1 10 . 1 1 3 3 ASP CB C 129 40.770 40.770 41.600 -0.830 18090 3501 1 10 . 1 1 3 3 ASP H H 129 8.310 8.310 8.081 0.229 18090 3502 1 10 . 1 1 4 4 LEU N N 130 122.280 122.280 121.443 0.837 18090 3503 1 10 . 1 1 4 4 LEU HA H 130 4.130 4.130 4.577 -0.447 18090 3504 1 10 . 1 1 4 4 LEU C C 130 177.280 177.280 176.236 1.044 18090 3505 1 10 . 1 1 4 4 LEU CA C 130 55.350 55.350 54.416 0.934 18090 3506 1 10 . 1 1 4 4 LEU CB C 130 41.490 41.490 43.738 -2.248 18090 3507 1 10 . 1 1 4 4 LEU H H 130 8.080 8.080 8.512 -0.432 18090 3508 1 10 . 1 1 5 5 GLY N N 131 107.830 107.830 113.534 -5.704 18090 3509 1 10 . 1 1 5 5 GLY C C 131 175.120 175.120 173.176 1.944 18090 3510 1 10 . 1 1 5 5 GLY CA C 131 45.300 45.300 45.857 -0.557 18090 3511 1 10 . 1 1 5 5 GLY H H 131 8.180 8.180 8.137 0.043 18090 3512 1 10 . 1 1 6 6 LEU N N 132 121.080 121.080 118.661 2.419 18090 3513 1 10 . 1 1 6 6 LEU HA H 132 3.870 3.870 4.314 -0.444 18090 3514 1 10 . 1 1 6 6 LEU C C 132 178.000 178.000 177.429 0.571 18090 3515 1 10 . 1 1 6 6 LEU CA C 132 57.180 57.180 53.435 3.745 18090 3516 1 10 . 1 1 6 6 LEU CB C 132 41.870 41.870 42.760 -0.890 18090 3517 1 10 . 1 1 6 6 LEU H H 132 8.150 8.150 7.402 0.748 18090 3518 1 10 . 1 1 7 7 THR N N 133 111.580 111.580 114.178 -2.598 18090 3519 1 10 . 1 1 7 7 THR HA H 133 3.730 3.730 3.928 -0.198 18090 3520 1 10 . 1 1 7 7 THR C C 133 176.530 176.530 176.039 0.491 18090 3521 1 10 . 1 1 7 7 THR CA C 133 65.940 65.940 65.888 0.052 18090 3522 1 10 . 1 1 7 7 THR CB C 133 68.130 68.130 68.697 -0.567 18090 3523 1 10 . 1 1 7 7 THR H H 133 7.970 7.970 8.608 -0.638 18090 3524 1 10 . 1 1 8 8 GLN N N 134 119.490 119.490 121.176 -1.686 18090 3525 1 10 . 1 1 8 8 GLN HA H 134 3.990 3.990 3.917 0.073 18090 3526 1 10 . 1 1 8 8 GLN C C 134 178.190 178.190 178.176 0.014 18090 3527 1 10 . 1 1 8 8 GLN CA C 134 57.930 57.930 58.628 -0.698 18090 3528 1 10 . 1 1 8 8 GLN CB C 134 27.850 27.850 28.010 -0.160 18090 3529 1 10 . 1 1 8 8 GLN H H 134 7.890 7.890 8.371 -0.481 18090 3530 1 10 . 1 1 9 9 LEU N N 135 120.170 120.170 118.050 2.120 18090 3531 1 10 . 1 1 9 9 LEU HA H 135 3.820 3.820 3.948 -0.128 18090 3532 1 10 . 1 1 9 9 LEU C C 135 177.810 177.810 178.390 -0.580 18090 3533 1 10 . 1 1 9 9 LEU CA C 135 57.470 57.470 57.170 0.300 18090 3534 1 10 . 1 1 9 9 LEU CB C 135 41.640 41.640 41.919 -0.279 18090 3535 1 10 . 1 1 9 9 LEU H H 135 7.600 7.600 7.318 0.282 18090 3536 1 10 . 1 1 10 10 PHE N N 136 111.950 111.950 113.126 -1.176 18090 3537 1 10 . 1 1 10 10 PHE HA H 136 4.380 4.380 4.392 -0.012 18090 3538 1 10 . 1 1 10 10 PHE C C 136 174.990 174.990 177.173 -2.183 18090 3539 1 10 . 1 1 10 10 PHE CA C 136 58.450 58.450 57.364 1.086 18090 3540 1 10 . 1 1 10 10 PHE CB C 136 38.570 38.570 37.911 0.659 18090 3541 1 10 . 1 1 10 10 PHE H H 136 7.410 7.410 6.621 0.789 18090 3542 1 10 . 1 1 11 11 ALA N N 137 120.230 120.230 122.162 -1.932 18090 3543 1 10 . 1 1 11 11 ALA HA H 137 4.130 4.130 4.153 -0.023 18090 3544 1 10 . 1 1 11 11 ALA C C 137 177.090 177.090 178.236 -1.146 18090 3545 1 10 . 1 1 11 11 ALA CA C 137 52.580 52.580 53.536 -0.956 18090 3546 1 10 . 1 1 11 11 ALA CB C 137 18.660 18.660 18.750 -0.090 18090 3547 1 10 . 1 1 11 11 ALA H H 137 7.330 7.330 8.509 -1.179 18090 3548 1 10 . 1 1 12 12 ASP N N 138 119.830 119.830 120.804 -0.974 18090 3549 1 10 . 1 1 12 12 ASP HA H 138 4.510 4.510 4.762 -0.252 18090 3550 1 10 . 1 1 12 12 ASP C C 138 176.370 176.370 174.541 1.829 18090 3551 1 10 . 1 1 12 12 ASP CA C 138 51.960 51.960 52.872 -0.912 18090 3552 1 10 . 1 1 12 12 ASP CB C 138 41.990 41.990 41.650 0.341 18090 3553 1 10 . 1 1 12 12 ASP H H 138 6.980 6.980 7.632 -0.652 18090 3554 1 10 . 1 1 13 13 PRO HA H 139 4.260 4.260 4.392 -0.132 18090 3555 1 10 . 1 1 13 13 PRO CA C 139 64.350 64.350 62.909 1.441 18090 3556 1 10 . 1 1 13 13 PRO CB C 139 31.760 31.760 32.408 -0.648 18090 3557 1 10 . 1 1 14 14 ASN N N 140 116.840 116.840 117.389 -0.549 18090 3558 1 10 . 1 1 14 14 ASN HA H 140 4.840 4.840 4.477 0.363 18090 3559 1 10 . 1 1 14 14 ASN C C 140 173.840 173.840 175.308 -1.468 18090 3560 1 10 . 1 1 14 14 ASN CA C 140 52.380 52.380 54.159 -1.779 18090 3561 1 10 . 1 1 14 14 ASN CB C 140 38.330 38.330 36.947 1.383 18090 3562 1 10 . 1 1 14 14 ASN H H 140 8.670 8.670 8.683 -0.013 18090 3563 1 10 . 1 1 15 15 LEU N N 141 120.290 120.290 120.027 0.263 18090 3564 1 10 . 1 1 15 15 LEU HA H 141 3.790 3.790 4.530 -0.740 18090 3565 1 10 . 1 1 15 15 LEU C C 141 177.120 177.120 177.490 -0.370 18090 3566 1 10 . 1 1 15 15 LEU CA C 141 59.280 59.280 55.657 3.623 18090 3567 1 10 . 1 1 15 15 LEU CB C 141 42.980 42.980 43.081 -0.101 18090 3568 1 10 . 1 1 15 15 LEU H H 141 7.200 7.200 8.371 -1.171 18090 3569 1 10 . 1 1 16 16 ILE N N 142 115.290 115.290 120.495 -5.205 18090 3570 1 10 . 1 1 16 16 ILE HA H 142 3.480 3.480 3.676 -0.196 18090 3571 1 10 . 1 1 16 16 ILE C C 142 177.990 177.990 177.451 0.539 18090 3572 1 10 . 1 1 16 16 ILE CA C 142 62.690 62.690 65.240 -2.550 18090 3573 1 10 . 1 1 16 16 ILE CB C 142 34.620 34.620 37.732 -3.112 18090 3574 1 10 . 1 1 16 16 ILE H H 142 7.940 7.940 8.413 -0.473 18090 3575 1 10 . 1 1 17 17 GLU N N 143 119.600 119.600 119.189 0.411 18090 3576 1 10 . 1 1 17 17 GLU HA H 143 3.700 3.700 3.990 -0.290 18090 3577 1 10 . 1 1 17 17 GLU C C 143 179.170 179.170 178.808 0.362 18090 3578 1 10 . 1 1 17 17 GLU CA C 143 59.360 59.360 60.128 -0.768 18090 3579 1 10 . 1 1 17 17 GLU CB C 143 28.520 28.520 29.185 -0.665 18090 3580 1 10 . 1 1 17 17 GLU H H 143 7.970 7.970 8.579 -0.609 18090 3581 1 10 . 1 1 18 18 ASN N N 144 117.170 117.170 117.974 -0.804 18090 3582 1 10 . 1 1 18 18 ASN HA H 144 4.270 4.270 4.454 -0.184 18090 3583 1 10 . 1 1 18 18 ASN C C 144 179.120 179.120 177.819 1.301 18090 3584 1 10 . 1 1 18 18 ASN CA C 144 55.490 55.490 55.652 -0.162 18090 3585 1 10 . 1 1 18 18 ASN CB C 144 36.550 36.550 37.841 -1.291 18090 3586 1 10 . 1 1 18 18 ASN H H 144 8.450 8.450 8.354 0.096 18090 3587 1 10 . 1 1 19 19 LEU N N 145 121.060 121.060 120.187 0.873 18090 3588 1 10 . 1 1 19 19 LEU HA H 145 4.020 4.020 3.988 0.032 18090 3589 1 10 . 1 1 19 19 LEU C C 145 180.260 180.260 178.560 1.700 18090 3590 1 10 . 1 1 19 19 LEU CA C 145 56.620 56.620 57.444 -0.825 18090 3591 1 10 . 1 1 19 19 LEU CB C 145 41.780 41.780 41.546 0.234 18090 3592 1 10 . 1 1 19 19 LEU H H 145 7.990 7.990 7.600 0.390 18090 3593 1 10 . 1 1 20 20 LYS N N 146 118.960 118.960 117.795 1.165 18090 3594 1 10 . 1 1 20 20 LYS HA H 146 3.610 3.610 4.005 -0.395 18090 3595 1 10 . 1 1 20 20 LYS C C 146 177.390 177.390 178.228 -0.838 18090 3596 1 10 . 1 1 20 20 LYS CA C 146 59.640 59.640 59.310 0.330 18090 3597 1 10 . 1 1 20 20 LYS CB C 146 32.450 32.450 32.356 0.094 18090 3598 1 10 . 1 1 20 20 LYS H H 146 8.250 8.250 7.979 0.271 18090 3599 1 10 . 1 1 21 21 LYS N N 147 114.720 114.720 116.630 -1.910 18090 3600 1 10 . 1 1 21 21 LYS HA H 147 4.110 4.110 4.236 -0.126 18090 3601 1 10 . 1 1 21 21 LYS C C 147 175.880 175.880 178.176 -2.296 18090 3602 1 10 . 1 1 21 21 LYS CA C 147 56.210 56.210 58.229 -2.019 18090 3603 1 10 . 1 1 21 21 LYS CB C 147 33.000 33.000 32.696 0.304 18090 3604 1 10 . 1 1 21 21 LYS H H 147 7.130 7.130 7.641 -0.511 18090 3605 1 10 . 1 1 22 22 ASN N N 148 122.180 122.180 115.498 6.682 18090 3606 1 10 . 1 1 22 22 ASN HA H 148 4.740 4.740 4.906 -0.166 18090 3607 1 10 . 1 1 22 22 ASN C C 148 174.000 174.000 173.526 0.474 18090 3608 1 10 . 1 1 22 22 ASN CA C 148 50.970 50.970 52.797 -1.827 18090 3609 1 10 . 1 1 22 22 ASN CB C 148 38.670 38.670 38.918 -0.248 18090 3610 1 10 . 1 1 22 22 ASN H H 148 6.930 6.930 7.851 -0.921 18090 3611 1 10 . 1 1 23 23 PRO HA H 149 4.300 4.300 4.700 -0.400 18090 3612 1 10 . 1 1 23 23 PRO CA C 149 64.610 64.610 61.975 2.635 18090 3613 1 10 . 1 1 23 23 PRO CB C 149 32.000 32.000 34.232 -2.232 18090 3614 1 10 . 1 1 24 24 LYS N N 150 116.060 116.060 121.035 -4.975 18090 3615 1 10 . 1 1 24 24 LYS HA H 150 4.070 4.070 3.953 0.117 18090 3616 1 10 . 1 1 24 24 LYS C C 150 178.240 178.240 178.274 -0.034 18090 3617 1 10 . 1 1 24 24 LYS CA C 150 57.950 57.950 59.573 -1.623 18090 3618 1 10 . 1 1 24 24 LYS CB C 150 32.590 32.590 31.845 0.745 18090 3619 1 10 . 1 1 24 24 LYS H H 150 8.520 8.520 8.819 -0.299 18090 3620 1 10 . 1 1 25 25 THR N N 151 105.190 105.190 110.579 -5.389 18090 3621 1 10 . 1 1 25 25 THR HA H 151 4.390 4.390 4.090 0.300 18090 3622 1 10 . 1 1 25 25 THR C C 151 176.090 176.090 176.089 0.001 18090 3623 1 10 . 1 1 25 25 THR CA C 151 61.400 61.400 64.810 -3.410 18090 3624 1 10 . 1 1 25 25 THR CB C 151 69.440 69.440 67.690 1.750 18090 3625 1 10 . 1 1 25 25 THR H H 151 7.490 7.490 8.217 -0.727 18090 3626 1 10 . 1 1 26 26 SER N N 152 119.700 119.700 116.988 2.712 18090 3627 1 10 . 1 1 26 26 SER HA H 152 3.770 3.770 4.162 -0.392 18090 3628 1 10 . 1 1 26 26 SER C C 152 177.470 177.470 176.119 1.351 18090 3629 1 10 . 1 1 26 26 SER CA C 152 62.450 62.450 61.414 1.036 18090 3630 1 10 . 1 1 26 26 SER CB C 152 62.520 62.520 62.575 -0.055 18090 3631 1 10 . 1 1 26 26 SER H H 152 8.190 8.190 7.945 0.245 18090 3632 1 10 . 1 1 27 27 GLU N N 153 119.870 119.870 122.765 -2.895 18090 3633 1 10 . 1 1 27 27 GLU HA H 153 3.890 3.890 3.960 -0.070 18090 3634 1 10 . 1 1 27 27 GLU C C 153 180.040 180.040 178.717 1.323 18090 3635 1 10 . 1 1 27 27 GLU CA C 153 58.700 58.700 59.373 -0.673 18090 3636 1 10 . 1 1 27 27 GLU CB C 153 28.590 28.590 29.452 -0.862 18090 3637 1 10 . 1 1 27 27 GLU H H 153 8.350 8.350 7.756 0.594 18090 3638 1 10 . 1 1 28 28 MET N N 154 119.430 119.430 116.873 2.557 18090 3639 1 10 . 1 1 28 28 MET HA H 154 4.040 4.040 4.170 -0.130 18090 3640 1 10 . 1 1 28 28 MET C C 154 177.110 177.110 178.134 -1.024 18090 3641 1 10 . 1 1 28 28 MET CA C 154 58.510 58.510 58.578 -0.068 18090 3642 1 10 . 1 1 28 28 MET CB C 154 31.430 31.430 32.731 -1.302 18090 3643 1 10 . 1 1 28 28 MET H H 154 7.850 7.850 7.643 0.207 18090 3644 1 10 . 1 1 29 29 MET N N 155 112.640 112.640 114.386 -1.746 18090 3645 1 10 . 1 1 29 29 MET HA H 155 4.340 4.340 4.253 0.087 18090 3646 1 10 . 1 1 29 29 MET C C 155 175.530 175.530 177.821 -2.291 18090 3647 1 10 . 1 1 29 29 MET CA C 155 53.790 53.790 57.163 -3.373 18090 3648 1 10 . 1 1 29 29 MET CB C 155 30.380 30.380 32.125 -1.745 18090 3649 1 10 . 1 1 29 29 MET H H 155 7.200 7.200 7.348 -0.148 18090 3650 1 10 . 1 1 30 30 LYS N N 156 117.050 117.050 116.906 0.144 18090 3651 1 10 . 1 1 30 30 LYS HA H 156 3.960 3.960 4.284 -0.324 18090 3652 1 10 . 1 1 30 30 LYS C C 156 176.120 176.120 177.006 -0.886 18090 3653 1 10 . 1 1 30 30 LYS CA C 156 57.090 57.090 57.277 -0.187 18090 3654 1 10 . 1 1 30 30 LYS CB C 156 31.960 31.960 33.041 -1.081 18090 3655 1 10 . 1 1 30 30 LYS H H 156 7.130 7.130 7.658 -0.528 18090 3656 1 10 . 1 1 31 31 ASP N N 157 119.810 119.810 118.311 1.499 18090 3657 1 10 . 1 1 31 31 ASP HA H 157 4.860 4.860 4.885 -0.025 18090 3658 1 10 . 1 1 31 31 ASP C C 157 174.890 174.890 174.365 0.525 18090 3659 1 10 . 1 1 31 31 ASP CA C 157 50.520 50.520 54.639 -4.119 18090 3660 1 10 . 1 1 31 31 ASP CB C 157 41.010 41.010 40.749 0.261 18090 3661 1 10 . 1 1 31 31 ASP H H 157 7.340 7.340 7.773 -0.433 18090 3662 1 10 . 1 1 32 32 PRO HA H 158 4.130 4.130 4.445 -0.315 18090 3663 1 10 . 1 1 32 32 PRO CA C 158 64.270 64.270 62.834 1.436 18090 3664 1 10 . 1 1 32 32 PRO CB C 158 31.770 31.770 32.408 -0.638 18090 3665 1 10 . 1 1 33 33 GLN N N 159 117.760 117.760 120.275 -2.515 18090 3666 1 10 . 1 1 33 33 GLN HA H 159 4.000 4.000 4.041 -0.041 18090 3667 1 10 . 1 1 33 33 GLN C C 159 178.740 178.740 177.946 0.794 18090 3668 1 10 . 1 1 33 33 GLN CA C 159 58.220 58.220 58.039 0.181 18090 3669 1 10 . 1 1 33 33 GLN CB C 159 27.870 27.870 28.080 -0.210 18090 3670 1 10 . 1 1 33 33 GLN H H 159 8.150 8.150 8.768 -0.618 18090 3671 1 10 . 1 1 34 34 LEU N N 160 123.300 123.300 120.203 3.097 18090 3672 1 10 . 1 1 34 34 LEU HA H 160 3.970 3.970 4.020 -0.050 18090 3673 1 10 . 1 1 34 34 LEU C C 160 177.980 177.980 178.168 -0.188 18090 3674 1 10 . 1 1 34 34 LEU CA C 160 57.050 57.050 57.297 -0.247 18090 3675 1 10 . 1 1 34 34 LEU CB C 160 40.760 40.760 41.642 -0.882 18090 3676 1 10 . 1 1 34 34 LEU H H 160 7.110 7.110 7.995 -0.885 18090 3677 1 10 . 1 1 35 35 VAL N N 161 118.390 118.390 119.287 -0.897 18090 3678 1 10 . 1 1 35 35 VAL HA H 161 3.110 3.110 3.553 -0.443 18090 3679 1 10 . 1 1 35 35 VAL C C 161 176.840 176.840 177.948 -1.108 18090 3680 1 10 . 1 1 35 35 VAL CA C 161 67.700 67.700 66.635 1.065 18090 3681 1 10 . 1 1 35 35 VAL CB C 161 31.260 31.260 30.613 0.646 18090 3682 1 10 . 1 1 35 35 VAL H H 161 7.430 7.430 7.424 0.006 18090 3683 1 10 . 1 1 36 36 ALA N N 162 117.600 117.600 121.706 -4.106 18090 3684 1 10 . 1 1 36 36 ALA HA H 162 3.810 3.810 3.937 -0.127 18090 3685 1 10 . 1 1 36 36 ALA C C 162 180.620 180.620 179.714 0.906 18090 3686 1 10 . 1 1 36 36 ALA CA C 162 54.720 54.720 55.365 -0.645 18090 3687 1 10 . 1 1 36 36 ALA CB C 162 17.490 17.490 18.192 -0.702 18090 3688 1 10 . 1 1 36 36 ALA H H 162 7.500 7.500 7.825 -0.325 18090 3689 1 10 . 1 1 37 37 LYS N N 163 119.880 119.880 118.508 1.372 18090 3690 1 10 . 1 1 37 37 LYS HA H 163 3.570 3.570 3.984 -0.414 18090 3691 1 10 . 1 1 37 37 LYS C C 163 177.800 177.800 179.118 -1.318 18090 3692 1 10 . 1 1 37 37 LYS CA C 163 58.880 58.880 58.938 -0.058 18090 3693 1 10 . 1 1 37 37 LYS CB C 163 31.610 31.610 32.031 -0.421 18090 3694 1 10 . 1 1 37 37 LYS H H 163 7.350 7.350 7.413 -0.063 18090 3695 1 10 . 1 1 38 38 LEU N N 164 118.020 118.020 119.993 -1.973 18090 3696 1 10 . 1 1 38 38 LEU HA H 164 3.670 3.670 4.069 -0.399 18090 3697 1 10 . 1 1 38 38 LEU C C 164 179.380 179.380 179.208 0.172 18090 3698 1 10 . 1 1 38 38 LEU CA C 164 57.340 57.340 57.757 -0.417 18090 3699 1 10 . 1 1 38 38 LEU CB C 164 41.660 41.660 41.709 -0.049 18090 3700 1 10 . 1 1 38 38 LEU H H 164 7.660 7.660 8.125 -0.465 18090 3701 1 10 . 1 1 39 39 ILE N N 165 118.070 118.070 118.295 -0.225 18090 3702 1 10 . 1 1 39 39 ILE HA H 165 3.510 3.510 3.640 -0.130 18090 3703 1 10 . 1 1 39 39 ILE C C 165 179.570 179.570 178.230 1.340 18090 3704 1 10 . 1 1 39 39 ILE CA C 165 64.450 64.450 65.524 -1.074 18090 3705 1 10 . 1 1 39 39 ILE CB C 165 37.310 37.310 37.463 -0.153 18090 3706 1 10 . 1 1 39 39 ILE H H 165 8.030 8.030 7.981 0.049 18090 3707 1 10 . 1 1 40 40 GLY N N 166 107.970 107.970 107.922 0.048 18090 3708 1 10 . 1 1 40 40 GLY C C 166 176.470 176.470 175.708 0.762 18090 3709 1 10 . 1 1 40 40 GLY CA C 166 46.410 46.410 46.951 -0.541 18090 3710 1 10 . 1 1 40 40 GLY H H 166 7.590 7.590 7.618 -0.028 18090 3711 1 10 . 1 1 41 41 TYR N N 167 121.270 121.270 122.348 -1.078 18090 3712 1 10 . 1 1 41 41 TYR HA H 167 4.190 4.190 4.209 -0.019 18090 3713 1 10 . 1 1 41 41 TYR C C 167 176.470 176.470 176.221 0.249 18090 3714 1 10 . 1 1 41 41 TYR CA C 167 57.130 57.130 60.401 -3.271 18090 3715 1 10 . 1 1 41 41 TYR CB C 167 35.950 35.950 38.224 -2.274 18090 3716 1 10 . 1 1 41 41 TYR H H 167 7.350 7.350 7.858 -0.508 18090 3717 1 10 . 1 1 42 42 LYS N N 168 116.520 116.520 116.011 0.509 18090 3718 1 10 . 1 1 42 42 LYS HA H 168 3.820 3.820 4.058 -0.238 18090 3719 1 10 . 1 1 42 42 LYS C C 168 177.810 177.810 177.916 -0.106 18090 3720 1 10 . 1 1 42 42 LYS CA C 168 59.390 59.390 58.340 1.050 18090 3721 1 10 . 1 1 42 42 LYS CB C 168 31.580 31.580 32.750 -1.170 18090 3722 1 10 . 1 1 42 42 LYS H H 168 7.460 7.460 8.275 -0.815 18090 3723 1 10 . 1 1 43 43 GLN N N 169 113.750 113.750 116.071 -2.321 18090 3724 1 10 . 1 1 43 43 GLN HA H 169 4.220 4.220 4.154 0.066 18090 3725 1 10 . 1 1 43 43 GLN C C 169 175.840 175.840 177.411 -1.571 18090 3726 1 10 . 1 1 43 43 GLN CA C 169 56.230 56.230 58.167 -1.937 18090 3727 1 10 . 1 1 43 43 GLN CB C 169 29.290 29.290 29.383 -0.092 18090 3728 1 10 . 1 1 43 43 GLN H H 169 7.220 7.220 7.656 -0.436 18090 3729 1 10 . 1 1 44 44 ASN N N 170 114.130 114.130 116.295 -2.165 18090 3730 1 10 . 1 1 44 44 ASN HA H 170 5.050 5.050 4.956 0.094 18090 3731 1 10 . 1 1 44 44 ASN C C 170 172.200 172.200 173.548 -1.348 18090 3732 1 10 . 1 1 44 44 ASN CA C 170 50.780 50.780 53.548 -2.768 18090 3733 1 10 . 1 1 44 44 ASN CB C 170 38.380 38.380 39.714 -1.334 18090 3734 1 10 . 1 1 44 44 ASN H H 170 7.580 7.580 7.655 -0.075 18090 3735 1 10 . 1 1 45 45 PRO HA H 171 4.130 4.130 4.677 -0.547 18090 3736 1 10 . 1 1 45 45 PRO CA C 171 64.800 64.800 62.086 2.714 18090 3737 1 10 . 1 1 45 45 PRO CB C 171 31.360 31.360 31.943 -0.583 18090 3738 1 10 . 1 1 46 46 GLN N N 172 115.570 115.570 124.885 -9.315 18090 3739 1 10 . 1 1 46 46 GLN HA H 172 3.770 3.770 3.833 -0.063 18090 3740 1 10 . 1 1 46 46 GLN C C 172 177.360 177.360 177.594 -0.234 18090 3741 1 10 . 1 1 46 46 GLN CA C 172 57.950 57.950 58.206 -0.256 18090 3742 1 10 . 1 1 46 46 GLN CB C 172 27.050 27.050 27.671 -0.621 18090 3743 1 10 . 1 1 46 46 GLN H H 172 8.160 8.160 8.565 -0.405 18090 3744 1 10 . 1 1 47 47 ALA N N 173 121.420 121.420 121.815 -0.395 18090 3745 1 10 . 1 1 47 47 ALA HA H 173 4.050 4.050 4.165 -0.115 18090 3746 1 10 . 1 1 47 47 ALA C C 173 178.090 178.090 179.554 -1.464 18090 3747 1 10 . 1 1 47 47 ALA CA C 173 53.490 53.490 53.924 -0.434 18090 3748 1 10 . 1 1 47 47 ALA CB C 173 18.450 18.450 17.629 0.821 18090 3749 1 10 . 1 1 47 47 ALA H H 173 7.470 7.470 8.111 -0.641 18090 3750 1 10 . 1 1 48 48 ILE N N 174 118.050 118.050 118.837 -0.787 18090 3751 1 10 . 1 1 48 48 ILE HA H 174 3.180 3.180 3.878 -0.698 18090 3752 1 10 . 1 1 48 48 ILE C C 174 176.250 176.250 177.912 -1.662 18090 3753 1 10 . 1 1 48 48 ILE CA C 174 64.030 64.030 64.140 -0.110 18090 3754 1 10 . 1 1 48 48 ILE CB C 174 37.280 37.280 37.096 0.184 18090 3755 1 10 . 1 1 48 48 ILE H H 174 7.150 7.150 7.330 -0.180 18090 3756 1 10 . 1 1 49 49 GLY N N 175 105.390 105.390 106.606 -1.216 18090 3757 1 10 . 1 1 49 49 GLY C C 175 174.220 174.220 176.292 -2.072 18090 3758 1 10 . 1 1 49 49 GLY CA C 175 46.700 46.700 47.115 -0.415 18090 3759 1 10 . 1 1 49 49 GLY H H 175 7.550 7.550 7.837 -0.287 18090 3760 1 10 . 1 1 50 50 GLN N N 176 116.230 116.230 117.888 -1.658 18090 3761 1 10 . 1 1 50 50 GLN HA H 176 4.210 4.210 4.678 -0.468 18090 3762 1 10 . 1 1 50 50 GLN C C 176 178.120 178.120 177.893 0.227 18090 3763 1 10 . 1 1 50 50 GLN CA C 176 57.320 57.320 57.837 -0.517 18090 3764 1 10 . 1 1 50 50 GLN CB C 176 28.630 28.630 28.869 -0.239 18090 3765 1 10 . 1 1 50 50 GLN H H 176 7.390 7.390 7.926 -0.536 18090 3766 1 10 . 1 1 51 51 ASP N N 177 120.000 120.000 121.225 -1.225 18090 3767 1 10 . 1 1 51 51 ASP HA H 177 4.420 4.420 4.680 -0.260 18090 3768 1 10 . 1 1 51 51 ASP C C 177 177.950 177.950 178.464 -0.514 18090 3769 1 10 . 1 1 51 51 ASP CA C 177 55.840 55.840 56.021 -0.181 18090 3770 1 10 . 1 1 51 51 ASP CB C 177 40.310 40.310 40.921 -0.611 18090 3771 1 10 . 1 1 51 51 ASP H H 177 7.870 7.870 8.038 -0.168 18090 3772 1 10 . 1 1 52 52 LEU N N 178 120.010 120.010 120.326 -0.316 18090 3773 1 10 . 1 1 52 52 LEU HA H 178 3.650 3.650 3.979 -0.329 18090 3774 1 10 . 1 1 52 52 LEU C C 178 175.810 175.810 178.199 -2.389 18090 3775 1 10 . 1 1 52 52 LEU CA C 178 57.620 57.620 57.801 -0.181 18090 3776 1 10 . 1 1 52 52 LEU CB C 178 41.880 41.880 41.689 0.191 18090 3777 1 10 . 1 1 52 52 LEU H H 178 7.860 7.860 7.735 0.125 18090 3778 1 10 . 1 1 53 53 PHE N N 179 110.580 110.580 111.909 -1.329 18090 3779 1 10 . 1 1 53 53 PHE HA H 179 4.230 4.230 4.316 -0.086 18090 3780 1 10 . 1 1 53 53 PHE C C 179 176.370 176.370 177.385 -1.015 18090 3781 1 10 . 1 1 53 53 PHE CA C 179 58.730 58.730 60.131 -1.401 18090 3782 1 10 . 1 1 53 53 PHE CB C 179 38.720 38.720 38.891 -0.171 18090 3783 1 10 . 1 1 53 53 PHE H H 179 7.210 7.210 7.852 -0.642 18090 3784 1 10 . 1 1 54 54 THR N N 180 108.190 108.190 108.922 -0.732 18090 3785 1 10 . 1 1 54 54 THR HA H 180 4.300 4.300 4.289 0.011 18090 3786 1 10 . 1 1 54 54 THR C C 180 174.400 174.400 175.311 -0.911 18090 3787 1 10 . 1 1 54 54 THR CA C 180 62.020 62.020 62.643 -0.623 18090 3788 1 10 . 1 1 54 54 THR CB C 180 69.730 69.730 69.931 -0.201 18090 3789 1 10 . 1 1 54 54 THR H H 180 7.550 7.550 7.479 0.071 18090 3790 1 10 . 1 1 55 55 ASP N N 181 120.060 120.060 122.668 -2.608 18090 3791 1 10 . 1 1 55 55 ASP HA H 181 5.020 5.020 5.063 -0.043 18090 3792 1 10 . 1 1 55 55 ASP C C 181 174.120 174.120 175.475 -1.355 18090 3793 1 10 . 1 1 55 55 ASP CA C 181 50.560 50.560 50.700 -0.140 18090 3794 1 10 . 1 1 55 55 ASP CB C 181 41.190 41.190 42.947 -1.757 18090 3795 1 10 . 1 1 55 55 ASP H H 181 7.480 7.480 8.027 -0.547 18090 3796 1 10 . 1 1 56 56 PRO HA H 182 4.320 4.320 4.339 -0.019 18090 3797 1 10 . 1 1 56 56 PRO CA C 182 64.280 64.280 64.827 -0.547 18090 3798 1 10 . 1 1 56 56 PRO CB C 182 31.980 31.980 32.565 -0.585 18090 3799 1 10 . 1 1 57 57 ARG N N 183 117.660 117.660 118.667 -1.007 18090 3800 1 10 . 1 1 57 57 ARG HA H 183 3.960 3.960 4.094 -0.134 18090 3801 1 10 . 1 1 57 57 ARG C C 183 179.030 179.030 178.602 0.428 18090 3802 1 10 . 1 1 57 57 ARG CA C 183 59.000 59.000 58.837 0.163 18090 3803 1 10 . 1 1 57 57 ARG CB C 183 29.750 29.750 29.297 0.453 18090 3804 1 10 . 1 1 57 57 ARG H H 183 7.920 7.920 8.100 -0.180 18090 3805 1 10 . 1 1 58 58 LEU N N 184 115.670 115.670 119.602 -3.932 18090 3806 1 10 . 1 1 58 58 LEU HA H 184 3.850 3.850 3.954 -0.104 18090 3807 1 10 . 1 1 58 58 LEU C C 184 178.770 178.770 179.095 -0.325 18090 3808 1 10 . 1 1 58 58 LEU CA C 184 57.110 57.110 57.781 -0.671 18090 3809 1 10 . 1 1 58 58 LEU CB C 184 41.310 41.310 41.601 -0.291 18090 3810 1 10 . 1 1 58 58 LEU H H 184 7.750 7.750 8.162 -0.412 18090 3811 1 10 . 1 1 59 59 MET N N 185 118.570 118.570 116.579 1.991 18090 3812 1 10 . 1 1 59 59 MET HA H 185 4.060 4.060 4.093 -0.033 18090 3813 1 10 . 1 1 59 59 MET C C 185 177.540 177.540 178.345 -0.805 18090 3814 1 10 . 1 1 59 59 MET CA C 185 58.090 58.090 59.712 -1.622 18090 3815 1 10 . 1 1 59 59 MET CB C 185 31.270 31.270 32.183 -0.913 18090 3816 1 10 . 1 1 59 59 MET H H 185 7.590 7.590 7.757 -0.167 18090 3817 1 10 . 1 1 60 60 THR N N 186 116.390 116.390 117.426 -1.036 18090 3818 1 10 . 1 1 60 60 THR HA H 186 3.680 3.680 4.004 -0.324 18090 3819 1 10 . 1 1 60 60 THR C C 186 177.440 177.440 176.407 1.033 18090 3820 1 10 . 1 1 60 60 THR CA C 186 66.940 66.940 67.302 -0.362 18090 3821 1 10 . 1 1 60 60 THR CB C 186 68.030 68.030 68.228 -0.198 18090 3822 1 10 . 1 1 60 60 THR H H 186 7.180 7.180 7.758 -0.578 18090 3823 1 10 . 1 1 61 61 ILE N N 187 123.840 123.840 122.152 1.688 18090 3824 1 10 . 1 1 61 61 ILE HA H 187 3.290 3.290 3.749 -0.459 18090 3825 1 10 . 1 1 61 61 ILE C C 187 176.660 176.660 178.101 -1.441 18090 3826 1 10 . 1 1 61 61 ILE CA C 187 65.850 65.850 65.649 0.201 18090 3827 1 10 . 1 1 61 61 ILE CB C 187 37.640 37.640 37.890 -0.250 18090 3828 1 10 . 1 1 61 61 ILE H H 187 8.010 8.010 7.836 0.174 18090 3829 1 10 . 1 1 62 62 MET N N 188 118.210 118.210 117.998 0.212 18090 3830 1 10 . 1 1 62 62 MET HA H 188 3.910 3.910 4.066 -0.156 18090 3831 1 10 . 1 1 62 62 MET C C 188 177.540 177.540 178.430 -0.890 18090 3832 1 10 . 1 1 62 62 MET CA C 188 58.530 58.530 58.985 -0.455 18090 3833 1 10 . 1 1 62 62 MET CB C 188 31.200 31.200 31.661 -0.461 18090 3834 1 10 . 1 1 62 62 MET H H 188 8.560 8.560 7.367 1.193 18090 3835 1 10 . 1 1 63 63 ALA N N 189 119.850 119.850 121.945 -2.095 18090 3836 1 10 . 1 1 63 63 ALA HA H 189 3.730 3.730 3.920 -0.190 18090 3837 1 10 . 1 1 63 63 ALA C C 189 179.550 179.550 179.264 0.286 18090 3838 1 10 . 1 1 63 63 ALA CA C 189 55.470 55.470 55.642 -0.172 18090 3839 1 10 . 1 1 63 63 ALA CB C 189 17.640 17.640 18.129 -0.489 18090 3840 1 10 . 1 1 63 63 ALA H H 189 8.210 8.210 8.403 -0.193 18090 3841 1 10 . 1 1 64 64 THR N N 190 114.570 114.570 113.431 1.139 18090 3842 1 10 . 1 1 64 64 THR HA H 190 3.790 3.790 3.949 -0.159 18090 3843 1 10 . 1 1 64 64 THR C C 190 177.640 177.640 176.612 1.028 18090 3844 1 10 . 1 1 64 64 THR CA C 190 66.690 66.690 66.196 0.494 18090 3845 1 10 . 1 1 64 64 THR CB C 190 68.310 68.310 68.498 -0.188 18090 3846 1 10 . 1 1 64 64 THR H H 190 7.740 7.740 7.699 0.041 18090 3847 1 10 . 1 1 65 65 LEU N N 191 122.410 122.410 122.018 0.392 18090 3848 1 10 . 1 1 65 65 LEU HA H 191 3.930 3.930 3.985 -0.055 18090 3849 1 10 . 1 1 65 65 LEU C C 191 178.470 178.470 179.611 -1.141 18090 3850 1 10 . 1 1 65 65 LEU CA C 191 57.120 57.120 58.078 -0.958 18090 3851 1 10 . 1 1 65 65 LEU CB C 191 41.830 41.830 41.779 0.051 18090 3852 1 10 . 1 1 65 65 LEU H H 191 8.180 8.180 7.558 0.622 18090 3853 1 10 . 1 1 66 66 MET N N 192 115.320 115.320 117.247 -1.927 18090 3854 1 10 . 1 1 66 66 MET HA H 192 4.090 4.090 4.305 -0.215 18090 3855 1 10 . 1 1 66 66 MET C C 192 176.090 176.090 178.312 -2.222 18090 3856 1 10 . 1 1 66 66 MET CA C 192 56.390 56.390 57.265 -0.875 18090 3857 1 10 . 1 1 66 66 MET CB C 192 33.770 33.770 31.786 1.984 18090 3858 1 10 . 1 1 66 66 MET H H 192 7.880 7.880 8.581 -0.701 18090 3859 1 10 . 1 1 67 67 GLY N N 193 107.490 107.490 105.440 2.050 18090 3860 1 10 . 1 1 67 67 GLY C C 193 174.390 174.390 174.681 -0.291 18090 3861 1 10 . 1 1 67 67 GLY CA C 193 45.880 45.880 44.884 0.996 18090 3862 1 10 . 1 1 67 67 GLY H H 193 7.580 7.580 8.211 -0.631 18090 3863 1 10 . 1 1 68 68 VAL N N 194 118.520 118.520 117.109 1.411 18090 3864 1 10 . 1 1 68 68 VAL HA H 194 3.940 3.940 3.649 0.291 18090 3865 1 10 . 1 1 68 68 VAL C C 194 174.760 174.760 175.432 -0.672 18090 3866 1 10 . 1 1 68 68 VAL CA C 194 61.510 61.510 63.236 -1.726 18090 3867 1 10 . 1 1 68 68 VAL CB C 194 32.670 32.670 30.191 2.479 18090 3868 1 10 . 1 1 68 68 VAL H H 194 7.840 7.840 7.456 0.384 18090 3869 1 10 . 1 1 69 69 ASP N N 195 124.550 124.550 117.726 6.824 18090 3870 1 10 . 1 1 69 69 ASP HA H 195 4.430 4.430 4.272 0.158 18090 3871 1 10 . 1 1 69 69 ASP C C 195 175.140 175.140 177.074 -1.934 18090 3872 1 10 . 1 1 69 69 ASP CA C 195 53.760 53.760 55.411 -1.651 18090 3873 1 10 . 1 1 69 69 ASP CB C 195 40.920 40.920 39.563 1.357 18090 3874 1 10 . 1 1 69 69 ASP H H 195 8.400 8.400 8.107 0.293 18090 3875 1 10 . 1 1 70 70 LEU N N 196 123.930 123.930 114.700 9.230 18090 3876 1 10 . 1 1 70 70 LEU HA H 196 4.200 4.200 3.721 0.479 18090 3877 1 10 . 1 1 70 70 LEU C C 196 175.950 175.950 177.172 -1.222 18090 3878 1 10 . 1 1 70 70 LEU CA C 196 54.380 54.380 58.078 -3.698 18090 3879 1 10 . 1 1 70 70 LEU CB C 196 41.610 41.610 40.356 1.254 18090 3880 1 10 . 1 1 70 70 LEU H H 196 8.160 8.160 8.435 -0.275 18090 3881 1 11 . 1 1 2 2 PRO HA H 128 4.220 4.220 4.363 -0.143 18090 3882 1 11 . 1 1 2 2 PRO CA C 128 63.320 63.320 63.673 -0.353 18090 3883 1 11 . 1 1 2 2 PRO CB C 128 31.680 31.680 31.898 -0.218 18090 3884 1 11 . 1 1 3 3 ASP N N 129 119.320 119.320 119.444 -0.124 18090 3885 1 11 . 1 1 3 3 ASP HA H 129 4.400 4.400 4.366 0.034 18090 3886 1 11 . 1 1 3 3 ASP C C 129 176.120 176.120 175.933 0.187 18090 3887 1 11 . 1 1 3 3 ASP CA C 129 54.050 54.050 54.493 -0.443 18090 3888 1 11 . 1 1 3 3 ASP CB C 129 40.770 40.770 40.905 -0.135 18090 3889 1 11 . 1 1 3 3 ASP H H 129 8.310 8.310 8.182 0.128 18090 3890 1 11 . 1 1 4 4 LEU N N 130 122.280 122.280 119.913 2.367 18090 3891 1 11 . 1 1 4 4 LEU HA H 130 4.130 4.130 3.996 0.134 18090 3892 1 11 . 1 1 4 4 LEU C C 130 177.280 177.280 177.265 0.015 18090 3893 1 11 . 1 1 4 4 LEU CA C 130 55.350 55.350 55.865 -0.515 18090 3894 1 11 . 1 1 4 4 LEU CB C 130 41.490 41.490 42.288 -0.798 18090 3895 1 11 . 1 1 4 4 LEU H H 130 8.080 8.080 8.242 -0.162 18090 3896 1 11 . 1 1 5 5 GLY N N 131 107.830 107.830 106.170 1.660 18090 3897 1 11 . 1 1 5 5 GLY C C 131 175.120 175.120 173.231 1.889 18090 3898 1 11 . 1 1 5 5 GLY CA C 131 45.300 45.300 45.393 -0.093 18090 3899 1 11 . 1 1 5 5 GLY H H 131 8.180 8.180 8.388 -0.208 18090 3900 1 11 . 1 1 6 6 LEU N N 132 121.080 121.080 116.080 5.000 18090 3901 1 11 . 1 1 6 6 LEU HA H 132 3.870 3.870 4.503 -0.633 18090 3902 1 11 . 1 1 6 6 LEU C C 132 178.000 178.000 177.745 0.255 18090 3903 1 11 . 1 1 6 6 LEU CA C 132 57.180 57.180 53.635 3.545 18090 3904 1 11 . 1 1 6 6 LEU CB C 132 41.870 41.870 44.404 -2.534 18090 3905 1 11 . 1 1 6 6 LEU H H 132 8.150 8.150 7.440 0.710 18090 3906 1 11 . 1 1 7 7 THR N N 133 111.580 111.580 113.519 -1.939 18090 3907 1 11 . 1 1 7 7 THR HA H 133 3.730 3.730 3.984 -0.254 18090 3908 1 11 . 1 1 7 7 THR C C 133 176.530 176.530 176.120 0.410 18090 3909 1 11 . 1 1 7 7 THR CA C 133 65.940 65.940 66.271 -0.331 18090 3910 1 11 . 1 1 7 7 THR CB C 133 68.130 68.130 68.830 -0.700 18090 3911 1 11 . 1 1 7 7 THR H H 133 7.970 7.970 8.707 -0.737 18090 3912 1 11 . 1 1 8 8 GLN N N 134 119.490 119.490 120.966 -1.476 18090 3913 1 11 . 1 1 8 8 GLN HA H 134 3.990 3.990 3.894 0.096 18090 3914 1 11 . 1 1 8 8 GLN C C 134 178.190 178.190 178.092 0.098 18090 3915 1 11 . 1 1 8 8 GLN CA C 134 57.930 57.930 58.655 -0.725 18090 3916 1 11 . 1 1 8 8 GLN CB C 134 27.850 27.850 28.094 -0.244 18090 3917 1 11 . 1 1 8 8 GLN H H 134 7.890 7.890 8.361 -0.471 18090 3918 1 11 . 1 1 9 9 LEU N N 135 120.170 120.170 118.122 2.048 18090 3919 1 11 . 1 1 9 9 LEU HA H 135 3.820 3.820 3.940 -0.120 18090 3920 1 11 . 1 1 9 9 LEU C C 135 177.810 177.810 178.410 -0.600 18090 3921 1 11 . 1 1 9 9 LEU CA C 135 57.470 57.470 57.166 0.304 18090 3922 1 11 . 1 1 9 9 LEU CB C 135 41.640 41.640 41.916 -0.276 18090 3923 1 11 . 1 1 9 9 LEU H H 135 7.600 7.600 7.252 0.348 18090 3924 1 11 . 1 1 10 10 PHE N N 136 111.950 111.950 113.175 -1.225 18090 3925 1 11 . 1 1 10 10 PHE HA H 136 4.380 4.380 4.380 0.000 18090 3926 1 11 . 1 1 10 10 PHE C C 136 174.990 174.990 177.180 -2.190 18090 3927 1 11 . 1 1 10 10 PHE CA C 136 58.450 58.450 57.397 1.053 18090 3928 1 11 . 1 1 10 10 PHE CB C 136 38.570 38.570 37.929 0.641 18090 3929 1 11 . 1 1 10 10 PHE H H 136 7.410 7.410 6.586 0.824 18090 3930 1 11 . 1 1 11 11 ALA N N 137 120.230 120.230 122.246 -2.016 18090 3931 1 11 . 1 1 11 11 ALA HA H 137 4.130 4.130 4.145 -0.015 18090 3932 1 11 . 1 1 11 11 ALA C C 137 177.090 177.090 178.262 -1.172 18090 3933 1 11 . 1 1 11 11 ALA CA C 137 52.580 52.580 53.519 -0.938 18090 3934 1 11 . 1 1 11 11 ALA CB C 137 18.660 18.660 18.727 -0.067 18090 3935 1 11 . 1 1 11 11 ALA H H 137 7.330 7.330 8.504 -1.174 18090 3936 1 11 . 1 1 12 12 ASP N N 138 119.830 119.830 120.549 -0.719 18090 3937 1 11 . 1 1 12 12 ASP HA H 138 4.510 4.510 4.666 -0.156 18090 3938 1 11 . 1 1 12 12 ASP C C 138 176.370 176.370 174.961 1.409 18090 3939 1 11 . 1 1 12 12 ASP CA C 138 51.960 51.960 53.090 -1.131 18090 3940 1 11 . 1 1 12 12 ASP CB C 138 41.990 41.990 41.519 0.471 18090 3941 1 11 . 1 1 12 12 ASP H H 138 6.980 6.980 7.651 -0.671 18090 3942 1 11 . 1 1 13 13 PRO HA H 139 4.260 4.260 4.421 -0.161 18090 3943 1 11 . 1 1 13 13 PRO CA C 139 64.350 64.350 63.084 1.266 18090 3944 1 11 . 1 1 13 13 PRO CB C 139 31.760 31.760 32.325 -0.565 18090 3945 1 11 . 1 1 14 14 ASN N N 140 116.840 116.840 118.204 -1.364 18090 3946 1 11 . 1 1 14 14 ASN HA H 140 4.840 4.840 4.473 0.367 18090 3947 1 11 . 1 1 14 14 ASN C C 140 173.840 173.840 175.686 -1.846 18090 3948 1 11 . 1 1 14 14 ASN CA C 140 52.380 52.380 54.037 -1.657 18090 3949 1 11 . 1 1 14 14 ASN CB C 140 38.330 38.330 36.848 1.482 18090 3950 1 11 . 1 1 14 14 ASN H H 140 8.670 8.670 8.711 -0.041 18090 3951 1 11 . 1 1 15 15 LEU N N 141 120.290 120.290 120.449 -0.159 18090 3952 1 11 . 1 1 15 15 LEU HA H 141 3.790 3.790 4.536 -0.746 18090 3953 1 11 . 1 1 15 15 LEU C C 141 177.120 177.120 177.520 -0.400 18090 3954 1 11 . 1 1 15 15 LEU CA C 141 59.280 59.280 55.592 3.688 18090 3955 1 11 . 1 1 15 15 LEU CB C 141 42.980 42.980 43.177 -0.197 18090 3956 1 11 . 1 1 15 15 LEU H H 141 7.200 7.200 8.424 -1.224 18090 3957 1 11 . 1 1 16 16 ILE N N 142 115.290 115.290 120.210 -4.920 18090 3958 1 11 . 1 1 16 16 ILE HA H 142 3.480 3.480 3.725 -0.245 18090 3959 1 11 . 1 1 16 16 ILE C C 142 177.990 177.990 177.494 0.496 18090 3960 1 11 . 1 1 16 16 ILE CA C 142 62.690 62.690 65.327 -2.637 18090 3961 1 11 . 1 1 16 16 ILE CB C 142 34.620 34.620 37.642 -3.022 18090 3962 1 11 . 1 1 16 16 ILE H H 142 7.940 7.940 8.285 -0.345 18090 3963 1 11 . 1 1 17 17 GLU N N 143 119.600 119.600 119.034 0.566 18090 3964 1 11 . 1 1 17 17 GLU HA H 143 3.700 3.700 3.992 -0.292 18090 3965 1 11 . 1 1 17 17 GLU C C 143 179.170 179.170 178.720 0.450 18090 3966 1 11 . 1 1 17 17 GLU CA C 143 59.360 59.360 60.097 -0.737 18090 3967 1 11 . 1 1 17 17 GLU CB C 143 28.520 28.520 29.215 -0.695 18090 3968 1 11 . 1 1 17 17 GLU H H 143 7.970 7.970 8.539 -0.569 18090 3969 1 11 . 1 1 18 18 ASN N N 144 117.170 117.170 117.832 -0.662 18090 3970 1 11 . 1 1 18 18 ASN HA H 144 4.270 4.270 4.447 -0.177 18090 3971 1 11 . 1 1 18 18 ASN C C 144 179.120 179.120 177.797 1.323 18090 3972 1 11 . 1 1 18 18 ASN CA C 144 55.490 55.490 55.641 -0.151 18090 3973 1 11 . 1 1 18 18 ASN CB C 144 36.550 36.550 37.790 -1.240 18090 3974 1 11 . 1 1 18 18 ASN H H 144 8.450 8.450 8.374 0.076 18090 3975 1 11 . 1 1 19 19 LEU N N 145 121.060 121.060 118.988 2.072 18090 3976 1 11 . 1 1 19 19 LEU HA H 145 4.020 4.020 4.027 -0.007 18090 3977 1 11 . 1 1 19 19 LEU C C 145 180.260 180.260 178.170 2.090 18090 3978 1 11 . 1 1 19 19 LEU CA C 145 56.620 56.620 57.043 -0.423 18090 3979 1 11 . 1 1 19 19 LEU CB C 145 41.780 41.780 41.524 0.256 18090 3980 1 11 . 1 1 19 19 LEU H H 145 7.990 7.990 7.536 0.454 18090 3981 1 11 . 1 1 20 20 LYS N N 146 118.960 118.960 117.639 1.321 18090 3982 1 11 . 1 1 20 20 LYS HA H 146 3.610 3.610 3.976 -0.366 18090 3983 1 11 . 1 1 20 20 LYS C C 146 177.390 177.390 178.260 -0.870 18090 3984 1 11 . 1 1 20 20 LYS CA C 146 59.640 59.640 59.281 0.359 18090 3985 1 11 . 1 1 20 20 LYS CB C 146 32.450 32.450 32.287 0.163 18090 3986 1 11 . 1 1 20 20 LYS H H 146 8.250 8.250 7.835 0.415 18090 3987 1 11 . 1 1 21 21 LYS N N 147 114.720 114.720 116.611 -1.891 18090 3988 1 11 . 1 1 21 21 LYS HA H 147 4.110 4.110 4.222 -0.112 18090 3989 1 11 . 1 1 21 21 LYS C C 147 175.880 175.880 178.300 -2.420 18090 3990 1 11 . 1 1 21 21 LYS CA C 147 56.210 56.210 58.285 -2.075 18090 3991 1 11 . 1 1 21 21 LYS CB C 147 33.000 33.000 32.685 0.315 18090 3992 1 11 . 1 1 21 21 LYS H H 147 7.130 7.130 7.671 -0.541 18090 3993 1 11 . 1 1 22 22 ASN N N 148 122.180 122.180 115.381 6.799 18090 3994 1 11 . 1 1 22 22 ASN HA H 148 4.740 4.740 4.915 -0.175 18090 3995 1 11 . 1 1 22 22 ASN C C 148 174.000 174.000 173.508 0.492 18090 3996 1 11 . 1 1 22 22 ASN CA C 148 50.970 50.970 52.715 -1.746 18090 3997 1 11 . 1 1 22 22 ASN CB C 148 38.670 38.670 38.968 -0.298 18090 3998 1 11 . 1 1 22 22 ASN H H 148 6.930 6.930 7.895 -0.965 18090 3999 1 11 . 1 1 23 23 PRO HA H 149 4.300 4.300 4.698 -0.398 18090 4000 1 11 . 1 1 23 23 PRO CA C 149 64.610 64.610 61.989 2.621 18090 4001 1 11 . 1 1 23 23 PRO CB C 149 32.000 32.000 34.171 -2.171 18090 4002 1 11 . 1 1 24 24 LYS N N 150 116.060 116.060 120.866 -4.806 18090 4003 1 11 . 1 1 24 24 LYS HA H 150 4.070 4.070 3.980 0.090 18090 4004 1 11 . 1 1 24 24 LYS C C 150 178.240 178.240 178.318 -0.078 18090 4005 1 11 . 1 1 24 24 LYS CA C 150 57.950 57.950 59.865 -1.915 18090 4006 1 11 . 1 1 24 24 LYS CB C 150 32.590 32.590 31.814 0.776 18090 4007 1 11 . 1 1 24 24 LYS H H 150 8.520 8.520 8.770 -0.250 18090 4008 1 11 . 1 1 25 25 THR N N 151 105.190 105.190 111.510 -6.320 18090 4009 1 11 . 1 1 25 25 THR HA H 151 4.390 4.390 4.078 0.312 18090 4010 1 11 . 1 1 25 25 THR C C 151 176.090 176.090 176.039 0.051 18090 4011 1 11 . 1 1 25 25 THR CA C 151 61.400 61.400 65.084 -3.683 18090 4012 1 11 . 1 1 25 25 THR CB C 151 69.440 69.440 67.590 1.850 18090 4013 1 11 . 1 1 25 25 THR H H 151 7.490 7.490 8.166 -0.676 18090 4014 1 11 . 1 1 26 26 SER N N 152 119.700 119.700 116.656 3.044 18090 4015 1 11 . 1 1 26 26 SER HA H 152 3.770 3.770 4.125 -0.355 18090 4016 1 11 . 1 1 26 26 SER C C 152 177.470 177.470 175.957 1.513 18090 4017 1 11 . 1 1 26 26 SER CA C 152 62.450 62.450 61.525 0.925 18090 4018 1 11 . 1 1 26 26 SER CB C 152 62.520 62.520 62.625 -0.105 18090 4019 1 11 . 1 1 26 26 SER H H 152 8.190 8.190 7.941 0.249 18090 4020 1 11 . 1 1 27 27 GLU N N 153 119.870 119.870 122.662 -2.792 18090 4021 1 11 . 1 1 27 27 GLU HA H 153 3.890 3.890 3.963 -0.073 18090 4022 1 11 . 1 1 27 27 GLU C C 153 180.040 180.040 178.724 1.316 18090 4023 1 11 . 1 1 27 27 GLU CA C 153 58.700 58.700 59.340 -0.640 18090 4024 1 11 . 1 1 27 27 GLU CB C 153 28.590 28.590 29.453 -0.863 18090 4025 1 11 . 1 1 27 27 GLU H H 153 8.350 8.350 7.889 0.461 18090 4026 1 11 . 1 1 28 28 MET N N 154 119.430 119.430 117.020 2.410 18090 4027 1 11 . 1 1 28 28 MET HA H 154 4.040 4.040 4.165 -0.125 18090 4028 1 11 . 1 1 28 28 MET C C 154 177.110 177.110 178.157 -1.047 18090 4029 1 11 . 1 1 28 28 MET CA C 154 58.510 58.510 58.656 -0.146 18090 4030 1 11 . 1 1 28 28 MET CB C 154 31.430 31.430 32.738 -1.308 18090 4031 1 11 . 1 1 28 28 MET H H 154 7.850 7.850 7.581 0.269 18090 4032 1 11 . 1 1 29 29 MET N N 155 112.640 112.640 114.265 -1.625 18090 4033 1 11 . 1 1 29 29 MET HA H 155 4.340 4.340 4.256 0.084 18090 4034 1 11 . 1 1 29 29 MET C C 155 175.530 175.530 177.821 -2.291 18090 4035 1 11 . 1 1 29 29 MET CA C 155 53.790 53.790 57.139 -3.349 18090 4036 1 11 . 1 1 29 29 MET CB C 155 30.380 30.380 32.044 -1.664 18090 4037 1 11 . 1 1 29 29 MET H H 155 7.200 7.200 7.363 -0.163 18090 4038 1 11 . 1 1 30 30 LYS N N 156 117.050 117.050 116.704 0.346 18090 4039 1 11 . 1 1 30 30 LYS HA H 156 3.960 3.960 4.262 -0.302 18090 4040 1 11 . 1 1 30 30 LYS C C 156 176.120 176.120 177.151 -1.031 18090 4041 1 11 . 1 1 30 30 LYS CA C 156 57.090 57.090 57.345 -0.255 18090 4042 1 11 . 1 1 30 30 LYS CB C 156 31.960 31.960 32.928 -0.968 18090 4043 1 11 . 1 1 30 30 LYS H H 156 7.130 7.130 7.631 -0.501 18090 4044 1 11 . 1 1 31 31 ASP N N 157 119.810 119.810 118.449 1.361 18090 4045 1 11 . 1 1 31 31 ASP HA H 157 4.860 4.860 4.982 -0.122 18090 4046 1 11 . 1 1 31 31 ASP C C 157 174.890 174.890 174.500 0.390 18090 4047 1 11 . 1 1 31 31 ASP CA C 157 50.520 50.520 54.214 -3.694 18090 4048 1 11 . 1 1 31 31 ASP CB C 157 41.010 41.010 40.512 0.498 18090 4049 1 11 . 1 1 31 31 ASP H H 157 7.340 7.340 7.743 -0.403 18090 4050 1 11 . 1 1 32 32 PRO HA H 158 4.130 4.130 4.474 -0.344 18090 4051 1 11 . 1 1 32 32 PRO CA C 158 64.270 64.270 62.924 1.346 18090 4052 1 11 . 1 1 32 32 PRO CB C 158 31.770 31.770 32.399 -0.629 18090 4053 1 11 . 1 1 33 33 GLN N N 159 117.760 117.760 120.259 -2.499 18090 4054 1 11 . 1 1 33 33 GLN HA H 159 4.000 4.000 4.039 -0.039 18090 4055 1 11 . 1 1 33 33 GLN C C 159 178.740 178.740 177.952 0.788 18090 4056 1 11 . 1 1 33 33 GLN CA C 159 58.220 58.220 58.057 0.163 18090 4057 1 11 . 1 1 33 33 GLN CB C 159 27.870 27.870 28.079 -0.209 18090 4058 1 11 . 1 1 33 33 GLN H H 159 8.150 8.150 8.770 -0.620 18090 4059 1 11 . 1 1 34 34 LEU N N 160 123.300 123.300 120.002 3.298 18090 4060 1 11 . 1 1 34 34 LEU HA H 160 3.970 3.970 4.013 -0.043 18090 4061 1 11 . 1 1 34 34 LEU C C 160 177.980 177.980 178.170 -0.190 18090 4062 1 11 . 1 1 34 34 LEU CA C 160 57.050 57.050 57.454 -0.404 18090 4063 1 11 . 1 1 34 34 LEU CB C 160 40.760 40.760 41.593 -0.833 18090 4064 1 11 . 1 1 34 34 LEU H H 160 7.110 7.110 7.971 -0.861 18090 4065 1 11 . 1 1 35 35 VAL N N 161 118.390 118.390 119.749 -1.359 18090 4066 1 11 . 1 1 35 35 VAL HA H 161 3.110 3.110 3.562 -0.452 18090 4067 1 11 . 1 1 35 35 VAL C C 161 176.840 176.840 177.760 -0.920 18090 4068 1 11 . 1 1 35 35 VAL CA C 161 67.700 67.700 66.638 1.062 18090 4069 1 11 . 1 1 35 35 VAL CB C 161 31.260 31.260 30.744 0.516 18090 4070 1 11 . 1 1 35 35 VAL H H 161 7.430 7.430 7.413 0.017 18090 4071 1 11 . 1 1 36 36 ALA N N 162 117.600 117.600 121.275 -3.675 18090 4072 1 11 . 1 1 36 36 ALA HA H 162 3.810 3.810 3.950 -0.140 18090 4073 1 11 . 1 1 36 36 ALA C C 162 180.620 180.620 179.729 0.891 18090 4074 1 11 . 1 1 36 36 ALA CA C 162 54.720 54.720 55.358 -0.638 18090 4075 1 11 . 1 1 36 36 ALA CB C 162 17.490 17.490 18.119 -0.629 18090 4076 1 11 . 1 1 36 36 ALA H H 162 7.500 7.500 7.771 -0.271 18090 4077 1 11 . 1 1 37 37 LYS N N 163 119.880 119.880 118.522 1.358 18090 4078 1 11 . 1 1 37 37 LYS HA H 163 3.570 3.570 3.985 -0.415 18090 4079 1 11 . 1 1 37 37 LYS C C 163 177.800 177.800 179.125 -1.325 18090 4080 1 11 . 1 1 37 37 LYS CA C 163 58.880 58.880 58.935 -0.055 18090 4081 1 11 . 1 1 37 37 LYS CB C 163 31.610 31.610 32.037 -0.427 18090 4082 1 11 . 1 1 37 37 LYS H H 163 7.350 7.350 7.410 -0.060 18090 4083 1 11 . 1 1 38 38 LEU N N 164 118.020 118.020 120.006 -1.986 18090 4084 1 11 . 1 1 38 38 LEU HA H 164 3.670 3.670 4.063 -0.393 18090 4085 1 11 . 1 1 38 38 LEU C C 164 179.380 179.380 179.212 0.168 18090 4086 1 11 . 1 1 38 38 LEU CA C 164 57.340 57.340 57.774 -0.434 18090 4087 1 11 . 1 1 38 38 LEU CB C 164 41.660 41.660 41.703 -0.043 18090 4088 1 11 . 1 1 38 38 LEU H H 164 7.660 7.660 8.166 -0.506 18090 4089 1 11 . 1 1 39 39 ILE N N 165 118.070 118.070 118.245 -0.175 18090 4090 1 11 . 1 1 39 39 ILE HA H 165 3.510 3.510 3.644 -0.134 18090 4091 1 11 . 1 1 39 39 ILE C C 165 179.570 179.570 178.230 1.340 18090 4092 1 11 . 1 1 39 39 ILE CA C 165 64.450 64.450 65.508 -1.058 18090 4093 1 11 . 1 1 39 39 ILE CB C 165 37.310 37.310 37.463 -0.153 18090 4094 1 11 . 1 1 39 39 ILE H H 165 8.030 8.030 7.985 0.045 18090 4095 1 11 . 1 1 40 40 GLY N N 166 107.970 107.970 107.971 -0.001 18090 4096 1 11 . 1 1 40 40 GLY C C 166 176.470 176.470 175.705 0.765 18090 4097 1 11 . 1 1 40 40 GLY CA C 166 46.410 46.410 46.957 -0.547 18090 4098 1 11 . 1 1 40 40 GLY H H 166 7.590 7.590 7.622 -0.032 18090 4099 1 11 . 1 1 41 41 TYR N N 167 121.270 121.270 122.348 -1.078 18090 4100 1 11 . 1 1 41 41 TYR HA H 167 4.190 4.190 4.210 -0.020 18090 4101 1 11 . 1 1 41 41 TYR C C 167 176.470 176.470 176.212 0.258 18090 4102 1 11 . 1 1 41 41 TYR CA C 167 57.130 57.130 60.408 -3.279 18090 4103 1 11 . 1 1 41 41 TYR CB C 167 35.950 35.950 38.223 -2.273 18090 4104 1 11 . 1 1 41 41 TYR H H 167 7.350 7.350 7.881 -0.531 18090 4105 1 11 . 1 1 42 42 LYS N N 168 116.520 116.520 116.050 0.470 18090 4106 1 11 . 1 1 42 42 LYS HA H 168 3.820 3.820 4.059 -0.238 18090 4107 1 11 . 1 1 42 42 LYS C C 168 177.810 177.810 177.917 -0.107 18090 4108 1 11 . 1 1 42 42 LYS CA C 168 59.390 59.390 58.366 1.024 18090 4109 1 11 . 1 1 42 42 LYS CB C 168 31.580 31.580 32.766 -1.186 18090 4110 1 11 . 1 1 42 42 LYS H H 168 7.460 7.460 8.270 -0.810 18090 4111 1 11 . 1 1 43 43 GLN N N 169 113.750 113.750 116.189 -2.439 18090 4112 1 11 . 1 1 43 43 GLN HA H 169 4.220 4.220 4.162 0.058 18090 4113 1 11 . 1 1 43 43 GLN C C 169 175.840 175.840 177.346 -1.506 18090 4114 1 11 . 1 1 43 43 GLN CA C 169 56.230 56.230 58.184 -1.954 18090 4115 1 11 . 1 1 43 43 GLN CB C 169 29.290 29.290 29.380 -0.090 18090 4116 1 11 . 1 1 43 43 GLN H H 169 7.220 7.220 7.617 -0.397 18090 4117 1 11 . 1 1 44 44 ASN N N 170 114.130 114.130 116.021 -1.891 18090 4118 1 11 . 1 1 44 44 ASN HA H 170 5.050 5.050 4.940 0.110 18090 4119 1 11 . 1 1 44 44 ASN C C 170 172.200 172.200 173.568 -1.368 18090 4120 1 11 . 1 1 44 44 ASN CA C 170 50.780 50.780 53.947 -3.167 18090 4121 1 11 . 1 1 44 44 ASN CB C 170 38.380 38.380 39.736 -1.355 18090 4122 1 11 . 1 1 44 44 ASN H H 170 7.580 7.580 7.635 -0.055 18090 4123 1 11 . 1 1 45 45 PRO HA H 171 4.130 4.130 4.650 -0.520 18090 4124 1 11 . 1 1 45 45 PRO CA C 171 64.800 64.800 62.088 2.712 18090 4125 1 11 . 1 1 45 45 PRO CB C 171 31.360 31.360 31.926 -0.566 18090 4126 1 11 . 1 1 46 46 GLN N N 172 115.570 115.570 124.351 -8.781 18090 4127 1 11 . 1 1 46 46 GLN HA H 172 3.770 3.770 3.769 0.001 18090 4128 1 11 . 1 1 46 46 GLN C C 172 177.360 177.360 177.718 -0.358 18090 4129 1 11 . 1 1 46 46 GLN CA C 172 57.950 57.950 58.127 -0.177 18090 4130 1 11 . 1 1 46 46 GLN CB C 172 27.050 27.050 27.821 -0.771 18090 4131 1 11 . 1 1 46 46 GLN H H 172 8.160 8.160 8.562 -0.402 18090 4132 1 11 . 1 1 47 47 ALA N N 173 121.420 121.420 121.856 -0.436 18090 4133 1 11 . 1 1 47 47 ALA HA H 173 4.050 4.050 4.162 -0.112 18090 4134 1 11 . 1 1 47 47 ALA C C 173 178.090 178.090 179.533 -1.443 18090 4135 1 11 . 1 1 47 47 ALA CA C 173 53.490 53.490 53.950 -0.460 18090 4136 1 11 . 1 1 47 47 ALA CB C 173 18.450 18.450 17.654 0.796 18090 4137 1 11 . 1 1 47 47 ALA H H 173 7.470 7.470 8.113 -0.643 18090 4138 1 11 . 1 1 48 48 ILE N N 174 118.050 118.050 118.697 -0.647 18090 4139 1 11 . 1 1 48 48 ILE HA H 174 3.180 3.180 3.876 -0.696 18090 4140 1 11 . 1 1 48 48 ILE C C 174 176.250 176.250 177.882 -1.632 18090 4141 1 11 . 1 1 48 48 ILE CA C 174 64.030 64.030 64.062 -0.032 18090 4142 1 11 . 1 1 48 48 ILE CB C 174 37.280 37.280 37.102 0.178 18090 4143 1 11 . 1 1 48 48 ILE H H 174 7.150 7.150 7.336 -0.186 18090 4144 1 11 . 1 1 49 49 GLY N N 175 105.390 105.390 106.615 -1.225 18090 4145 1 11 . 1 1 49 49 GLY C C 175 174.220 174.220 175.985 -1.765 18090 4146 1 11 . 1 1 49 49 GLY CA C 175 46.700 46.700 47.050 -0.350 18090 4147 1 11 . 1 1 49 49 GLY H H 175 7.550 7.550 7.785 -0.235 18090 4148 1 11 . 1 1 50 50 GLN N N 176 116.230 116.230 118.619 -2.389 18090 4149 1 11 . 1 1 50 50 GLN HA H 176 4.210 4.210 4.491 -0.281 18090 4150 1 11 . 1 1 50 50 GLN C C 176 178.120 178.120 178.288 -0.168 18090 4151 1 11 . 1 1 50 50 GLN CA C 176 57.320 57.320 57.954 -0.634 18090 4152 1 11 . 1 1 50 50 GLN CB C 176 28.630 28.630 29.175 -0.545 18090 4153 1 11 . 1 1 50 50 GLN H H 176 7.390 7.390 7.978 -0.588 18090 4154 1 11 . 1 1 51 51 ASP N N 177 120.000 120.000 120.996 -0.996 18090 4155 1 11 . 1 1 51 51 ASP HA H 177 4.420 4.420 4.633 -0.213 18090 4156 1 11 . 1 1 51 51 ASP C C 177 177.950 177.950 178.306 -0.356 18090 4157 1 11 . 1 1 51 51 ASP CA C 177 55.840 55.840 55.981 -0.141 18090 4158 1 11 . 1 1 51 51 ASP CB C 177 40.310 40.310 40.847 -0.537 18090 4159 1 11 . 1 1 51 51 ASP H H 177 7.870 7.870 7.876 -0.006 18090 4160 1 11 . 1 1 52 52 LEU N N 178 120.010 120.010 120.538 -0.528 18090 4161 1 11 . 1 1 52 52 LEU HA H 178 3.650 3.650 4.031 -0.381 18090 4162 1 11 . 1 1 52 52 LEU C C 178 175.810 175.810 178.811 -3.001 18090 4163 1 11 . 1 1 52 52 LEU CA C 178 57.620 57.620 57.757 -0.137 18090 4164 1 11 . 1 1 52 52 LEU CB C 178 41.880 41.880 41.835 0.045 18090 4165 1 11 . 1 1 52 52 LEU H H 178 7.860 7.860 7.604 0.256 18090 4166 1 11 . 1 1 53 53 PHE N N 179 110.580 110.580 114.293 -3.713 18090 4167 1 11 . 1 1 53 53 PHE HA H 179 4.230 4.230 4.324 -0.094 18090 4168 1 11 . 1 1 53 53 PHE C C 179 176.370 176.370 177.763 -1.393 18090 4169 1 11 . 1 1 53 53 PHE CA C 179 58.730 58.730 60.475 -1.745 18090 4170 1 11 . 1 1 53 53 PHE CB C 179 38.720 38.720 38.976 -0.256 18090 4171 1 11 . 1 1 53 53 PHE H H 179 7.210 7.210 8.135 -0.925 18090 4172 1 11 . 1 1 54 54 THR N N 180 108.190 108.190 109.153 -0.963 18090 4173 1 11 . 1 1 54 54 THR HA H 180 4.300 4.300 4.280 0.020 18090 4174 1 11 . 1 1 54 54 THR C C 180 174.400 174.400 175.285 -0.885 18090 4175 1 11 . 1 1 54 54 THR CA C 180 62.020 62.020 62.186 -0.166 18090 4176 1 11 . 1 1 54 54 THR CB C 180 69.730 69.730 69.927 -0.197 18090 4177 1 11 . 1 1 54 54 THR H H 180 7.550 7.550 7.462 0.088 18090 4178 1 11 . 1 1 55 55 ASP N N 181 120.060 120.060 122.937 -2.877 18090 4179 1 11 . 1 1 55 55 ASP HA H 181 5.020 5.020 5.097 -0.077 18090 4180 1 11 . 1 1 55 55 ASP C C 181 174.120 174.120 175.286 -1.166 18090 4181 1 11 . 1 1 55 55 ASP CA C 181 50.560 50.560 50.743 -0.183 18090 4182 1 11 . 1 1 55 55 ASP CB C 181 41.190 41.190 42.984 -1.794 18090 4183 1 11 . 1 1 55 55 ASP H H 181 7.480 7.480 8.027 -0.547 18090 4184 1 11 . 1 1 56 56 PRO HA H 182 4.320 4.320 4.313 0.007 18090 4185 1 11 . 1 1 56 56 PRO CA C 182 64.280 64.280 64.921 -0.642 18090 4186 1 11 . 1 1 56 56 PRO CB C 182 31.980 31.980 32.588 -0.608 18090 4187 1 11 . 1 1 57 57 ARG N N 183 117.660 117.660 118.336 -0.676 18090 4188 1 11 . 1 1 57 57 ARG HA H 183 3.960 3.960 4.105 -0.145 18090 4189 1 11 . 1 1 57 57 ARG C C 183 179.030 179.030 178.676 0.354 18090 4190 1 11 . 1 1 57 57 ARG CA C 183 59.000 59.000 58.773 0.227 18090 4191 1 11 . 1 1 57 57 ARG CB C 183 29.750 29.750 29.342 0.408 18090 4192 1 11 . 1 1 57 57 ARG H H 183 7.920 7.920 8.112 -0.192 18090 4193 1 11 . 1 1 58 58 LEU N N 184 115.670 115.670 119.510 -3.840 18090 4194 1 11 . 1 1 58 58 LEU HA H 184 3.850 3.850 3.962 -0.112 18090 4195 1 11 . 1 1 58 58 LEU C C 184 178.770 178.770 179.106 -0.336 18090 4196 1 11 . 1 1 58 58 LEU CA C 184 57.110 57.110 57.736 -0.626 18090 4197 1 11 . 1 1 58 58 LEU CB C 184 41.310 41.310 41.596 -0.286 18090 4198 1 11 . 1 1 58 58 LEU H H 184 7.750 7.750 8.182 -0.432 18090 4199 1 11 . 1 1 59 59 MET N N 185 118.570 118.570 116.408 2.162 18090 4200 1 11 . 1 1 59 59 MET HA H 185 4.060 4.060 4.077 -0.017 18090 4201 1 11 . 1 1 59 59 MET C C 185 177.540 177.540 178.143 -0.603 18090 4202 1 11 . 1 1 59 59 MET CA C 185 58.090 58.090 59.585 -1.495 18090 4203 1 11 . 1 1 59 59 MET CB C 185 31.270 31.270 32.171 -0.901 18090 4204 1 11 . 1 1 59 59 MET H H 185 7.590 7.590 7.777 -0.187 18090 4205 1 11 . 1 1 60 60 THR N N 186 116.390 116.390 117.463 -1.073 18090 4206 1 11 . 1 1 60 60 THR HA H 186 3.680 3.680 3.995 -0.315 18090 4207 1 11 . 1 1 60 60 THR C C 186 177.440 177.440 176.392 1.048 18090 4208 1 11 . 1 1 60 60 THR CA C 186 66.940 66.940 67.266 -0.326 18090 4209 1 11 . 1 1 60 60 THR CB C 186 68.030 68.030 68.233 -0.203 18090 4210 1 11 . 1 1 60 60 THR H H 186 7.180 7.180 7.777 -0.597 18090 4211 1 11 . 1 1 61 61 ILE N N 187 123.840 123.840 122.108 1.732 18090 4212 1 11 . 1 1 61 61 ILE HA H 187 3.290 3.290 3.754 -0.464 18090 4213 1 11 . 1 1 61 61 ILE C C 187 176.660 176.660 178.044 -1.384 18090 4214 1 11 . 1 1 61 61 ILE CA C 187 65.850 65.850 65.521 0.329 18090 4215 1 11 . 1 1 61 61 ILE CB C 187 37.640 37.640 37.877 -0.237 18090 4216 1 11 . 1 1 61 61 ILE H H 187 8.010 8.010 7.837 0.173 18090 4217 1 11 . 1 1 62 62 MET N N 188 118.210 118.210 118.283 -0.073 18090 4218 1 11 . 1 1 62 62 MET HA H 188 3.910 3.910 4.006 -0.096 18090 4219 1 11 . 1 1 62 62 MET C C 188 177.540 177.540 178.437 -0.897 18090 4220 1 11 . 1 1 62 62 MET CA C 188 58.530 58.530 58.898 -0.368 18090 4221 1 11 . 1 1 62 62 MET CB C 188 31.200 31.200 31.540 -0.340 18090 4222 1 11 . 1 1 62 62 MET H H 188 8.560 8.560 7.425 1.135 18090 4223 1 11 . 1 1 63 63 ALA N N 189 119.850 119.850 121.982 -2.132 18090 4224 1 11 . 1 1 63 63 ALA HA H 189 3.730 3.730 3.910 -0.180 18090 4225 1 11 . 1 1 63 63 ALA C C 189 179.550 179.550 179.316 0.234 18090 4226 1 11 . 1 1 63 63 ALA CA C 189 55.470 55.470 55.524 -0.054 18090 4227 1 11 . 1 1 63 63 ALA CB C 189 17.640 17.640 18.102 -0.462 18090 4228 1 11 . 1 1 63 63 ALA H H 189 8.210 8.210 8.207 0.003 18090 4229 1 11 . 1 1 64 64 THR N N 190 114.570 114.570 113.335 1.235 18090 4230 1 11 . 1 1 64 64 THR HA H 190 3.790 3.790 3.903 -0.113 18090 4231 1 11 . 1 1 64 64 THR C C 190 177.640 177.640 176.942 0.698 18090 4232 1 11 . 1 1 64 64 THR CA C 190 66.690 66.690 65.365 1.325 18090 4233 1 11 . 1 1 64 64 THR CB C 190 68.310 68.310 68.733 -0.423 18090 4234 1 11 . 1 1 64 64 THR H H 190 7.740 7.740 7.583 0.157 18090 4235 1 11 . 1 1 65 65 LEU N N 191 122.410 122.410 122.568 -0.158 18090 4236 1 11 . 1 1 65 65 LEU HA H 191 3.930 3.930 3.928 0.002 18090 4237 1 11 . 1 1 65 65 LEU C C 191 178.470 178.470 179.494 -1.024 18090 4238 1 11 . 1 1 65 65 LEU CA C 191 57.120 57.120 58.124 -1.004 18090 4239 1 11 . 1 1 65 65 LEU CB C 191 41.830 41.830 41.746 0.084 18090 4240 1 11 . 1 1 65 65 LEU H H 191 8.180 8.180 7.634 0.546 18090 4241 1 11 . 1 1 66 66 MET N N 192 115.320 115.320 117.128 -1.808 18090 4242 1 11 . 1 1 66 66 MET HA H 192 4.090 4.090 4.307 -0.217 18090 4243 1 11 . 1 1 66 66 MET C C 192 176.090 176.090 178.260 -2.170 18090 4244 1 11 . 1 1 66 66 MET CA C 192 56.390 56.390 57.378 -0.988 18090 4245 1 11 . 1 1 66 66 MET CB C 192 33.770 33.770 31.886 1.884 18090 4246 1 11 . 1 1 66 66 MET H H 192 7.880 7.880 8.465 -0.585 18090 4247 1 11 . 1 1 67 67 GLY N N 193 107.490 107.490 105.171 2.319 18090 4248 1 11 . 1 1 67 67 GLY C C 193 174.390 174.390 174.890 -0.500 18090 4249 1 11 . 1 1 67 67 GLY CA C 193 45.880 45.880 45.098 0.782 18090 4250 1 11 . 1 1 67 67 GLY H H 193 7.580 7.580 8.141 -0.561 18090 4251 1 11 . 1 1 68 68 VAL N N 194 118.520 118.520 116.613 1.907 18090 4252 1 11 . 1 1 68 68 VAL HA H 194 3.940 3.940 3.645 0.295 18090 4253 1 11 . 1 1 68 68 VAL C C 194 174.760 174.760 175.888 -1.128 18090 4254 1 11 . 1 1 68 68 VAL CA C 194 61.510 61.510 63.878 -2.368 18090 4255 1 11 . 1 1 68 68 VAL CB C 194 32.670 32.670 29.572 3.098 18090 4256 1 11 . 1 1 68 68 VAL H H 194 7.840 7.840 7.499 0.341 18090 4257 1 11 . 1 1 69 69 ASP N N 195 124.550 124.550 119.188 5.362 18090 4258 1 11 . 1 1 69 69 ASP HA H 195 4.430 4.430 4.619 -0.189 18090 4259 1 11 . 1 1 69 69 ASP C C 195 175.140 175.140 175.753 -0.613 18090 4260 1 11 . 1 1 69 69 ASP CA C 195 53.760 53.760 55.561 -1.801 18090 4261 1 11 . 1 1 69 69 ASP CB C 195 40.920 40.920 41.030 -0.110 18090 4262 1 11 . 1 1 69 69 ASP H H 195 8.400 8.400 7.975 0.425 18090 4263 1 11 . 1 1 70 70 LEU N N 196 123.930 123.930 119.276 4.654 18090 4264 1 11 . 1 1 70 70 LEU HA H 196 4.200 4.200 4.501 -0.301 18090 4265 1 11 . 1 1 70 70 LEU C C 196 175.950 175.950 175.216 0.734 18090 4266 1 11 . 1 1 70 70 LEU CA C 196 54.380 54.380 53.730 0.650 18090 4267 1 11 . 1 1 70 70 LEU CB C 196 41.610 41.610 44.497 -2.887 18090 4268 1 11 . 1 1 70 70 LEU H H 196 8.160 8.160 7.458 0.702 18090 4269 1 12 . 1 1 2 2 PRO HA H 128 4.220 4.220 4.567 -0.347 18090 4270 1 12 . 1 1 2 2 PRO CA C 128 63.320 63.320 63.362 -0.042 18090 4271 1 12 . 1 1 2 2 PRO CB C 128 31.680 31.680 32.327 -0.647 18090 4272 1 12 . 1 1 3 3 ASP N N 129 119.320 119.320 119.588 -0.268 18090 4273 1 12 . 1 1 3 3 ASP HA H 129 4.400 4.400 4.806 -0.406 18090 4274 1 12 . 1 1 3 3 ASP C C 129 176.120 176.120 174.463 1.657 18090 4275 1 12 . 1 1 3 3 ASP CA C 129 54.050 54.050 53.901 0.149 18090 4276 1 12 . 1 1 3 3 ASP CB C 129 40.770 40.770 41.018 -0.248 18090 4277 1 12 . 1 1 3 3 ASP H H 129 8.310 8.310 8.521 -0.211 18090 4278 1 12 . 1 1 4 4 LEU N N 130 122.280 122.280 118.285 3.995 18090 4279 1 12 . 1 1 4 4 LEU HA H 130 4.130 4.130 4.557 -0.427 18090 4280 1 12 . 1 1 4 4 LEU C C 130 177.280 177.280 176.048 1.232 18090 4281 1 12 . 1 1 4 4 LEU CA C 130 55.350 55.350 54.200 1.150 18090 4282 1 12 . 1 1 4 4 LEU CB C 130 41.490 41.490 45.169 -3.679 18090 4283 1 12 . 1 1 4 4 LEU H H 130 8.080 8.080 7.574 0.506 18090 4284 1 12 . 1 1 5 5 GLY N N 131 107.830 107.830 107.931 -0.101 18090 4285 1 12 . 1 1 5 5 GLY C C 131 175.120 175.120 173.161 1.959 18090 4286 1 12 . 1 1 5 5 GLY CA C 131 45.300 45.300 45.490 -0.190 18090 4287 1 12 . 1 1 5 5 GLY H H 131 8.180 8.180 8.347 -0.167 18090 4288 1 12 . 1 1 6 6 LEU N N 132 121.080 121.080 116.124 4.956 18090 4289 1 12 . 1 1 6 6 LEU HA H 132 3.870 3.870 4.464 -0.594 18090 4290 1 12 . 1 1 6 6 LEU C C 132 178.000 178.000 177.651 0.349 18090 4291 1 12 . 1 1 6 6 LEU CA C 132 57.180 57.180 53.686 3.494 18090 4292 1 12 . 1 1 6 6 LEU CB C 132 41.870 41.870 44.415 -2.545 18090 4293 1 12 . 1 1 6 6 LEU H H 132 8.150 8.150 7.425 0.725 18090 4294 1 12 . 1 1 7 7 THR N N 133 111.580 111.580 113.655 -2.075 18090 4295 1 12 . 1 1 7 7 THR HA H 133 3.730 3.730 4.019 -0.289 18090 4296 1 12 . 1 1 7 7 THR C C 133 176.530 176.530 176.063 0.467 18090 4297 1 12 . 1 1 7 7 THR CA C 133 65.940 65.940 66.364 -0.424 18090 4298 1 12 . 1 1 7 7 THR CB C 133 68.130 68.130 68.710 -0.580 18090 4299 1 12 . 1 1 7 7 THR H H 133 7.970 7.970 8.723 -0.753 18090 4300 1 12 . 1 1 8 8 GLN N N 134 119.490 119.490 121.113 -1.623 18090 4301 1 12 . 1 1 8 8 GLN HA H 134 3.990 3.990 3.885 0.105 18090 4302 1 12 . 1 1 8 8 GLN C C 134 178.190 178.190 178.086 0.104 18090 4303 1 12 . 1 1 8 8 GLN CA C 134 57.930 57.930 58.721 -0.791 18090 4304 1 12 . 1 1 8 8 GLN CB C 134 27.850 27.850 28.023 -0.173 18090 4305 1 12 . 1 1 8 8 GLN H H 134 7.890 7.890 8.357 -0.467 18090 4306 1 12 . 1 1 9 9 LEU N N 135 120.170 120.170 119.275 0.895 18090 4307 1 12 . 1 1 9 9 LEU HA H 135 3.820 3.820 3.923 -0.103 18090 4308 1 12 . 1 1 9 9 LEU C C 135 177.810 177.810 178.844 -1.034 18090 4309 1 12 . 1 1 9 9 LEU CA C 135 57.470 57.470 57.364 0.106 18090 4310 1 12 . 1 1 9 9 LEU CB C 135 41.640 41.640 41.678 -0.038 18090 4311 1 12 . 1 1 9 9 LEU H H 135 7.600 7.600 7.311 0.289 18090 4312 1 12 . 1 1 10 10 PHE N N 136 111.950 111.950 113.870 -1.920 18090 4313 1 12 . 1 1 10 10 PHE HA H 136 4.380 4.380 4.458 -0.078 18090 4314 1 12 . 1 1 10 10 PHE C C 136 174.990 174.990 177.434 -2.444 18090 4315 1 12 . 1 1 10 10 PHE CA C 136 58.450 58.450 57.706 0.744 18090 4316 1 12 . 1 1 10 10 PHE CB C 136 38.570 38.570 37.308 1.262 18090 4317 1 12 . 1 1 10 10 PHE H H 136 7.410 7.410 6.723 0.687 18090 4318 1 12 . 1 1 11 11 ALA N N 137 120.230 120.230 122.030 -1.800 18090 4319 1 12 . 1 1 11 11 ALA HA H 137 4.130 4.130 4.151 -0.021 18090 4320 1 12 . 1 1 11 11 ALA C C 137 177.090 177.090 178.245 -1.155 18090 4321 1 12 . 1 1 11 11 ALA CA C 137 52.580 52.580 53.519 -0.939 18090 4322 1 12 . 1 1 11 11 ALA CB C 137 18.660 18.660 18.755 -0.095 18090 4323 1 12 . 1 1 11 11 ALA H H 137 7.330 7.330 8.567 -1.237 18090 4324 1 12 . 1 1 12 12 ASP N N 138 119.830 119.830 120.813 -0.983 18090 4325 1 12 . 1 1 12 12 ASP HA H 138 4.510 4.510 4.717 -0.207 18090 4326 1 12 . 1 1 12 12 ASP C C 138 176.370 176.370 174.824 1.546 18090 4327 1 12 . 1 1 12 12 ASP CA C 138 51.960 51.960 52.916 -0.956 18090 4328 1 12 . 1 1 12 12 ASP CB C 138 41.990 41.990 41.569 0.421 18090 4329 1 12 . 1 1 12 12 ASP H H 138 6.980 6.980 7.616 -0.636 18090 4330 1 12 . 1 1 13 13 PRO HA H 139 4.260 4.260 4.423 -0.163 18090 4331 1 12 . 1 1 13 13 PRO CA C 139 64.350 64.350 63.198 1.152 18090 4332 1 12 . 1 1 13 13 PRO CB C 139 31.760 31.760 32.282 -0.523 18090 4333 1 12 . 1 1 14 14 ASN N N 140 116.840 116.840 118.167 -1.327 18090 4334 1 12 . 1 1 14 14 ASN HA H 140 4.840 4.840 4.472 0.368 18090 4335 1 12 . 1 1 14 14 ASN C C 140 173.840 173.840 175.665 -1.825 18090 4336 1 12 . 1 1 14 14 ASN CA C 140 52.380 52.380 54.042 -1.662 18090 4337 1 12 . 1 1 14 14 ASN CB C 140 38.330 38.330 36.835 1.495 18090 4338 1 12 . 1 1 14 14 ASN H H 140 8.670 8.670 8.718 -0.048 18090 4339 1 12 . 1 1 15 15 LEU N N 141 120.290 120.290 120.385 -0.095 18090 4340 1 12 . 1 1 15 15 LEU HA H 141 3.790 3.790 4.534 -0.744 18090 4341 1 12 . 1 1 15 15 LEU C C 141 177.120 177.120 177.512 -0.392 18090 4342 1 12 . 1 1 15 15 LEU CA C 141 59.280 59.280 55.570 3.710 18090 4343 1 12 . 1 1 15 15 LEU CB C 141 42.980 42.980 43.163 -0.183 18090 4344 1 12 . 1 1 15 15 LEU H H 141 7.200 7.200 8.412 -1.212 18090 4345 1 12 . 1 1 16 16 ILE N N 142 115.290 115.290 120.256 -4.966 18090 4346 1 12 . 1 1 16 16 ILE HA H 142 3.480 3.480 3.723 -0.243 18090 4347 1 12 . 1 1 16 16 ILE C C 142 177.990 177.990 177.502 0.488 18090 4348 1 12 . 1 1 16 16 ILE CA C 142 62.690 62.690 65.367 -2.677 18090 4349 1 12 . 1 1 16 16 ILE CB C 142 34.620 34.620 37.642 -3.022 18090 4350 1 12 . 1 1 16 16 ILE H H 142 7.940 7.940 8.297 -0.357 18090 4351 1 12 . 1 1 17 17 GLU N N 143 119.600 119.600 119.023 0.577 18090 4352 1 12 . 1 1 17 17 GLU HA H 143 3.700 3.700 3.992 -0.292 18090 4353 1 12 . 1 1 17 17 GLU C C 143 179.170 179.170 178.729 0.441 18090 4354 1 12 . 1 1 17 17 GLU CA C 143 59.360 59.360 60.093 -0.733 18090 4355 1 12 . 1 1 17 17 GLU CB C 143 28.520 28.520 29.214 -0.694 18090 4356 1 12 . 1 1 17 17 GLU H H 143 7.970 7.970 8.547 -0.577 18090 4357 1 12 . 1 1 18 18 ASN N N 144 117.170 117.170 117.823 -0.653 18090 4358 1 12 . 1 1 18 18 ASN HA H 144 4.270 4.270 4.446 -0.176 18090 4359 1 12 . 1 1 18 18 ASN C C 144 179.120 179.120 177.791 1.329 18090 4360 1 12 . 1 1 18 18 ASN CA C 144 55.490 55.490 55.645 -0.155 18090 4361 1 12 . 1 1 18 18 ASN CB C 144 36.550 36.550 37.800 -1.250 18090 4362 1 12 . 1 1 18 18 ASN H H 144 8.450 8.450 8.375 0.075 18090 4363 1 12 . 1 1 19 19 LEU N N 145 121.060 121.060 118.989 2.071 18090 4364 1 12 . 1 1 19 19 LEU HA H 145 4.020 4.020 4.027 -0.007 18090 4365 1 12 . 1 1 19 19 LEU C C 145 180.260 180.260 178.176 2.084 18090 4366 1 12 . 1 1 19 19 LEU CA C 145 56.620 56.620 57.050 -0.430 18090 4367 1 12 . 1 1 19 19 LEU CB C 145 41.780 41.780 41.539 0.241 18090 4368 1 12 . 1 1 19 19 LEU H H 145 7.990 7.990 7.530 0.460 18090 4369 1 12 . 1 1 20 20 LYS N N 146 118.960 118.960 117.548 1.412 18090 4370 1 12 . 1 1 20 20 LYS HA H 146 3.610 3.610 4.006 -0.396 18090 4371 1 12 . 1 1 20 20 LYS C C 146 177.390 177.390 178.125 -0.735 18090 4372 1 12 . 1 1 20 20 LYS CA C 146 59.640 59.640 59.075 0.565 18090 4373 1 12 . 1 1 20 20 LYS CB C 146 32.450 32.450 32.329 0.121 18090 4374 1 12 . 1 1 20 20 LYS H H 146 8.250 8.250 7.791 0.459 18090 4375 1 12 . 1 1 21 21 LYS N N 147 114.720 114.720 116.511 -1.791 18090 4376 1 12 . 1 1 21 21 LYS HA H 147 4.110 4.110 4.238 -0.128 18090 4377 1 12 . 1 1 21 21 LYS C C 147 175.880 175.880 178.051 -2.171 18090 4378 1 12 . 1 1 21 21 LYS CA C 147 56.210 56.210 58.184 -1.974 18090 4379 1 12 . 1 1 21 21 LYS CB C 147 33.000 33.000 32.721 0.279 18090 4380 1 12 . 1 1 21 21 LYS H H 147 7.130 7.130 7.694 -0.565 18090 4381 1 12 . 1 1 22 22 ASN N N 148 122.180 122.180 115.345 6.835 18090 4382 1 12 . 1 1 22 22 ASN HA H 148 4.740 4.740 4.917 -0.177 18090 4383 1 12 . 1 1 22 22 ASN C C 148 174.000 174.000 173.496 0.504 18090 4384 1 12 . 1 1 22 22 ASN CA C 148 50.970 50.970 52.687 -1.717 18090 4385 1 12 . 1 1 22 22 ASN CB C 148 38.670 38.670 38.954 -0.284 18090 4386 1 12 . 1 1 22 22 ASN H H 148 6.930 6.930 7.893 -0.963 18090 4387 1 12 . 1 1 23 23 PRO HA H 149 4.300 4.300 4.697 -0.397 18090 4388 1 12 . 1 1 23 23 PRO CA C 149 64.610 64.610 61.973 2.637 18090 4389 1 12 . 1 1 23 23 PRO CB C 149 32.000 32.000 34.128 -2.128 18090 4390 1 12 . 1 1 24 24 LYS N N 150 116.060 116.060 121.275 -5.215 18090 4391 1 12 . 1 1 24 24 LYS HA H 150 4.070 4.070 3.978 0.092 18090 4392 1 12 . 1 1 24 24 LYS C C 150 178.240 178.240 178.597 -0.357 18090 4393 1 12 . 1 1 24 24 LYS CA C 150 57.950 57.950 59.764 -1.814 18090 4394 1 12 . 1 1 24 24 LYS CB C 150 32.590 32.590 31.951 0.639 18090 4395 1 12 . 1 1 24 24 LYS H H 150 8.520 8.520 8.804 -0.284 18090 4396 1 12 . 1 1 25 25 THR N N 151 105.190 105.190 110.547 -5.357 18090 4397 1 12 . 1 1 25 25 THR HA H 151 4.390 4.390 4.061 0.329 18090 4398 1 12 . 1 1 25 25 THR C C 151 176.090 176.090 176.196 -0.106 18090 4399 1 12 . 1 1 25 25 THR CA C 151 61.400 61.400 64.831 -3.431 18090 4400 1 12 . 1 1 25 25 THR CB C 151 69.440 69.440 68.215 1.225 18090 4401 1 12 . 1 1 25 25 THR H H 151 7.490 7.490 8.104 -0.614 18090 4402 1 12 . 1 1 26 26 SER N N 152 119.700 119.700 116.474 3.226 18090 4403 1 12 . 1 1 26 26 SER HA H 152 3.770 3.770 4.148 -0.378 18090 4404 1 12 . 1 1 26 26 SER C C 152 177.470 177.470 176.063 1.407 18090 4405 1 12 . 1 1 26 26 SER CA C 152 62.450 62.450 61.330 1.120 18090 4406 1 12 . 1 1 26 26 SER CB C 152 62.520 62.520 62.772 -0.252 18090 4407 1 12 . 1 1 26 26 SER H H 152 8.190 8.190 7.966 0.224 18090 4408 1 12 . 1 1 27 27 GLU N N 153 119.870 119.870 122.918 -3.048 18090 4409 1 12 . 1 1 27 27 GLU HA H 153 3.890 3.890 3.952 -0.062 18090 4410 1 12 . 1 1 27 27 GLU C C 153 180.040 180.040 178.711 1.329 18090 4411 1 12 . 1 1 27 27 GLU CA C 153 58.700 58.700 59.471 -0.771 18090 4412 1 12 . 1 1 27 27 GLU CB C 153 28.590 28.590 29.447 -0.857 18090 4413 1 12 . 1 1 27 27 GLU H H 153 8.350 8.350 7.916 0.434 18090 4414 1 12 . 1 1 28 28 MET N N 154 119.430 119.430 117.125 2.305 18090 4415 1 12 . 1 1 28 28 MET HA H 154 4.040 4.040 4.155 -0.115 18090 4416 1 12 . 1 1 28 28 MET C C 154 177.110 177.110 178.045 -0.935 18090 4417 1 12 . 1 1 28 28 MET CA C 154 58.510 58.510 58.799 -0.289 18090 4418 1 12 . 1 1 28 28 MET CB C 154 31.430 31.430 32.769 -1.339 18090 4419 1 12 . 1 1 28 28 MET H H 154 7.850 7.850 7.570 0.280 18090 4420 1 12 . 1 1 29 29 MET N N 155 112.640 112.640 114.394 -1.754 18090 4421 1 12 . 1 1 29 29 MET HA H 155 4.340 4.340 4.273 0.067 18090 4422 1 12 . 1 1 29 29 MET C C 155 175.530 175.530 177.876 -2.346 18090 4423 1 12 . 1 1 29 29 MET CA C 155 53.790 53.790 57.212 -3.422 18090 4424 1 12 . 1 1 29 29 MET CB C 155 30.380 30.380 31.850 -1.470 18090 4425 1 12 . 1 1 29 29 MET H H 155 7.200 7.200 7.402 -0.202 18090 4426 1 12 . 1 1 30 30 LYS N N 156 117.050 117.050 117.114 -0.064 18090 4427 1 12 . 1 1 30 30 LYS HA H 156 3.960 3.960 4.247 -0.287 18090 4428 1 12 . 1 1 30 30 LYS C C 156 176.120 176.120 177.143 -1.023 18090 4429 1 12 . 1 1 30 30 LYS CA C 156 57.090 57.090 57.674 -0.584 18090 4430 1 12 . 1 1 30 30 LYS CB C 156 31.960 31.960 32.939 -0.979 18090 4431 1 12 . 1 1 30 30 LYS H H 156 7.130 7.130 7.729 -0.599 18090 4432 1 12 . 1 1 31 31 ASP N N 157 119.810 119.810 118.382 1.428 18090 4433 1 12 . 1 1 31 31 ASP HA H 157 4.860 4.860 4.982 -0.122 18090 4434 1 12 . 1 1 31 31 ASP C C 157 174.890 174.890 174.489 0.401 18090 4435 1 12 . 1 1 31 31 ASP CA C 157 50.520 50.520 54.207 -3.687 18090 4436 1 12 . 1 1 31 31 ASP CB C 157 41.010 41.010 40.556 0.454 18090 4437 1 12 . 1 1 31 31 ASP H H 157 7.340 7.340 7.717 -0.377 18090 4438 1 12 . 1 1 32 32 PRO HA H 158 4.130 4.130 4.475 -0.345 18090 4439 1 12 . 1 1 32 32 PRO CA C 158 64.270 64.270 62.929 1.341 18090 4440 1 12 . 1 1 32 32 PRO CB C 158 31.770 31.770 32.398 -0.628 18090 4441 1 12 . 1 1 33 33 GLN N N 159 117.760 117.760 120.274 -2.514 18090 4442 1 12 . 1 1 33 33 GLN HA H 159 4.000 4.000 4.040 -0.040 18090 4443 1 12 . 1 1 33 33 GLN C C 159 178.740 178.740 177.945 0.795 18090 4444 1 12 . 1 1 33 33 GLN CA C 159 58.220 58.220 58.036 0.184 18090 4445 1 12 . 1 1 33 33 GLN CB C 159 27.870 27.870 28.078 -0.208 18090 4446 1 12 . 1 1 33 33 GLN H H 159 8.150 8.150 8.770 -0.620 18090 4447 1 12 . 1 1 34 34 LEU N N 160 123.300 123.300 120.040 3.260 18090 4448 1 12 . 1 1 34 34 LEU HA H 160 3.970 3.970 4.009 -0.039 18090 4449 1 12 . 1 1 34 34 LEU C C 160 177.980 177.980 178.149 -0.169 18090 4450 1 12 . 1 1 34 34 LEU CA C 160 57.050 57.050 57.254 -0.204 18090 4451 1 12 . 1 1 34 34 LEU CB C 160 40.760 40.760 41.669 -0.909 18090 4452 1 12 . 1 1 34 34 LEU H H 160 7.110 7.110 7.983 -0.873 18090 4453 1 12 . 1 1 35 35 VAL N N 161 118.390 118.390 119.418 -1.028 18090 4454 1 12 . 1 1 35 35 VAL HA H 161 3.110 3.110 3.491 -0.381 18090 4455 1 12 . 1 1 35 35 VAL C C 161 176.840 176.840 177.662 -0.822 18090 4456 1 12 . 1 1 35 35 VAL CA C 161 67.700 67.700 66.980 0.720 18090 4457 1 12 . 1 1 35 35 VAL CB C 161 31.260 31.260 31.328 -0.068 18090 4458 1 12 . 1 1 35 35 VAL H H 161 7.430 7.430 7.411 0.019 18090 4459 1 12 . 1 1 36 36 ALA N N 162 117.600 117.600 121.247 -3.647 18090 4460 1 12 . 1 1 36 36 ALA HA H 162 3.810 3.810 3.946 -0.136 18090 4461 1 12 . 1 1 36 36 ALA C C 162 180.620 180.620 179.619 1.001 18090 4462 1 12 . 1 1 36 36 ALA CA C 162 54.720 54.720 55.326 -0.606 18090 4463 1 12 . 1 1 36 36 ALA CB C 162 17.490 17.490 18.102 -0.612 18090 4464 1 12 . 1 1 36 36 ALA H H 162 7.500 7.500 7.781 -0.281 18090 4465 1 12 . 1 1 37 37 LYS N N 163 119.880 119.880 118.544 1.336 18090 4466 1 12 . 1 1 37 37 LYS HA H 163 3.570 3.570 3.988 -0.418 18090 4467 1 12 . 1 1 37 37 LYS C C 163 177.800 177.800 179.111 -1.311 18090 4468 1 12 . 1 1 37 37 LYS CA C 163 58.880 58.880 58.940 -0.060 18090 4469 1 12 . 1 1 37 37 LYS CB C 163 31.610 31.610 32.048 -0.438 18090 4470 1 12 . 1 1 37 37 LYS H H 163 7.350 7.350 7.407 -0.057 18090 4471 1 12 . 1 1 38 38 LEU N N 164 118.020 118.020 119.969 -1.949 18090 4472 1 12 . 1 1 38 38 LEU HA H 164 3.670 3.670 4.069 -0.399 18090 4473 1 12 . 1 1 38 38 LEU C C 164 179.380 179.380 179.279 0.101 18090 4474 1 12 . 1 1 38 38 LEU CA C 164 57.340 57.340 57.734 -0.394 18090 4475 1 12 . 1 1 38 38 LEU CB C 164 41.660 41.660 41.719 -0.059 18090 4476 1 12 . 1 1 38 38 LEU H H 164 7.660 7.660 8.144 -0.484 18090 4477 1 12 . 1 1 39 39 ILE N N 165 118.070 118.070 118.296 -0.226 18090 4478 1 12 . 1 1 39 39 ILE HA H 165 3.510 3.510 3.651 -0.141 18090 4479 1 12 . 1 1 39 39 ILE C C 165 179.570 179.570 178.201 1.369 18090 4480 1 12 . 1 1 39 39 ILE CA C 165 64.450 64.450 65.504 -1.054 18090 4481 1 12 . 1 1 39 39 ILE CB C 165 37.310 37.310 37.469 -0.159 18090 4482 1 12 . 1 1 39 39 ILE H H 165 8.030 8.030 7.976 0.054 18090 4483 1 12 . 1 1 40 40 GLY N N 166 107.970 107.970 108.042 -0.072 18090 4484 1 12 . 1 1 40 40 GLY C C 166 176.470 176.470 175.710 0.760 18090 4485 1 12 . 1 1 40 40 GLY CA C 166 46.410 46.410 46.967 -0.557 18090 4486 1 12 . 1 1 40 40 GLY H H 166 7.590 7.590 7.636 -0.046 18090 4487 1 12 . 1 1 41 41 TYR N N 167 121.270 121.270 122.319 -1.049 18090 4488 1 12 . 1 1 41 41 TYR HA H 167 4.190 4.190 4.212 -0.022 18090 4489 1 12 . 1 1 41 41 TYR C C 167 176.470 176.470 176.204 0.266 18090 4490 1 12 . 1 1 41 41 TYR CA C 167 57.130 57.130 60.410 -3.280 18090 4491 1 12 . 1 1 41 41 TYR CB C 167 35.950 35.950 38.227 -2.276 18090 4492 1 12 . 1 1 41 41 TYR H H 167 7.350 7.350 7.919 -0.569 18090 4493 1 12 . 1 1 42 42 LYS N N 168 116.520 116.520 116.134 0.386 18090 4494 1 12 . 1 1 42 42 LYS HA H 168 3.820 3.820 4.041 -0.221 18090 4495 1 12 . 1 1 42 42 LYS C C 168 177.810 177.810 177.900 -0.090 18090 4496 1 12 . 1 1 42 42 LYS CA C 168 59.390 59.390 58.391 0.999 18090 4497 1 12 . 1 1 42 42 LYS CB C 168 31.580 31.580 32.752 -1.172 18090 4498 1 12 . 1 1 42 42 LYS H H 168 7.460 7.460 8.249 -0.789 18090 4499 1 12 . 1 1 43 43 GLN N N 169 113.750 113.750 115.984 -2.234 18090 4500 1 12 . 1 1 43 43 GLN HA H 169 4.220 4.220 4.162 0.058 18090 4501 1 12 . 1 1 43 43 GLN C C 169 175.840 175.840 177.163 -1.323 18090 4502 1 12 . 1 1 43 43 GLN CA C 169 56.230 56.230 58.121 -1.891 18090 4503 1 12 . 1 1 43 43 GLN CB C 169 29.290 29.290 29.402 -0.112 18090 4504 1 12 . 1 1 43 43 GLN H H 169 7.220 7.220 7.624 -0.404 18090 4505 1 12 . 1 1 44 44 ASN N N 170 114.130 114.130 116.196 -2.066 18090 4506 1 12 . 1 1 44 44 ASN HA H 170 5.050 5.050 4.987 0.063 18090 4507 1 12 . 1 1 44 44 ASN C C 170 172.200 172.200 173.664 -1.464 18090 4508 1 12 . 1 1 44 44 ASN CA C 170 50.780 50.780 53.449 -2.669 18090 4509 1 12 . 1 1 44 44 ASN CB C 170 38.380 38.380 39.956 -1.576 18090 4510 1 12 . 1 1 44 44 ASN H H 170 7.580 7.580 7.633 -0.053 18090 4511 1 12 . 1 1 45 45 PRO HA H 171 4.130 4.130 4.699 -0.569 18090 4512 1 12 . 1 1 45 45 PRO CA C 171 64.800 64.800 62.211 2.589 18090 4513 1 12 . 1 1 45 45 PRO CB C 171 31.360 31.360 31.772 -0.412 18090 4514 1 12 . 1 1 46 46 GLN N N 172 115.570 115.570 124.925 -9.355 18090 4515 1 12 . 1 1 46 46 GLN HA H 172 3.770 3.770 3.833 -0.063 18090 4516 1 12 . 1 1 46 46 GLN C C 172 177.360 177.360 177.597 -0.237 18090 4517 1 12 . 1 1 46 46 GLN CA C 172 57.950 57.950 58.214 -0.264 18090 4518 1 12 . 1 1 46 46 GLN CB C 172 27.050 27.050 27.657 -0.607 18090 4519 1 12 . 1 1 46 46 GLN H H 172 8.160 8.160 8.564 -0.404 18090 4520 1 12 . 1 1 47 47 ALA N N 173 121.420 121.420 121.855 -0.435 18090 4521 1 12 . 1 1 47 47 ALA HA H 173 4.050 4.050 4.166 -0.116 18090 4522 1 12 . 1 1 47 47 ALA C C 173 178.090 178.090 179.535 -1.445 18090 4523 1 12 . 1 1 47 47 ALA CA C 173 53.490 53.490 53.945 -0.455 18090 4524 1 12 . 1 1 47 47 ALA CB C 173 18.450 18.450 17.643 0.807 18090 4525 1 12 . 1 1 47 47 ALA H H 173 7.470 7.470 8.105 -0.635 18090 4526 1 12 . 1 1 48 48 ILE N N 174 118.050 118.050 118.709 -0.659 18090 4527 1 12 . 1 1 48 48 ILE HA H 174 3.180 3.180 3.892 -0.712 18090 4528 1 12 . 1 1 48 48 ILE C C 174 176.250 176.250 177.880 -1.630 18090 4529 1 12 . 1 1 48 48 ILE CA C 174 64.030 64.030 64.081 -0.050 18090 4530 1 12 . 1 1 48 48 ILE CB C 174 37.280 37.280 37.071 0.209 18090 4531 1 12 . 1 1 48 48 ILE H H 174 7.150 7.150 7.336 -0.186 18090 4532 1 12 . 1 1 49 49 GLY N N 175 105.390 105.390 106.556 -1.166 18090 4533 1 12 . 1 1 49 49 GLY C C 175 174.220 174.220 176.001 -1.781 18090 4534 1 12 . 1 1 49 49 GLY CA C 175 46.700 46.700 47.029 -0.329 18090 4535 1 12 . 1 1 49 49 GLY H H 175 7.550 7.550 7.793 -0.243 18090 4536 1 12 . 1 1 50 50 GLN N N 176 116.230 116.230 118.650 -2.420 18090 4537 1 12 . 1 1 50 50 GLN HA H 176 4.210 4.210 4.618 -0.408 18090 4538 1 12 . 1 1 50 50 GLN C C 176 178.120 178.120 178.318 -0.198 18090 4539 1 12 . 1 1 50 50 GLN CA C 176 57.320 57.320 58.041 -0.721 18090 4540 1 12 . 1 1 50 50 GLN CB C 176 28.630 28.630 29.213 -0.583 18090 4541 1 12 . 1 1 50 50 GLN H H 176 7.390 7.390 7.996 -0.606 18090 4542 1 12 . 1 1 51 51 ASP N N 177 120.000 120.000 121.087 -1.087 18090 4543 1 12 . 1 1 51 51 ASP HA H 177 4.420 4.420 4.641 -0.221 18090 4544 1 12 . 1 1 51 51 ASP C C 177 177.950 177.950 178.347 -0.397 18090 4545 1 12 . 1 1 51 51 ASP CA C 177 55.840 55.840 56.018 -0.178 18090 4546 1 12 . 1 1 51 51 ASP CB C 177 40.310 40.310 40.832 -0.522 18090 4547 1 12 . 1 1 51 51 ASP H H 177 7.870 7.870 7.919 -0.049 18090 4548 1 12 . 1 1 52 52 LEU N N 178 120.010 120.010 120.657 -0.647 18090 4549 1 12 . 1 1 52 52 LEU HA H 178 3.650 3.650 3.948 -0.298 18090 4550 1 12 . 1 1 52 52 LEU C C 178 175.810 175.810 178.369 -2.559 18090 4551 1 12 . 1 1 52 52 LEU CA C 178 57.620 57.620 57.909 -0.289 18090 4552 1 12 . 1 1 52 52 LEU CB C 178 41.880 41.880 41.658 0.222 18090 4553 1 12 . 1 1 52 52 LEU H H 178 7.860 7.860 7.655 0.205 18090 4554 1 12 . 1 1 53 53 PHE N N 179 110.580 110.580 113.346 -2.766 18090 4555 1 12 . 1 1 53 53 PHE HA H 179 4.230 4.230 4.310 -0.080 18090 4556 1 12 . 1 1 53 53 PHE C C 179 176.370 176.370 178.103 -1.733 18090 4557 1 12 . 1 1 53 53 PHE CA C 179 58.730 58.730 60.522 -1.792 18090 4558 1 12 . 1 1 53 53 PHE CB C 179 38.720 38.720 38.698 0.022 18090 4559 1 12 . 1 1 53 53 PHE H H 179 7.210 7.210 7.838 -0.628 18090 4560 1 12 . 1 1 54 54 THR N N 180 108.190 108.190 108.729 -0.539 18090 4561 1 12 . 1 1 54 54 THR HA H 180 4.300 4.300 4.314 -0.014 18090 4562 1 12 . 1 1 54 54 THR C C 180 174.400 174.400 174.681 -0.281 18090 4563 1 12 . 1 1 54 54 THR CA C 180 62.020 62.020 63.179 -1.159 18090 4564 1 12 . 1 1 54 54 THR CB C 180 69.730 69.730 69.731 -0.001 18090 4565 1 12 . 1 1 54 54 THR H H 180 7.550 7.550 7.470 0.080 18090 4566 1 12 . 1 1 55 55 ASP N N 181 120.060 120.060 123.381 -3.321 18090 4567 1 12 . 1 1 55 55 ASP HA H 181 5.020 5.020 5.110 -0.090 18090 4568 1 12 . 1 1 55 55 ASP C C 181 174.120 174.120 175.233 -1.113 18090 4569 1 12 . 1 1 55 55 ASP CA C 181 50.560 50.560 50.757 -0.197 18090 4570 1 12 . 1 1 55 55 ASP CB C 181 41.190 41.190 43.163 -1.973 18090 4571 1 12 . 1 1 55 55 ASP H H 181 7.480 7.480 8.117 -0.636 18090 4572 1 12 . 1 1 56 56 PRO HA H 182 4.320 4.320 4.370 -0.050 18090 4573 1 12 . 1 1 56 56 PRO CA C 182 64.280 64.280 64.769 -0.490 18090 4574 1 12 . 1 1 56 56 PRO CB C 182 31.980 31.980 32.566 -0.586 18090 4575 1 12 . 1 1 57 57 ARG N N 183 117.660 117.660 118.680 -1.020 18090 4576 1 12 . 1 1 57 57 ARG HA H 183 3.960 3.960 4.092 -0.132 18090 4577 1 12 . 1 1 57 57 ARG C C 183 179.030 179.030 178.561 0.469 18090 4578 1 12 . 1 1 57 57 ARG CA C 183 59.000 59.000 58.860 0.140 18090 4579 1 12 . 1 1 57 57 ARG CB C 183 29.750 29.750 29.303 0.447 18090 4580 1 12 . 1 1 57 57 ARG H H 183 7.920 7.920 8.162 -0.242 18090 4581 1 12 . 1 1 58 58 LEU N N 184 115.670 115.670 119.516 -3.846 18090 4582 1 12 . 1 1 58 58 LEU HA H 184 3.850 3.850 3.958 -0.108 18090 4583 1 12 . 1 1 58 58 LEU C C 184 178.770 178.770 179.079 -0.309 18090 4584 1 12 . 1 1 58 58 LEU CA C 184 57.110 57.110 57.717 -0.607 18090 4585 1 12 . 1 1 58 58 LEU CB C 184 41.310 41.310 41.605 -0.295 18090 4586 1 12 . 1 1 58 58 LEU H H 184 7.750 7.750 8.184 -0.434 18090 4587 1 12 . 1 1 59 59 MET N N 185 118.570 118.570 116.233 2.337 18090 4588 1 12 . 1 1 59 59 MET HA H 185 4.060 4.060 4.121 -0.061 18090 4589 1 12 . 1 1 59 59 MET C C 185 177.540 177.540 178.185 -0.645 18090 4590 1 12 . 1 1 59 59 MET CA C 185 58.090 58.090 59.302 -1.212 18090 4591 1 12 . 1 1 59 59 MET CB C 185 31.270 31.270 32.179 -0.909 18090 4592 1 12 . 1 1 59 59 MET H H 185 7.590 7.590 7.685 -0.095 18090 4593 1 12 . 1 1 60 60 THR N N 186 116.390 116.390 117.363 -0.973 18090 4594 1 12 . 1 1 60 60 THR HA H 186 3.680 3.680 4.004 -0.324 18090 4595 1 12 . 1 1 60 60 THR C C 186 177.440 177.440 176.708 0.732 18090 4596 1 12 . 1 1 60 60 THR CA C 186 66.940 66.940 66.373 0.567 18090 4597 1 12 . 1 1 60 60 THR CB C 186 68.030 68.030 68.137 -0.107 18090 4598 1 12 . 1 1 60 60 THR H H 186 7.180 7.180 7.769 -0.589 18090 4599 1 12 . 1 1 61 61 ILE N N 187 123.840 123.840 122.128 1.712 18090 4600 1 12 . 1 1 61 61 ILE HA H 187 3.290 3.290 3.767 -0.477 18090 4601 1 12 . 1 1 61 61 ILE C C 187 176.660 176.660 178.229 -1.569 18090 4602 1 12 . 1 1 61 61 ILE CA C 187 65.850 65.850 65.455 0.395 18090 4603 1 12 . 1 1 61 61 ILE CB C 187 37.640 37.640 37.758 -0.118 18090 4604 1 12 . 1 1 61 61 ILE H H 187 8.010 8.010 7.828 0.182 18090 4605 1 12 . 1 1 62 62 MET N N 188 118.210 118.210 118.249 -0.039 18090 4606 1 12 . 1 1 62 62 MET HA H 188 3.910 3.910 3.999 -0.089 18090 4607 1 12 . 1 1 62 62 MET C C 188 177.540 177.540 178.444 -0.904 18090 4608 1 12 . 1 1 62 62 MET CA C 188 58.530 58.530 58.879 -0.349 18090 4609 1 12 . 1 1 62 62 MET CB C 188 31.200 31.200 31.523 -0.322 18090 4610 1 12 . 1 1 62 62 MET H H 188 8.560 8.560 7.422 1.138 18090 4611 1 12 . 1 1 63 63 ALA N N 189 119.850 119.850 122.496 -2.646 18090 4612 1 12 . 1 1 63 63 ALA HA H 189 3.730 3.730 3.896 -0.166 18090 4613 1 12 . 1 1 63 63 ALA C C 189 179.550 179.550 179.344 0.206 18090 4614 1 12 . 1 1 63 63 ALA CA C 189 55.470 55.470 55.414 0.056 18090 4615 1 12 . 1 1 63 63 ALA CB C 189 17.640 17.640 18.254 -0.614 18090 4616 1 12 . 1 1 63 63 ALA H H 189 8.210 8.210 8.168 0.042 18090 4617 1 12 . 1 1 64 64 THR N N 190 114.570 114.570 113.873 0.697 18090 4618 1 12 . 1 1 64 64 THR HA H 190 3.790 3.790 4.101 -0.311 18090 4619 1 12 . 1 1 64 64 THR C C 190 177.640 177.640 177.280 0.360 18090 4620 1 12 . 1 1 64 64 THR CA C 190 66.690 66.690 65.382 1.308 18090 4621 1 12 . 1 1 64 64 THR CB C 190 68.310 68.310 68.715 -0.405 18090 4622 1 12 . 1 1 64 64 THR H H 190 7.740 7.740 7.595 0.145 18090 4623 1 12 . 1 1 65 65 LEU N N 191 122.410 122.410 123.016 -0.606 18090 4624 1 12 . 1 1 65 65 LEU HA H 191 3.930 3.930 3.949 -0.019 18090 4625 1 12 . 1 1 65 65 LEU C C 191 178.470 178.470 179.548 -1.078 18090 4626 1 12 . 1 1 65 65 LEU CA C 191 57.120 57.120 58.017 -0.897 18090 4627 1 12 . 1 1 65 65 LEU CB C 191 41.830 41.830 41.808 0.022 18090 4628 1 12 . 1 1 65 65 LEU H H 191 8.180 8.180 7.652 0.528 18090 4629 1 12 . 1 1 66 66 MET N N 192 115.320 115.320 117.147 -1.827 18090 4630 1 12 . 1 1 66 66 MET HA H 192 4.090 4.090 4.301 -0.210 18090 4631 1 12 . 1 1 66 66 MET C C 192 176.090 176.090 178.267 -2.177 18090 4632 1 12 . 1 1 66 66 MET CA C 192 56.390 56.390 57.486 -1.096 18090 4633 1 12 . 1 1 66 66 MET CB C 192 33.770 33.770 31.925 1.845 18090 4634 1 12 . 1 1 66 66 MET H H 192 7.880 7.880 8.424 -0.544 18090 4635 1 12 . 1 1 67 67 GLY N N 193 107.490 107.490 105.324 2.166 18090 4636 1 12 . 1 1 67 67 GLY C C 193 174.390 174.390 174.698 -0.308 18090 4637 1 12 . 1 1 67 67 GLY CA C 193 45.880 45.880 45.147 0.733 18090 4638 1 12 . 1 1 67 67 GLY H H 193 7.580 7.580 8.153 -0.573 18090 4639 1 12 . 1 1 68 68 VAL N N 194 118.520 118.520 116.536 1.984 18090 4640 1 12 . 1 1 68 68 VAL HA H 194 3.940 3.940 3.588 0.352 18090 4641 1 12 . 1 1 68 68 VAL C C 194 174.760 174.760 176.023 -1.263 18090 4642 1 12 . 1 1 68 68 VAL CA C 194 61.510 61.510 63.404 -1.894 18090 4643 1 12 . 1 1 68 68 VAL CB C 194 32.670 32.670 29.907 2.763 18090 4644 1 12 . 1 1 68 68 VAL H H 194 7.840 7.840 7.439 0.401 18090 4645 1 12 . 1 1 69 69 ASP N N 195 124.550 124.550 119.714 4.836 18090 4646 1 12 . 1 1 69 69 ASP HA H 195 4.430 4.430 4.480 -0.050 18090 4647 1 12 . 1 1 69 69 ASP C C 195 175.140 175.140 177.004 -1.864 18090 4648 1 12 . 1 1 69 69 ASP CA C 195 53.760 53.760 56.611 -2.851 18090 4649 1 12 . 1 1 69 69 ASP CB C 195 40.920 40.920 41.046 -0.126 18090 4650 1 12 . 1 1 69 69 ASP H H 195 8.400 8.400 7.946 0.454 18090 4651 1 12 . 1 1 70 70 LEU N N 196 123.930 123.930 119.353 4.577 18090 4652 1 12 . 1 1 70 70 LEU HA H 196 4.200 4.200 4.192 0.008 18090 4653 1 12 . 1 1 70 70 LEU C C 196 175.950 175.950 176.914 -0.964 18090 4654 1 12 . 1 1 70 70 LEU CA C 196 54.380 54.380 56.756 -2.376 18090 4655 1 12 . 1 1 70 70 LEU CB C 196 41.610 41.610 42.654 -1.044 18090 4656 1 12 . 1 1 70 70 LEU H H 196 8.160 8.160 7.503 0.657 18090 4657 1 13 . 1 1 2 2 PRO HA H 128 4.220 4.220 4.348 -0.128 18090 4658 1 13 . 1 1 2 2 PRO CA C 128 63.320 63.320 64.434 -1.114 18090 4659 1 13 . 1 1 2 2 PRO CB C 128 31.680 31.680 32.055 -0.375 18090 4660 1 13 . 1 1 3 3 ASP N N 129 119.320 119.320 120.694 -1.374 18090 4661 1 13 . 1 1 3 3 ASP HA H 129 4.400 4.400 4.720 -0.320 18090 4662 1 13 . 1 1 3 3 ASP C C 129 176.120 176.120 175.743 0.377 18090 4663 1 13 . 1 1 3 3 ASP CA C 129 54.050 54.050 53.814 0.236 18090 4664 1 13 . 1 1 3 3 ASP CB C 129 40.770 40.770 38.858 1.912 18090 4665 1 13 . 1 1 3 3 ASP H H 129 8.310 8.310 8.349 -0.039 18090 4666 1 13 . 1 1 4 4 LEU N N 130 122.280 122.280 118.690 3.590 18090 4667 1 13 . 1 1 4 4 LEU HA H 130 4.130 4.130 3.919 0.211 18090 4668 1 13 . 1 1 4 4 LEU C C 130 177.280 177.280 177.990 -0.710 18090 4669 1 13 . 1 1 4 4 LEU CA C 130 55.350 55.350 55.538 -0.188 18090 4670 1 13 . 1 1 4 4 LEU CB C 130 41.490 41.490 42.011 -0.521 18090 4671 1 13 . 1 1 4 4 LEU H H 130 8.080 8.080 7.752 0.328 18090 4672 1 13 . 1 1 5 5 GLY N N 131 107.830 107.830 105.936 1.894 18090 4673 1 13 . 1 1 5 5 GLY C C 131 175.120 175.120 173.208 1.912 18090 4674 1 13 . 1 1 5 5 GLY CA C 131 45.300 45.300 45.379 -0.079 18090 4675 1 13 . 1 1 5 5 GLY H H 131 8.180 8.180 8.380 -0.200 18090 4676 1 13 . 1 1 6 6 LEU N N 132 121.080 121.080 116.229 4.851 18090 4677 1 13 . 1 1 6 6 LEU HA H 132 3.870 3.870 4.473 -0.603 18090 4678 1 13 . 1 1 6 6 LEU C C 132 178.000 178.000 177.602 0.398 18090 4679 1 13 . 1 1 6 6 LEU CA C 132 57.180 57.180 53.425 3.755 18090 4680 1 13 . 1 1 6 6 LEU CB C 132 41.870 41.870 44.815 -2.945 18090 4681 1 13 . 1 1 6 6 LEU H H 132 8.150 8.150 7.419 0.731 18090 4682 1 13 . 1 1 7 7 THR N N 133 111.580 111.580 113.782 -2.202 18090 4683 1 13 . 1 1 7 7 THR HA H 133 3.730 3.730 4.021 -0.291 18090 4684 1 13 . 1 1 7 7 THR C C 133 176.530 176.530 176.030 0.500 18090 4685 1 13 . 1 1 7 7 THR CA C 133 65.940 65.940 66.228 -0.288 18090 4686 1 13 . 1 1 7 7 THR CB C 133 68.130 68.130 68.566 -0.436 18090 4687 1 13 . 1 1 7 7 THR H H 133 7.970 7.970 8.693 -0.723 18090 4688 1 13 . 1 1 8 8 GLN N N 134 119.490 119.490 121.459 -1.969 18090 4689 1 13 . 1 1 8 8 GLN HA H 134 3.990 3.990 3.926 0.064 18090 4690 1 13 . 1 1 8 8 GLN C C 134 178.190 178.190 178.361 -0.171 18090 4691 1 13 . 1 1 8 8 GLN CA C 134 57.930 57.930 58.754 -0.824 18090 4692 1 13 . 1 1 8 8 GLN CB C 134 27.850 27.850 27.860 -0.010 18090 4693 1 13 . 1 1 8 8 GLN H H 134 7.890 7.890 8.381 -0.491 18090 4694 1 13 . 1 1 9 9 LEU N N 135 120.170 120.170 119.293 0.877 18090 4695 1 13 . 1 1 9 9 LEU HA H 135 3.820 3.820 3.922 -0.102 18090 4696 1 13 . 1 1 9 9 LEU C C 135 177.810 177.810 178.836 -1.026 18090 4697 1 13 . 1 1 9 9 LEU CA C 135 57.470 57.470 57.365 0.105 18090 4698 1 13 . 1 1 9 9 LEU CB C 135 41.640 41.640 41.663 -0.023 18090 4699 1 13 . 1 1 9 9 LEU H H 135 7.600 7.600 7.309 0.291 18090 4700 1 13 . 1 1 10 10 PHE N N 136 111.950 111.950 113.875 -1.925 18090 4701 1 13 . 1 1 10 10 PHE HA H 136 4.380 4.380 4.464 -0.084 18090 4702 1 13 . 1 1 10 10 PHE C C 136 174.990 174.990 177.449 -2.459 18090 4703 1 13 . 1 1 10 10 PHE CA C 136 58.450 58.450 57.699 0.751 18090 4704 1 13 . 1 1 10 10 PHE CB C 136 38.570 38.570 37.305 1.265 18090 4705 1 13 . 1 1 10 10 PHE H H 136 7.410 7.410 6.721 0.689 18090 4706 1 13 . 1 1 11 11 ALA N N 137 120.230 120.230 122.087 -1.857 18090 4707 1 13 . 1 1 11 11 ALA HA H 137 4.130 4.130 4.151 -0.021 18090 4708 1 13 . 1 1 11 11 ALA C C 137 177.090 177.090 178.242 -1.152 18090 4709 1 13 . 1 1 11 11 ALA CA C 137 52.580 52.580 53.541 -0.961 18090 4710 1 13 . 1 1 11 11 ALA CB C 137 18.660 18.660 18.757 -0.097 18090 4711 1 13 . 1 1 11 11 ALA H H 137 7.330 7.330 8.594 -1.264 18090 4712 1 13 . 1 1 12 12 ASP N N 138 119.830 119.830 120.759 -0.929 18090 4713 1 13 . 1 1 12 12 ASP HA H 138 4.510 4.510 4.719 -0.209 18090 4714 1 13 . 1 1 12 12 ASP C C 138 176.370 176.370 174.846 1.524 18090 4715 1 13 . 1 1 12 12 ASP CA C 138 51.960 51.960 52.853 -0.894 18090 4716 1 13 . 1 1 12 12 ASP CB C 138 41.990 41.990 41.583 0.407 18090 4717 1 13 . 1 1 12 12 ASP H H 138 6.980 6.980 7.621 -0.641 18090 4718 1 13 . 1 1 13 13 PRO HA H 139 4.260 4.260 4.424 -0.164 18090 4719 1 13 . 1 1 13 13 PRO CA C 139 64.350 64.350 63.195 1.155 18090 4720 1 13 . 1 1 13 13 PRO CB C 139 31.760 31.760 32.287 -0.527 18090 4721 1 13 . 1 1 14 14 ASN N N 140 116.840 116.840 118.140 -1.300 18090 4722 1 13 . 1 1 14 14 ASN HA H 140 4.840 4.840 4.472 0.368 18090 4723 1 13 . 1 1 14 14 ASN C C 140 173.840 173.840 175.652 -1.812 18090 4724 1 13 . 1 1 14 14 ASN CA C 140 52.380 52.380 54.041 -1.661 18090 4725 1 13 . 1 1 14 14 ASN CB C 140 38.330 38.330 36.824 1.506 18090 4726 1 13 . 1 1 14 14 ASN H H 140 8.670 8.670 8.721 -0.051 18090 4727 1 13 . 1 1 15 15 LEU N N 141 120.290 120.290 120.273 0.017 18090 4728 1 13 . 1 1 15 15 LEU HA H 141 3.790 3.790 4.539 -0.749 18090 4729 1 13 . 1 1 15 15 LEU C C 141 177.120 177.120 177.486 -0.366 18090 4730 1 13 . 1 1 15 15 LEU CA C 141 59.280 59.280 55.584 3.696 18090 4731 1 13 . 1 1 15 15 LEU CB C 141 42.980 42.980 43.172 -0.192 18090 4732 1 13 . 1 1 15 15 LEU H H 141 7.200 7.200 8.375 -1.175 18090 4733 1 13 . 1 1 16 16 ILE N N 142 115.290 115.290 120.567 -5.277 18090 4734 1 13 . 1 1 16 16 ILE HA H 142 3.480 3.480 3.670 -0.190 18090 4735 1 13 . 1 1 16 16 ILE C C 142 177.990 177.990 177.465 0.525 18090 4736 1 13 . 1 1 16 16 ILE CA C 142 62.690 62.690 65.290 -2.600 18090 4737 1 13 . 1 1 16 16 ILE CB C 142 34.620 34.620 37.757 -3.137 18090 4738 1 13 . 1 1 16 16 ILE H H 142 7.940 7.940 8.421 -0.481 18090 4739 1 13 . 1 1 17 17 GLU N N 143 119.600 119.600 119.096 0.504 18090 4740 1 13 . 1 1 17 17 GLU HA H 143 3.700 3.700 3.998 -0.298 18090 4741 1 13 . 1 1 17 17 GLU C C 143 179.170 179.170 178.750 0.420 18090 4742 1 13 . 1 1 17 17 GLU CA C 143 59.360 59.360 60.142 -0.782 18090 4743 1 13 . 1 1 17 17 GLU CB C 143 28.520 28.520 29.209 -0.689 18090 4744 1 13 . 1 1 17 17 GLU H H 143 7.970 7.970 8.559 -0.589 18090 4745 1 13 . 1 1 18 18 ASN N N 144 117.170 117.170 117.945 -0.775 18090 4746 1 13 . 1 1 18 18 ASN HA H 144 4.270 4.270 4.451 -0.181 18090 4747 1 13 . 1 1 18 18 ASN C C 144 179.120 179.120 177.808 1.312 18090 4748 1 13 . 1 1 18 18 ASN CA C 144 55.490 55.490 55.644 -0.154 18090 4749 1 13 . 1 1 18 18 ASN CB C 144 36.550 36.550 37.818 -1.268 18090 4750 1 13 . 1 1 18 18 ASN H H 144 8.450 8.450 8.365 0.085 18090 4751 1 13 . 1 1 19 19 LEU N N 145 121.060 121.060 120.092 0.968 18090 4752 1 13 . 1 1 19 19 LEU HA H 145 4.020 4.020 3.995 0.025 18090 4753 1 13 . 1 1 19 19 LEU C C 145 180.260 180.260 178.510 1.750 18090 4754 1 13 . 1 1 19 19 LEU CA C 145 56.620 56.620 57.399 -0.779 18090 4755 1 13 . 1 1 19 19 LEU CB C 145 41.780 41.780 41.524 0.256 18090 4756 1 13 . 1 1 19 19 LEU H H 145 7.990 7.990 7.571 0.419 18090 4757 1 13 . 1 1 20 20 LYS N N 146 118.960 118.960 117.852 1.108 18090 4758 1 13 . 1 1 20 20 LYS HA H 146 3.610 3.610 3.991 -0.381 18090 4759 1 13 . 1 1 20 20 LYS C C 146 177.390 177.390 178.290 -0.900 18090 4760 1 13 . 1 1 20 20 LYS CA C 146 59.640 59.640 59.358 0.282 18090 4761 1 13 . 1 1 20 20 LYS CB C 146 32.450 32.450 32.338 0.112 18090 4762 1 13 . 1 1 20 20 LYS H H 146 8.250 8.250 7.898 0.352 18090 4763 1 13 . 1 1 21 21 LYS N N 147 114.720 114.720 116.643 -1.923 18090 4764 1 13 . 1 1 21 21 LYS HA H 147 4.110 4.110 4.230 -0.120 18090 4765 1 13 . 1 1 21 21 LYS C C 147 175.880 175.880 178.214 -2.334 18090 4766 1 13 . 1 1 21 21 LYS CA C 147 56.210 56.210 58.252 -2.042 18090 4767 1 13 . 1 1 21 21 LYS CB C 147 33.000 33.000 32.669 0.332 18090 4768 1 13 . 1 1 21 21 LYS H H 147 7.130 7.130 7.633 -0.503 18090 4769 1 13 . 1 1 22 22 ASN N N 148 122.180 122.180 115.425 6.755 18090 4770 1 13 . 1 1 22 22 ASN HA H 148 4.740 4.740 4.908 -0.168 18090 4771 1 13 . 1 1 22 22 ASN C C 148 174.000 174.000 173.509 0.491 18090 4772 1 13 . 1 1 22 22 ASN CA C 148 50.970 50.970 52.786 -1.816 18090 4773 1 13 . 1 1 22 22 ASN CB C 148 38.670 38.670 38.933 -0.263 18090 4774 1 13 . 1 1 22 22 ASN H H 148 6.930 6.930 7.853 -0.923 18090 4775 1 13 . 1 1 23 23 PRO HA H 149 4.300 4.300 4.699 -0.400 18090 4776 1 13 . 1 1 23 23 PRO CA C 149 64.610 64.610 61.969 2.641 18090 4777 1 13 . 1 1 23 23 PRO CB C 149 32.000 32.000 34.215 -2.215 18090 4778 1 13 . 1 1 24 24 LYS N N 150 116.060 116.060 121.107 -5.047 18090 4779 1 13 . 1 1 24 24 LYS HA H 150 4.070 4.070 3.954 0.116 18090 4780 1 13 . 1 1 24 24 LYS C C 150 178.240 178.240 178.256 -0.016 18090 4781 1 13 . 1 1 24 24 LYS CA C 150 57.950 57.950 59.650 -1.700 18090 4782 1 13 . 1 1 24 24 LYS CB C 150 32.590 32.590 31.851 0.739 18090 4783 1 13 . 1 1 24 24 LYS H H 150 8.520 8.520 8.819 -0.299 18090 4784 1 13 . 1 1 25 25 THR N N 151 105.190 105.190 110.672 -5.482 18090 4785 1 13 . 1 1 25 25 THR HA H 151 4.390 4.390 4.073 0.317 18090 4786 1 13 . 1 1 25 25 THR C C 151 176.090 176.090 176.310 -0.220 18090 4787 1 13 . 1 1 25 25 THR CA C 151 61.400 61.400 64.600 -3.200 18090 4788 1 13 . 1 1 25 25 THR CB C 151 69.440 69.440 67.121 2.320 18090 4789 1 13 . 1 1 25 25 THR H H 151 7.490 7.490 8.139 -0.649 18090 4790 1 13 . 1 1 26 26 SER N N 152 119.700 119.700 116.655 3.045 18090 4791 1 13 . 1 1 26 26 SER HA H 152 3.770 3.770 4.128 -0.358 18090 4792 1 13 . 1 1 26 26 SER C C 152 177.470 177.470 175.993 1.477 18090 4793 1 13 . 1 1 26 26 SER CA C 152 62.450 62.450 61.402 1.048 18090 4794 1 13 . 1 1 26 26 SER CB C 152 62.520 62.520 62.605 -0.085 18090 4795 1 13 . 1 1 26 26 SER H H 152 8.190 8.190 7.940 0.250 18090 4796 1 13 . 1 1 27 27 GLU N N 153 119.870 119.870 122.978 -3.108 18090 4797 1 13 . 1 1 27 27 GLU HA H 153 3.890 3.890 3.954 -0.064 18090 4798 1 13 . 1 1 27 27 GLU C C 153 180.040 180.040 178.676 1.364 18090 4799 1 13 . 1 1 27 27 GLU CA C 153 58.700 58.700 59.560 -0.860 18090 4800 1 13 . 1 1 27 27 GLU CB C 153 28.590 28.590 29.447 -0.857 18090 4801 1 13 . 1 1 27 27 GLU H H 153 8.350 8.350 7.812 0.538 18090 4802 1 13 . 1 1 28 28 MET N N 154 119.430 119.430 117.161 2.269 18090 4803 1 13 . 1 1 28 28 MET HA H 154 4.040 4.040 4.155 -0.115 18090 4804 1 13 . 1 1 28 28 MET C C 154 177.110 177.110 178.061 -0.951 18090 4805 1 13 . 1 1 28 28 MET CA C 154 58.510 58.510 58.806 -0.296 18090 4806 1 13 . 1 1 28 28 MET CB C 154 31.430 31.430 32.765 -1.335 18090 4807 1 13 . 1 1 28 28 MET H H 154 7.850 7.850 7.615 0.235 18090 4808 1 13 . 1 1 29 29 MET N N 155 112.640 112.640 114.132 -1.492 18090 4809 1 13 . 1 1 29 29 MET HA H 155 4.340 4.340 4.251 0.089 18090 4810 1 13 . 1 1 29 29 MET C C 155 175.530 175.530 177.805 -2.275 18090 4811 1 13 . 1 1 29 29 MET CA C 155 53.790 53.790 57.222 -3.432 18090 4812 1 13 . 1 1 29 29 MET CB C 155 30.380 30.380 32.024 -1.644 18090 4813 1 13 . 1 1 29 29 MET H H 155 7.200 7.200 7.373 -0.173 18090 4814 1 13 . 1 1 30 30 LYS N N 156 117.050 117.050 116.889 0.161 18090 4815 1 13 . 1 1 30 30 LYS HA H 156 3.960 3.960 4.272 -0.312 18090 4816 1 13 . 1 1 30 30 LYS C C 156 176.120 176.120 177.043 -0.923 18090 4817 1 13 . 1 1 30 30 LYS CA C 156 57.090 57.090 57.307 -0.217 18090 4818 1 13 . 1 1 30 30 LYS CB C 156 31.960 31.960 33.001 -1.041 18090 4819 1 13 . 1 1 30 30 LYS H H 156 7.130 7.130 7.647 -0.517 18090 4820 1 13 . 1 1 31 31 ASP N N 157 119.810 119.810 118.208 1.602 18090 4821 1 13 . 1 1 31 31 ASP HA H 157 4.860 4.860 4.902 -0.042 18090 4822 1 13 . 1 1 31 31 ASP C C 157 174.890 174.890 174.358 0.532 18090 4823 1 13 . 1 1 31 31 ASP CA C 157 50.520 50.520 54.429 -3.909 18090 4824 1 13 . 1 1 31 31 ASP CB C 157 41.010 41.010 40.608 0.402 18090 4825 1 13 . 1 1 31 31 ASP H H 157 7.340 7.340 7.776 -0.436 18090 4826 1 13 . 1 1 32 32 PRO HA H 158 4.130 4.130 4.460 -0.330 18090 4827 1 13 . 1 1 32 32 PRO CA C 158 64.270 64.270 62.818 1.452 18090 4828 1 13 . 1 1 32 32 PRO CB C 158 31.770 31.770 32.425 -0.655 18090 4829 1 13 . 1 1 33 33 GLN N N 159 117.760 117.760 120.248 -2.488 18090 4830 1 13 . 1 1 33 33 GLN HA H 159 4.000 4.000 4.043 -0.043 18090 4831 1 13 . 1 1 33 33 GLN C C 159 178.740 178.740 177.944 0.796 18090 4832 1 13 . 1 1 33 33 GLN CA C 159 58.220 58.220 58.041 0.179 18090 4833 1 13 . 1 1 33 33 GLN CB C 159 27.870 27.870 28.085 -0.215 18090 4834 1 13 . 1 1 33 33 GLN H H 159 8.150 8.150 8.770 -0.620 18090 4835 1 13 . 1 1 34 34 LEU N N 160 123.300 123.300 120.040 3.260 18090 4836 1 13 . 1 1 34 34 LEU HA H 160 3.970 3.970 4.014 -0.044 18090 4837 1 13 . 1 1 34 34 LEU C C 160 177.980 177.980 178.143 -0.163 18090 4838 1 13 . 1 1 34 34 LEU CA C 160 57.050 57.050 57.237 -0.187 18090 4839 1 13 . 1 1 34 34 LEU CB C 160 40.760 40.760 41.671 -0.911 18090 4840 1 13 . 1 1 34 34 LEU H H 160 7.110 7.110 7.983 -0.873 18090 4841 1 13 . 1 1 35 35 VAL N N 161 118.390 118.390 119.458 -1.068 18090 4842 1 13 . 1 1 35 35 VAL HA H 161 3.110 3.110 3.490 -0.380 18090 4843 1 13 . 1 1 35 35 VAL C C 161 176.840 176.840 177.649 -0.809 18090 4844 1 13 . 1 1 35 35 VAL CA C 161 67.700 67.700 66.989 0.711 18090 4845 1 13 . 1 1 35 35 VAL CB C 161 31.260 31.260 31.322 -0.062 18090 4846 1 13 . 1 1 35 35 VAL H H 161 7.430 7.430 7.411 0.019 18090 4847 1 13 . 1 1 36 36 ALA N N 162 117.600 117.600 121.213 -3.613 18090 4848 1 13 . 1 1 36 36 ALA HA H 162 3.810 3.810 3.946 -0.136 18090 4849 1 13 . 1 1 36 36 ALA C C 162 180.620 180.620 179.617 1.003 18090 4850 1 13 . 1 1 36 36 ALA CA C 162 54.720 54.720 55.328 -0.608 18090 4851 1 13 . 1 1 36 36 ALA CB C 162 17.490 17.490 18.107 -0.617 18090 4852 1 13 . 1 1 36 36 ALA H H 162 7.500 7.500 7.783 -0.283 18090 4853 1 13 . 1 1 37 37 LYS N N 163 119.880 119.880 118.530 1.350 18090 4854 1 13 . 1 1 37 37 LYS HA H 163 3.570 3.570 3.987 -0.417 18090 4855 1 13 . 1 1 37 37 LYS C C 163 177.800 177.800 179.111 -1.311 18090 4856 1 13 . 1 1 37 37 LYS CA C 163 58.880 58.880 58.942 -0.062 18090 4857 1 13 . 1 1 37 37 LYS CB C 163 31.610 31.610 32.038 -0.428 18090 4858 1 13 . 1 1 37 37 LYS H H 163 7.350 7.350 7.413 -0.063 18090 4859 1 13 . 1 1 38 38 LEU N N 164 118.020 118.020 119.948 -1.928 18090 4860 1 13 . 1 1 38 38 LEU HA H 164 3.670 3.670 4.076 -0.406 18090 4861 1 13 . 1 1 38 38 LEU C C 164 179.380 179.380 179.277 0.103 18090 4862 1 13 . 1 1 38 38 LEU CA C 164 57.340 57.340 57.725 -0.385 18090 4863 1 13 . 1 1 38 38 LEU CB C 164 41.660 41.660 41.710 -0.050 18090 4864 1 13 . 1 1 38 38 LEU H H 164 7.660 7.660 8.140 -0.480 18090 4865 1 13 . 1 1 39 39 ILE N N 165 118.070 118.070 118.329 -0.259 18090 4866 1 13 . 1 1 39 39 ILE HA H 165 3.510 3.510 3.651 -0.141 18090 4867 1 13 . 1 1 39 39 ILE C C 165 179.570 179.570 178.215 1.355 18090 4868 1 13 . 1 1 39 39 ILE CA C 165 64.450 64.450 65.522 -1.072 18090 4869 1 13 . 1 1 39 39 ILE CB C 165 37.310 37.310 37.453 -0.143 18090 4870 1 13 . 1 1 39 39 ILE H H 165 8.030 8.030 7.984 0.046 18090 4871 1 13 . 1 1 40 40 GLY N N 166 107.970 107.970 108.034 -0.064 18090 4872 1 13 . 1 1 40 40 GLY C C 166 176.470 176.470 175.714 0.756 18090 4873 1 13 . 1 1 40 40 GLY CA C 166 46.410 46.410 46.965 -0.555 18090 4874 1 13 . 1 1 40 40 GLY H H 166 7.590 7.590 7.626 -0.036 18090 4875 1 13 . 1 1 41 41 TYR N N 167 121.270 121.270 122.337 -1.067 18090 4876 1 13 . 1 1 41 41 TYR HA H 167 4.190 4.190 4.213 -0.023 18090 4877 1 13 . 1 1 41 41 TYR C C 167 176.470 176.470 176.220 0.250 18090 4878 1 13 . 1 1 41 41 TYR CA C 167 57.130 57.130 60.414 -3.284 18090 4879 1 13 . 1 1 41 41 TYR CB C 167 35.950 35.950 38.231 -2.281 18090 4880 1 13 . 1 1 41 41 TYR H H 167 7.350 7.350 7.915 -0.565 18090 4881 1 13 . 1 1 42 42 LYS N N 168 116.520 116.520 116.103 0.417 18090 4882 1 13 . 1 1 42 42 LYS HA H 168 3.820 3.820 4.051 -0.231 18090 4883 1 13 . 1 1 42 42 LYS C C 168 177.810 177.810 177.896 -0.086 18090 4884 1 13 . 1 1 42 42 LYS CA C 168 59.390 59.390 58.371 1.019 18090 4885 1 13 . 1 1 42 42 LYS CB C 168 31.580 31.580 32.758 -1.178 18090 4886 1 13 . 1 1 42 42 LYS H H 168 7.460 7.460 8.268 -0.808 18090 4887 1 13 . 1 1 43 43 GLN N N 169 113.750 113.750 115.962 -2.212 18090 4888 1 13 . 1 1 43 43 GLN HA H 169 4.220 4.220 4.163 0.057 18090 4889 1 13 . 1 1 43 43 GLN C C 169 175.840 175.840 177.171 -1.331 18090 4890 1 13 . 1 1 43 43 GLN CA C 169 56.230 56.230 58.214 -1.984 18090 4891 1 13 . 1 1 43 43 GLN CB C 169 29.290 29.290 29.430 -0.140 18090 4892 1 13 . 1 1 43 43 GLN H H 169 7.220 7.220 7.626 -0.406 18090 4893 1 13 . 1 1 44 44 ASN N N 170 114.130 114.130 116.215 -2.085 18090 4894 1 13 . 1 1 44 44 ASN HA H 170 5.050 5.050 4.997 0.053 18090 4895 1 13 . 1 1 44 44 ASN C C 170 172.200 172.200 173.574 -1.374 18090 4896 1 13 . 1 1 44 44 ASN CA C 170 50.780 50.780 53.368 -2.588 18090 4897 1 13 . 1 1 44 44 ASN CB C 170 38.380 38.380 40.015 -1.635 18090 4898 1 13 . 1 1 44 44 ASN H H 170 7.580 7.580 7.623 -0.043 18090 4899 1 13 . 1 1 45 45 PRO HA H 171 4.130 4.130 4.699 -0.569 18090 4900 1 13 . 1 1 45 45 PRO CA C 171 64.800 64.800 62.214 2.586 18090 4901 1 13 . 1 1 45 45 PRO CB C 171 31.360 31.360 31.775 -0.415 18090 4902 1 13 . 1 1 46 46 GLN N N 172 115.570 115.570 124.920 -9.350 18090 4903 1 13 . 1 1 46 46 GLN HA H 172 3.770 3.770 3.833 -0.063 18090 4904 1 13 . 1 1 46 46 GLN C C 172 177.360 177.360 177.605 -0.245 18090 4905 1 13 . 1 1 46 46 GLN CA C 172 57.950 57.950 58.232 -0.282 18090 4906 1 13 . 1 1 46 46 GLN CB C 172 27.050 27.050 27.660 -0.610 18090 4907 1 13 . 1 1 46 46 GLN H H 172 8.160 8.160 8.567 -0.407 18090 4908 1 13 . 1 1 47 47 ALA N N 173 121.420 121.420 121.874 -0.454 18090 4909 1 13 . 1 1 47 47 ALA HA H 173 4.050 4.050 4.163 -0.113 18090 4910 1 13 . 1 1 47 47 ALA C C 173 178.090 178.090 179.547 -1.457 18090 4911 1 13 . 1 1 47 47 ALA CA C 173 53.490 53.490 53.961 -0.471 18090 4912 1 13 . 1 1 47 47 ALA CB C 173 18.450 18.450 17.642 0.808 18090 4913 1 13 . 1 1 47 47 ALA H H 173 7.470 7.470 8.108 -0.638 18090 4914 1 13 . 1 1 48 48 ILE N N 174 118.050 118.050 118.717 -0.667 18090 4915 1 13 . 1 1 48 48 ILE HA H 174 3.180 3.180 3.898 -0.718 18090 4916 1 13 . 1 1 48 48 ILE C C 174 176.250 176.250 177.887 -1.637 18090 4917 1 13 . 1 1 48 48 ILE CA C 174 64.030 64.030 64.087 -0.057 18090 4918 1 13 . 1 1 48 48 ILE CB C 174 37.280 37.280 37.072 0.208 18090 4919 1 13 . 1 1 48 48 ILE H H 174 7.150 7.150 7.336 -0.186 18090 4920 1 13 . 1 1 49 49 GLY N N 175 105.390 105.390 106.740 -1.350 18090 4921 1 13 . 1 1 49 49 GLY C C 175 174.220 174.220 176.316 -2.096 18090 4922 1 13 . 1 1 49 49 GLY CA C 175 46.700 46.700 47.123 -0.423 18090 4923 1 13 . 1 1 49 49 GLY H H 175 7.550 7.550 7.852 -0.302 18090 4924 1 13 . 1 1 50 50 GLN N N 176 116.230 116.230 118.550 -2.320 18090 4925 1 13 . 1 1 50 50 GLN HA H 176 4.210 4.210 4.694 -0.484 18090 4926 1 13 . 1 1 50 50 GLN C C 176 178.120 178.120 178.304 -0.184 18090 4927 1 13 . 1 1 50 50 GLN CA C 176 57.320 57.320 58.039 -0.720 18090 4928 1 13 . 1 1 50 50 GLN CB C 176 28.630 28.630 28.820 -0.190 18090 4929 1 13 . 1 1 50 50 GLN H H 176 7.390 7.390 8.011 -0.621 18090 4930 1 13 . 1 1 51 51 ASP N N 177 120.000 120.000 121.231 -1.231 18090 4931 1 13 . 1 1 51 51 ASP HA H 177 4.420 4.420 4.656 -0.236 18090 4932 1 13 . 1 1 51 51 ASP C C 177 177.950 177.950 178.487 -0.537 18090 4933 1 13 . 1 1 51 51 ASP CA C 177 55.840 55.840 56.064 -0.224 18090 4934 1 13 . 1 1 51 51 ASP CB C 177 40.310 40.310 40.878 -0.568 18090 4935 1 13 . 1 1 51 51 ASP H H 177 7.870 7.870 7.965 -0.095 18090 4936 1 13 . 1 1 52 52 LEU N N 178 120.010 120.010 120.417 -0.407 18090 4937 1 13 . 1 1 52 52 LEU HA H 178 3.650 3.650 4.007 -0.357 18090 4938 1 13 . 1 1 52 52 LEU C C 178 175.810 175.810 178.726 -2.916 18090 4939 1 13 . 1 1 52 52 LEU CA C 178 57.620 57.620 57.731 -0.111 18090 4940 1 13 . 1 1 52 52 LEU CB C 178 41.880 41.880 41.766 0.114 18090 4941 1 13 . 1 1 52 52 LEU H H 178 7.860 7.860 7.641 0.219 18090 4942 1 13 . 1 1 53 53 PHE N N 179 110.580 110.580 112.303 -1.723 18090 4943 1 13 . 1 1 53 53 PHE HA H 179 4.230 4.230 4.325 -0.095 18090 4944 1 13 . 1 1 53 53 PHE C C 179 176.370 176.370 177.228 -0.858 18090 4945 1 13 . 1 1 53 53 PHE CA C 179 58.730 58.730 60.029 -1.299 18090 4946 1 13 . 1 1 53 53 PHE CB C 179 38.720 38.720 38.806 -0.086 18090 4947 1 13 . 1 1 53 53 PHE H H 179 7.210 7.210 7.924 -0.714 18090 4948 1 13 . 1 1 54 54 THR N N 180 108.190 108.190 107.385 0.805 18090 4949 1 13 . 1 1 54 54 THR HA H 180 4.300 4.300 4.312 -0.012 18090 4950 1 13 . 1 1 54 54 THR C C 180 174.400 174.400 174.544 -0.144 18090 4951 1 13 . 1 1 54 54 THR CA C 180 62.020 62.020 63.104 -1.084 18090 4952 1 13 . 1 1 54 54 THR CB C 180 69.730 69.730 69.721 0.009 18090 4953 1 13 . 1 1 54 54 THR H H 180 7.550 7.550 7.391 0.159 18090 4954 1 13 . 1 1 55 55 ASP N N 181 120.060 120.060 122.591 -2.531 18090 4955 1 13 . 1 1 55 55 ASP HA H 181 5.020 5.020 5.085 -0.065 18090 4956 1 13 . 1 1 55 55 ASP C C 181 174.120 174.120 175.040 -0.920 18090 4957 1 13 . 1 1 55 55 ASP CA C 181 50.560 50.560 50.712 -0.152 18090 4958 1 13 . 1 1 55 55 ASP CB C 181 41.190 41.190 42.931 -1.741 18090 4959 1 13 . 1 1 55 55 ASP H H 181 7.480 7.480 7.821 -0.341 18090 4960 1 13 . 1 1 56 56 PRO HA H 182 4.320 4.320 4.278 0.042 18090 4961 1 13 . 1 1 56 56 PRO CA C 182 64.280 64.280 64.865 -0.585 18090 4962 1 13 . 1 1 56 56 PRO CB C 182 31.980 31.980 32.378 -0.398 18090 4963 1 13 . 1 1 57 57 ARG N N 183 117.660 117.660 117.748 -0.088 18090 4964 1 13 . 1 1 57 57 ARG HA H 183 3.960 3.960 4.065 -0.105 18090 4965 1 13 . 1 1 57 57 ARG C C 183 179.030 179.030 178.512 0.518 18090 4966 1 13 . 1 1 57 57 ARG CA C 183 59.000 59.000 58.888 0.112 18090 4967 1 13 . 1 1 57 57 ARG CB C 183 29.750 29.750 29.507 0.243 18090 4968 1 13 . 1 1 57 57 ARG H H 183 7.920 7.920 7.995 -0.075 18090 4969 1 13 . 1 1 58 58 LEU N N 184 115.670 115.670 119.529 -3.859 18090 4970 1 13 . 1 1 58 58 LEU HA H 184 3.850 3.850 3.956 -0.106 18090 4971 1 13 . 1 1 58 58 LEU C C 184 178.770 178.770 179.105 -0.335 18090 4972 1 13 . 1 1 58 58 LEU CA C 184 57.110 57.110 57.755 -0.645 18090 4973 1 13 . 1 1 58 58 LEU CB C 184 41.310 41.310 41.598 -0.288 18090 4974 1 13 . 1 1 58 58 LEU H H 184 7.750 7.750 8.173 -0.423 18090 4975 1 13 . 1 1 59 59 MET N N 185 118.570 118.570 116.437 2.133 18090 4976 1 13 . 1 1 59 59 MET HA H 185 4.060 4.060 4.132 -0.072 18090 4977 1 13 . 1 1 59 59 MET C C 185 177.540 177.540 178.149 -0.609 18090 4978 1 13 . 1 1 59 59 MET CA C 185 58.090 58.090 59.354 -1.264 18090 4979 1 13 . 1 1 59 59 MET CB C 185 31.270 31.270 32.193 -0.923 18090 4980 1 13 . 1 1 59 59 MET H H 185 7.590 7.590 7.668 -0.078 18090 4981 1 13 . 1 1 60 60 THR N N 186 116.390 116.390 117.467 -1.077 18090 4982 1 13 . 1 1 60 60 THR HA H 186 3.680 3.680 3.994 -0.314 18090 4983 1 13 . 1 1 60 60 THR C C 186 177.440 177.440 176.381 1.059 18090 4984 1 13 . 1 1 60 60 THR CA C 186 66.940 66.940 67.304 -0.364 18090 4985 1 13 . 1 1 60 60 THR CB C 186 68.030 68.030 68.240 -0.210 18090 4986 1 13 . 1 1 60 60 THR H H 186 7.180 7.180 7.802 -0.622 18090 4987 1 13 . 1 1 61 61 ILE N N 187 123.840 123.840 122.028 1.812 18090 4988 1 13 . 1 1 61 61 ILE HA H 187 3.290 3.290 3.753 -0.463 18090 4989 1 13 . 1 1 61 61 ILE C C 187 176.660 176.660 178.073 -1.413 18090 4990 1 13 . 1 1 61 61 ILE CA C 187 65.850 65.850 65.482 0.368 18090 4991 1 13 . 1 1 61 61 ILE CB C 187 37.640 37.640 37.830 -0.189 18090 4992 1 13 . 1 1 61 61 ILE H H 187 8.010 8.010 7.787 0.223 18090 4993 1 13 . 1 1 62 62 MET N N 188 118.210 118.210 118.347 -0.137 18090 4994 1 13 . 1 1 62 62 MET HA H 188 3.910 3.910 4.007 -0.097 18090 4995 1 13 . 1 1 62 62 MET C C 188 177.540 177.540 178.425 -0.885 18090 4996 1 13 . 1 1 62 62 MET CA C 188 58.530 58.530 58.915 -0.385 18090 4997 1 13 . 1 1 62 62 MET CB C 188 31.200 31.200 31.567 -0.367 18090 4998 1 13 . 1 1 62 62 MET H H 188 8.560 8.560 7.415 1.145 18090 4999 1 13 . 1 1 63 63 ALA N N 189 119.850 119.850 122.114 -2.264 18090 5000 1 13 . 1 1 63 63 ALA HA H 189 3.730 3.730 3.907 -0.177 18090 5001 1 13 . 1 1 63 63 ALA C C 189 179.550 179.550 179.429 0.121 18090 5002 1 13 . 1 1 63 63 ALA CA C 189 55.470 55.470 55.733 -0.263 18090 5003 1 13 . 1 1 63 63 ALA CB C 189 17.640 17.640 18.153 -0.513 18090 5004 1 13 . 1 1 63 63 ALA H H 189 8.210 8.210 8.197 0.013 18090 5005 1 13 . 1 1 64 64 THR N N 190 114.570 114.570 114.040 0.530 18090 5006 1 13 . 1 1 64 64 THR HA H 190 3.790 3.790 4.159 -0.369 18090 5007 1 13 . 1 1 64 64 THR C C 190 177.640 177.640 177.166 0.474 18090 5008 1 13 . 1 1 64 64 THR CA C 190 66.690 66.690 65.531 1.159 18090 5009 1 13 . 1 1 64 64 THR CB C 190 68.310 68.310 68.221 0.089 18090 5010 1 13 . 1 1 64 64 THR H H 190 7.740 7.740 7.647 0.093 18090 5011 1 13 . 1 1 65 65 LEU N N 191 122.410 122.410 122.659 -0.249 18090 5012 1 13 . 1 1 65 65 LEU HA H 191 3.930 3.930 3.987 -0.057 18090 5013 1 13 . 1 1 65 65 LEU C C 191 178.470 178.470 179.668 -1.198 18090 5014 1 13 . 1 1 65 65 LEU CA C 191 57.120 57.120 57.953 -0.833 18090 5015 1 13 . 1 1 65 65 LEU CB C 191 41.830 41.830 41.850 -0.020 18090 5016 1 13 . 1 1 65 65 LEU H H 191 8.180 8.180 7.619 0.561 18090 5017 1 13 . 1 1 66 66 MET N N 192 115.320 115.320 117.148 -1.828 18090 5018 1 13 . 1 1 66 66 MET HA H 192 4.090 4.090 4.304 -0.214 18090 5019 1 13 . 1 1 66 66 MET C C 192 176.090 176.090 178.279 -2.189 18090 5020 1 13 . 1 1 66 66 MET CA C 192 56.390 56.390 57.401 -1.011 18090 5021 1 13 . 1 1 66 66 MET CB C 192 33.770 33.770 31.872 1.898 18090 5022 1 13 . 1 1 66 66 MET H H 192 7.880 7.880 8.501 -0.621 18090 5023 1 13 . 1 1 67 67 GLY N N 193 107.490 107.490 105.327 2.163 18090 5024 1 13 . 1 1 67 67 GLY C C 193 174.390 174.390 174.840 -0.450 18090 5025 1 13 . 1 1 67 67 GLY CA C 193 45.880 45.880 45.148 0.732 18090 5026 1 13 . 1 1 67 67 GLY H H 193 7.580 7.580 8.137 -0.557 18090 5027 1 13 . 1 1 68 68 VAL N N 194 118.520 118.520 116.481 2.039 18090 5028 1 13 . 1 1 68 68 VAL HA H 194 3.940 3.940 3.618 0.322 18090 5029 1 13 . 1 1 68 68 VAL C C 194 174.760 174.760 175.808 -1.048 18090 5030 1 13 . 1 1 68 68 VAL CA C 194 61.510 61.510 63.115 -1.605 18090 5031 1 13 . 1 1 68 68 VAL CB C 194 32.670 32.670 29.191 3.479 18090 5032 1 13 . 1 1 68 68 VAL H H 194 7.840 7.840 7.453 0.387 18090 5033 1 13 . 1 1 69 69 ASP N N 195 124.550 124.550 119.779 4.771 18090 5034 1 13 . 1 1 69 69 ASP HA H 195 4.430 4.430 4.489 -0.059 18090 5035 1 13 . 1 1 69 69 ASP C C 195 175.140 175.140 177.054 -1.914 18090 5036 1 13 . 1 1 69 69 ASP CA C 195 53.760 53.760 56.577 -2.817 18090 5037 1 13 . 1 1 69 69 ASP CB C 195 40.920 40.920 41.123 -0.203 18090 5038 1 13 . 1 1 69 69 ASP H H 195 8.400 8.400 7.988 0.412 18090 5039 1 13 . 1 1 70 70 LEU N N 196 123.930 123.930 119.358 4.572 18090 5040 1 13 . 1 1 70 70 LEU HA H 196 4.200 4.200 4.195 0.005 18090 5041 1 13 . 1 1 70 70 LEU C C 196 175.950 175.950 176.906 -0.956 18090 5042 1 13 . 1 1 70 70 LEU CA C 196 54.380 54.380 56.726 -2.346 18090 5043 1 13 . 1 1 70 70 LEU CB C 196 41.610 41.610 42.647 -1.037 18090 5044 1 13 . 1 1 70 70 LEU H H 196 8.160 8.160 7.533 0.627 18090 5045 1 14 . 1 1 2 2 PRO HA H 128 4.220 4.220 4.460 -0.240 18090 5046 1 14 . 1 1 2 2 PRO CA C 128 63.320 63.320 64.085 -0.765 18090 5047 1 14 . 1 1 2 2 PRO CB C 128 31.680 31.680 32.178 -0.498 18090 5048 1 14 . 1 1 3 3 ASP N N 129 119.320 119.320 118.588 0.732 18090 5049 1 14 . 1 1 3 3 ASP HA H 129 4.400 4.400 4.480 -0.080 18090 5050 1 14 . 1 1 3 3 ASP C C 129 176.120 176.120 176.342 -0.222 18090 5051 1 14 . 1 1 3 3 ASP CA C 129 54.050 54.050 54.640 -0.590 18090 5052 1 14 . 1 1 3 3 ASP CB C 129 40.770 40.770 40.859 -0.089 18090 5053 1 14 . 1 1 3 3 ASP H H 129 8.310 8.310 8.548 -0.238 18090 5054 1 14 . 1 1 4 4 LEU N N 130 122.280 122.280 117.153 5.127 18090 5055 1 14 . 1 1 4 4 LEU HA H 130 4.130 4.130 3.953 0.177 18090 5056 1 14 . 1 1 4 4 LEU C C 130 177.280 177.280 177.613 -0.333 18090 5057 1 14 . 1 1 4 4 LEU CA C 130 55.350 55.350 55.106 0.244 18090 5058 1 14 . 1 1 4 4 LEU CB C 130 41.490 41.490 42.189 -0.699 18090 5059 1 14 . 1 1 4 4 LEU H H 130 8.080 8.080 7.599 0.481 18090 5060 1 14 . 1 1 5 5 GLY N N 131 107.830 107.830 105.985 1.845 18090 5061 1 14 . 1 1 5 5 GLY C C 131 175.120 175.120 173.213 1.907 18090 5062 1 14 . 1 1 5 5 GLY CA C 131 45.300 45.300 45.383 -0.083 18090 5063 1 14 . 1 1 5 5 GLY H H 131 8.180 8.180 8.375 -0.195 18090 5064 1 14 . 1 1 6 6 LEU N N 132 121.080 121.080 116.307 4.773 18090 5065 1 14 . 1 1 6 6 LEU HA H 132 3.870 3.870 4.495 -0.625 18090 5066 1 14 . 1 1 6 6 LEU C C 132 178.000 178.000 177.732 0.268 18090 5067 1 14 . 1 1 6 6 LEU CA C 132 57.180 57.180 53.577 3.603 18090 5068 1 14 . 1 1 6 6 LEU CB C 132 41.870 41.870 44.521 -2.651 18090 5069 1 14 . 1 1 6 6 LEU H H 132 8.150 8.150 7.441 0.709 18090 5070 1 14 . 1 1 7 7 THR N N 133 111.580 111.580 113.402 -1.822 18090 5071 1 14 . 1 1 7 7 THR HA H 133 3.730 3.730 3.984 -0.254 18090 5072 1 14 . 1 1 7 7 THR C C 133 176.530 176.530 176.162 0.368 18090 5073 1 14 . 1 1 7 7 THR CA C 133 65.940 65.940 66.113 -0.173 18090 5074 1 14 . 1 1 7 7 THR CB C 133 68.130 68.130 68.749 -0.619 18090 5075 1 14 . 1 1 7 7 THR H H 133 7.970 7.970 8.678 -0.708 18090 5076 1 14 . 1 1 8 8 GLN N N 134 119.490 119.490 121.217 -1.727 18090 5077 1 14 . 1 1 8 8 GLN HA H 134 3.990 3.990 3.917 0.073 18090 5078 1 14 . 1 1 8 8 GLN C C 134 178.190 178.190 178.200 -0.010 18090 5079 1 14 . 1 1 8 8 GLN CA C 134 57.930 57.930 58.673 -0.743 18090 5080 1 14 . 1 1 8 8 GLN CB C 134 27.850 27.850 27.964 -0.114 18090 5081 1 14 . 1 1 8 8 GLN H H 134 7.890 7.890 8.407 -0.517 18090 5082 1 14 . 1 1 9 9 LEU N N 135 120.170 120.170 118.363 1.807 18090 5083 1 14 . 1 1 9 9 LEU HA H 135 3.820 3.820 3.945 -0.125 18090 5084 1 14 . 1 1 9 9 LEU C C 135 177.810 177.810 178.619 -0.809 18090 5085 1 14 . 1 1 9 9 LEU CA C 135 57.470 57.470 57.202 0.268 18090 5086 1 14 . 1 1 9 9 LEU CB C 135 41.640 41.640 41.869 -0.229 18090 5087 1 14 . 1 1 9 9 LEU H H 135 7.600 7.600 7.254 0.346 18090 5088 1 14 . 1 1 10 10 PHE N N 136 111.950 111.950 113.607 -1.657 18090 5089 1 14 . 1 1 10 10 PHE HA H 136 4.380 4.380 4.479 -0.099 18090 5090 1 14 . 1 1 10 10 PHE C C 136 174.990 174.990 177.440 -2.450 18090 5091 1 14 . 1 1 10 10 PHE CA C 136 58.450 58.450 57.624 0.826 18090 5092 1 14 . 1 1 10 10 PHE CB C 136 38.570 38.570 37.773 0.797 18090 5093 1 14 . 1 1 10 10 PHE H H 136 7.410 7.410 6.575 0.835 18090 5094 1 14 . 1 1 11 11 ALA N N 137 120.230 120.230 122.720 -2.490 18090 5095 1 14 . 1 1 11 11 ALA HA H 137 4.130 4.130 4.162 -0.032 18090 5096 1 14 . 1 1 11 11 ALA C C 137 177.090 177.090 178.184 -1.094 18090 5097 1 14 . 1 1 11 11 ALA CA C 137 52.580 52.580 53.597 -1.017 18090 5098 1 14 . 1 1 11 11 ALA CB C 137 18.660 18.660 18.648 0.013 18090 5099 1 14 . 1 1 11 11 ALA H H 137 7.330 7.330 8.624 -1.294 18090 5100 1 14 . 1 1 12 12 ASP N N 138 119.830 119.830 120.927 -1.097 18090 5101 1 14 . 1 1 12 12 ASP HA H 138 4.510 4.510 4.712 -0.202 18090 5102 1 14 . 1 1 12 12 ASP C C 138 176.370 176.370 174.769 1.601 18090 5103 1 14 . 1 1 12 12 ASP CA C 138 51.960 51.960 52.962 -1.002 18090 5104 1 14 . 1 1 12 12 ASP CB C 138 41.990 41.990 41.588 0.402 18090 5105 1 14 . 1 1 12 12 ASP H H 138 6.980 6.980 7.616 -0.636 18090 5106 1 14 . 1 1 13 13 PRO HA H 139 4.260 4.260 4.372 -0.112 18090 5107 1 14 . 1 1 13 13 PRO CA C 139 64.350 64.350 62.846 1.504 18090 5108 1 14 . 1 1 13 13 PRO CB C 139 31.760 31.760 32.377 -0.616 18090 5109 1 14 . 1 1 14 14 ASN N N 140 116.840 116.840 117.588 -0.748 18090 5110 1 14 . 1 1 14 14 ASN HA H 140 4.840 4.840 4.481 0.359 18090 5111 1 14 . 1 1 14 14 ASN C C 140 173.840 173.840 175.360 -1.520 18090 5112 1 14 . 1 1 14 14 ASN CA C 140 52.380 52.380 54.185 -1.805 18090 5113 1 14 . 1 1 14 14 ASN CB C 140 38.330 38.330 37.020 1.310 18090 5114 1 14 . 1 1 14 14 ASN H H 140 8.670 8.670 8.677 -0.007 18090 5115 1 14 . 1 1 15 15 LEU N N 141 120.290 120.290 120.440 -0.150 18090 5116 1 14 . 1 1 15 15 LEU HA H 141 3.790 3.790 4.536 -0.746 18090 5117 1 14 . 1 1 15 15 LEU C C 141 177.120 177.120 177.516 -0.396 18090 5118 1 14 . 1 1 15 15 LEU CA C 141 59.280 59.280 55.605 3.675 18090 5119 1 14 . 1 1 15 15 LEU CB C 141 42.980 42.980 43.160 -0.180 18090 5120 1 14 . 1 1 15 15 LEU H H 141 7.200 7.200 8.421 -1.221 18090 5121 1 14 . 1 1 16 16 ILE N N 142 115.290 115.290 120.227 -4.937 18090 5122 1 14 . 1 1 16 16 ILE HA H 142 3.480 3.480 3.726 -0.246 18090 5123 1 14 . 1 1 16 16 ILE C C 142 177.990 177.990 177.492 0.498 18090 5124 1 14 . 1 1 16 16 ILE CA C 142 62.690 62.690 65.320 -2.630 18090 5125 1 14 . 1 1 16 16 ILE CB C 142 34.620 34.620 37.643 -3.023 18090 5126 1 14 . 1 1 16 16 ILE H H 142 7.940 7.940 8.291 -0.351 18090 5127 1 14 . 1 1 17 17 GLU N N 143 119.600 119.600 119.046 0.554 18090 5128 1 14 . 1 1 17 17 GLU HA H 143 3.700 3.700 3.993 -0.293 18090 5129 1 14 . 1 1 17 17 GLU C C 143 179.170 179.170 178.730 0.440 18090 5130 1 14 . 1 1 17 17 GLU CA C 143 59.360 59.360 60.085 -0.725 18090 5131 1 14 . 1 1 17 17 GLU CB C 143 28.520 28.520 29.214 -0.694 18090 5132 1 14 . 1 1 17 17 GLU H H 143 7.970 7.970 8.542 -0.572 18090 5133 1 14 . 1 1 18 18 ASN N N 144 117.170 117.170 117.846 -0.676 18090 5134 1 14 . 1 1 18 18 ASN HA H 144 4.270 4.270 4.448 -0.178 18090 5135 1 14 . 1 1 18 18 ASN C C 144 179.120 179.120 177.802 1.318 18090 5136 1 14 . 1 1 18 18 ASN CA C 144 55.490 55.490 55.633 -0.143 18090 5137 1 14 . 1 1 18 18 ASN CB C 144 36.550 36.550 37.794 -1.244 18090 5138 1 14 . 1 1 18 18 ASN H H 144 8.450 8.450 8.371 0.079 18090 5139 1 14 . 1 1 19 19 LEU N N 145 121.060 121.060 119.026 2.034 18090 5140 1 14 . 1 1 19 19 LEU HA H 145 4.020 4.020 4.026 -0.006 18090 5141 1 14 . 1 1 19 19 LEU C C 145 180.260 180.260 178.158 2.102 18090 5142 1 14 . 1 1 19 19 LEU CA C 145 56.620 56.620 57.048 -0.428 18090 5143 1 14 . 1 1 19 19 LEU CB C 145 41.780 41.780 41.513 0.267 18090 5144 1 14 . 1 1 19 19 LEU H H 145 7.990 7.990 7.538 0.452 18090 5145 1 14 . 1 1 20 20 LYS N N 146 118.960 118.960 117.563 1.397 18090 5146 1 14 . 1 1 20 20 LYS HA H 146 3.610 3.610 3.936 -0.326 18090 5147 1 14 . 1 1 20 20 LYS C C 146 177.390 177.390 178.294 -0.904 18090 5148 1 14 . 1 1 20 20 LYS CA C 146 59.640 59.640 59.344 0.296 18090 5149 1 14 . 1 1 20 20 LYS CB C 146 32.450 32.450 32.370 0.080 18090 5150 1 14 . 1 1 20 20 LYS H H 146 8.250 8.250 7.845 0.405 18090 5151 1 14 . 1 1 21 21 LYS N N 147 114.720 114.720 116.606 -1.886 18090 5152 1 14 . 1 1 21 21 LYS HA H 147 4.110 4.110 4.191 -0.081 18090 5153 1 14 . 1 1 21 21 LYS C C 147 175.880 175.880 178.551 -2.671 18090 5154 1 14 . 1 1 21 21 LYS CA C 147 56.210 56.210 58.254 -2.044 18090 5155 1 14 . 1 1 21 21 LYS CB C 147 33.000 33.000 32.625 0.375 18090 5156 1 14 . 1 1 21 21 LYS H H 147 7.130 7.130 7.603 -0.473 18090 5157 1 14 . 1 1 22 22 ASN N N 148 122.180 122.180 115.417 6.763 18090 5158 1 14 . 1 1 22 22 ASN HA H 148 4.740 4.740 4.915 -0.175 18090 5159 1 14 . 1 1 22 22 ASN C C 148 174.000 174.000 173.512 0.488 18090 5160 1 14 . 1 1 22 22 ASN CA C 148 50.970 50.970 52.702 -1.732 18090 5161 1 14 . 1 1 22 22 ASN CB C 148 38.670 38.670 38.959 -0.289 18090 5162 1 14 . 1 1 22 22 ASN H H 148 6.930 6.930 7.898 -0.968 18090 5163 1 14 . 1 1 23 23 PRO HA H 149 4.300 4.300 4.697 -0.397 18090 5164 1 14 . 1 1 23 23 PRO CA C 149 64.610 64.610 61.993 2.617 18090 5165 1 14 . 1 1 23 23 PRO CB C 149 32.000 32.000 34.162 -2.162 18090 5166 1 14 . 1 1 24 24 LYS N N 150 116.060 116.060 121.306 -5.246 18090 5167 1 14 . 1 1 24 24 LYS HA H 150 4.070 4.070 3.978 0.092 18090 5168 1 14 . 1 1 24 24 LYS C C 150 178.240 178.240 178.600 -0.360 18090 5169 1 14 . 1 1 24 24 LYS CA C 150 57.950 57.950 59.742 -1.792 18090 5170 1 14 . 1 1 24 24 LYS CB C 150 32.590 32.590 31.958 0.632 18090 5171 1 14 . 1 1 24 24 LYS H H 150 8.520 8.520 8.804 -0.284 18090 5172 1 14 . 1 1 25 25 THR N N 151 105.190 105.190 110.662 -5.472 18090 5173 1 14 . 1 1 25 25 THR HA H 151 4.390 4.390 4.041 0.349 18090 5174 1 14 . 1 1 25 25 THR C C 151 176.090 176.090 176.217 -0.127 18090 5175 1 14 . 1 1 25 25 THR CA C 151 61.400 61.400 64.969 -3.569 18090 5176 1 14 . 1 1 25 25 THR CB C 151 69.440 69.440 68.234 1.206 18090 5177 1 14 . 1 1 25 25 THR H H 151 7.490 7.490 8.130 -0.640 18090 5178 1 14 . 1 1 26 26 SER N N 152 119.700 119.700 116.474 3.226 18090 5179 1 14 . 1 1 26 26 SER HA H 152 3.770 3.770 4.144 -0.374 18090 5180 1 14 . 1 1 26 26 SER C C 152 177.470 177.470 176.018 1.452 18090 5181 1 14 . 1 1 26 26 SER CA C 152 62.450 62.450 61.395 1.055 18090 5182 1 14 . 1 1 26 26 SER CB C 152 62.520 62.520 62.755 -0.235 18090 5183 1 14 . 1 1 26 26 SER H H 152 8.190 8.190 7.945 0.245 18090 5184 1 14 . 1 1 27 27 GLU N N 153 119.870 119.870 122.634 -2.764 18090 5185 1 14 . 1 1 27 27 GLU HA H 153 3.890 3.890 3.971 -0.081 18090 5186 1 14 . 1 1 27 27 GLU C C 153 180.040 180.040 178.697 1.343 18090 5187 1 14 . 1 1 27 27 GLU CA C 153 58.700 58.700 59.376 -0.676 18090 5188 1 14 . 1 1 27 27 GLU CB C 153 28.590 28.590 29.450 -0.860 18090 5189 1 14 . 1 1 27 27 GLU H H 153 8.350 8.350 7.897 0.453 18090 5190 1 14 . 1 1 28 28 MET N N 154 119.430 119.430 117.061 2.369 18090 5191 1 14 . 1 1 28 28 MET HA H 154 4.040 4.040 4.168 -0.128 18090 5192 1 14 . 1 1 28 28 MET C C 154 177.110 177.110 178.147 -1.037 18090 5193 1 14 . 1 1 28 28 MET CA C 154 58.510 58.510 58.673 -0.163 18090 5194 1 14 . 1 1 28 28 MET CB C 154 31.430 31.430 32.743 -1.313 18090 5195 1 14 . 1 1 28 28 MET H H 154 7.850 7.850 7.579 0.271 18090 5196 1 14 . 1 1 29 29 MET N N 155 112.640 112.640 114.229 -1.589 18090 5197 1 14 . 1 1 29 29 MET HA H 155 4.340 4.340 4.256 0.084 18090 5198 1 14 . 1 1 29 29 MET C C 155 175.530 175.530 177.820 -2.290 18090 5199 1 14 . 1 1 29 29 MET CA C 155 53.790 53.790 57.156 -3.366 18090 5200 1 14 . 1 1 29 29 MET CB C 155 30.380 30.380 32.041 -1.661 18090 5201 1 14 . 1 1 29 29 MET H H 155 7.200 7.200 7.367 -0.167 18090 5202 1 14 . 1 1 30 30 LYS N N 156 117.050 117.050 116.916 0.134 18090 5203 1 14 . 1 1 30 30 LYS HA H 156 3.960 3.960 4.263 -0.303 18090 5204 1 14 . 1 1 30 30 LYS C C 156 176.120 176.120 177.058 -0.938 18090 5205 1 14 . 1 1 30 30 LYS CA C 156 57.090 57.090 57.339 -0.249 18090 5206 1 14 . 1 1 30 30 LYS CB C 156 31.960 31.960 32.967 -1.007 18090 5207 1 14 . 1 1 30 30 LYS H H 156 7.130 7.130 7.643 -0.513 18090 5208 1 14 . 1 1 31 31 ASP N N 157 119.810 119.810 118.147 1.663 18090 5209 1 14 . 1 1 31 31 ASP HA H 157 4.860 4.860 4.912 -0.052 18090 5210 1 14 . 1 1 31 31 ASP C C 157 174.890 174.890 174.354 0.536 18090 5211 1 14 . 1 1 31 31 ASP CA C 157 50.520 50.520 54.335 -3.815 18090 5212 1 14 . 1 1 31 31 ASP CB C 157 41.010 41.010 40.544 0.466 18090 5213 1 14 . 1 1 31 31 ASP H H 157 7.340 7.340 7.774 -0.434 18090 5214 1 14 . 1 1 32 32 PRO HA H 158 4.130 4.130 4.466 -0.336 18090 5215 1 14 . 1 1 32 32 PRO CA C 158 64.270 64.270 62.812 1.458 18090 5216 1 14 . 1 1 32 32 PRO CB C 158 31.770 31.770 32.430 -0.660 18090 5217 1 14 . 1 1 33 33 GLN N N 159 117.760 117.760 120.258 -2.498 18090 5218 1 14 . 1 1 33 33 GLN HA H 159 4.000 4.000 4.040 -0.040 18090 5219 1 14 . 1 1 33 33 GLN C C 159 178.740 178.740 177.949 0.791 18090 5220 1 14 . 1 1 33 33 GLN CA C 159 58.220 58.220 58.056 0.165 18090 5221 1 14 . 1 1 33 33 GLN CB C 159 27.870 27.870 28.078 -0.208 18090 5222 1 14 . 1 1 33 33 GLN H H 159 8.150 8.150 8.769 -0.619 18090 5223 1 14 . 1 1 34 34 LEU N N 160 123.300 123.300 120.054 3.246 18090 5224 1 14 . 1 1 34 34 LEU HA H 160 3.970 3.970 4.009 -0.039 18090 5225 1 14 . 1 1 34 34 LEU C C 160 177.980 177.980 178.160 -0.180 18090 5226 1 14 . 1 1 34 34 LEU CA C 160 57.050 57.050 57.272 -0.222 18090 5227 1 14 . 1 1 34 34 LEU CB C 160 40.760 40.760 41.668 -0.908 18090 5228 1 14 . 1 1 34 34 LEU H H 160 7.110 7.110 7.985 -0.875 18090 5229 1 14 . 1 1 35 35 VAL N N 161 118.390 118.390 119.395 -1.005 18090 5230 1 14 . 1 1 35 35 VAL HA H 161 3.110 3.110 3.498 -0.388 18090 5231 1 14 . 1 1 35 35 VAL C C 161 176.840 176.840 177.665 -0.825 18090 5232 1 14 . 1 1 35 35 VAL CA C 161 67.700 67.700 66.962 0.738 18090 5233 1 14 . 1 1 35 35 VAL CB C 161 31.260 31.260 31.328 -0.068 18090 5234 1 14 . 1 1 35 35 VAL H H 161 7.430 7.430 7.413 0.017 18090 5235 1 14 . 1 1 36 36 ALA N N 162 117.600 117.600 121.244 -3.644 18090 5236 1 14 . 1 1 36 36 ALA HA H 162 3.810 3.810 3.949 -0.139 18090 5237 1 14 . 1 1 36 36 ALA C C 162 180.620 180.620 179.619 1.001 18090 5238 1 14 . 1 1 36 36 ALA CA C 162 54.720 54.720 55.325 -0.605 18090 5239 1 14 . 1 1 36 36 ALA CB C 162 17.490 17.490 18.110 -0.620 18090 5240 1 14 . 1 1 36 36 ALA H H 162 7.500 7.500 7.783 -0.283 18090 5241 1 14 . 1 1 37 37 LYS N N 163 119.880 119.880 118.528 1.352 18090 5242 1 14 . 1 1 37 37 LYS HA H 163 3.570 3.570 3.986 -0.416 18090 5243 1 14 . 1 1 37 37 LYS C C 163 177.800 177.800 179.111 -1.311 18090 5244 1 14 . 1 1 37 37 LYS CA C 163 58.880 58.880 58.938 -0.058 18090 5245 1 14 . 1 1 37 37 LYS CB C 163 31.610 31.610 32.034 -0.424 18090 5246 1 14 . 1 1 37 37 LYS H H 163 7.350 7.350 7.417 -0.067 18090 5247 1 14 . 1 1 38 38 LEU N N 164 118.020 118.020 119.980 -1.960 18090 5248 1 14 . 1 1 38 38 LEU HA H 164 3.670 3.670 4.068 -0.398 18090 5249 1 14 . 1 1 38 38 LEU C C 164 179.380 179.380 179.248 0.132 18090 5250 1 14 . 1 1 38 38 LEU CA C 164 57.340 57.340 57.755 -0.415 18090 5251 1 14 . 1 1 38 38 LEU CB C 164 41.660 41.660 41.710 -0.050 18090 5252 1 14 . 1 1 38 38 LEU H H 164 7.660 7.660 8.129 -0.469 18090 5253 1 14 . 1 1 39 39 ILE N N 165 118.070 118.070 118.212 -0.142 18090 5254 1 14 . 1 1 39 39 ILE HA H 165 3.510 3.510 3.648 -0.138 18090 5255 1 14 . 1 1 39 39 ILE C C 165 179.570 179.570 178.209 1.361 18090 5256 1 14 . 1 1 39 39 ILE CA C 165 64.450 64.450 65.475 -1.025 18090 5257 1 14 . 1 1 39 39 ILE CB C 165 37.310 37.310 37.463 -0.153 18090 5258 1 14 . 1 1 39 39 ILE H H 165 8.030 8.030 7.964 0.066 18090 5259 1 14 . 1 1 40 40 GLY N N 166 107.970 107.970 108.041 -0.071 18090 5260 1 14 . 1 1 40 40 GLY C C 166 176.470 176.470 175.697 0.773 18090 5261 1 14 . 1 1 40 40 GLY CA C 166 46.410 46.410 46.954 -0.544 18090 5262 1 14 . 1 1 40 40 GLY H H 166 7.590 7.590 7.623 -0.033 18090 5263 1 14 . 1 1 41 41 TYR N N 167 121.270 121.270 122.321 -1.051 18090 5264 1 14 . 1 1 41 41 TYR HA H 167 4.190 4.190 4.212 -0.022 18090 5265 1 14 . 1 1 41 41 TYR C C 167 176.470 176.470 176.190 0.280 18090 5266 1 14 . 1 1 41 41 TYR CA C 167 57.130 57.130 60.365 -3.235 18090 5267 1 14 . 1 1 41 41 TYR CB C 167 35.950 35.950 38.214 -2.264 18090 5268 1 14 . 1 1 41 41 TYR H H 167 7.350 7.350 7.906 -0.556 18090 5269 1 14 . 1 1 42 42 LYS N N 168 116.520 116.520 116.076 0.444 18090 5270 1 14 . 1 1 42 42 LYS HA H 168 3.820 3.820 4.047 -0.227 18090 5271 1 14 . 1 1 42 42 LYS C C 168 177.810 177.810 177.892 -0.082 18090 5272 1 14 . 1 1 42 42 LYS CA C 168 59.390 59.390 58.339 1.051 18090 5273 1 14 . 1 1 42 42 LYS CB C 168 31.580 31.580 32.764 -1.184 18090 5274 1 14 . 1 1 42 42 LYS H H 168 7.460 7.460 8.254 -0.794 18090 5275 1 14 . 1 1 43 43 GLN N N 169 113.750 113.750 116.063 -2.313 18090 5276 1 14 . 1 1 43 43 GLN HA H 169 4.220 4.220 4.153 0.067 18090 5277 1 14 . 1 1 43 43 GLN C C 169 175.840 175.840 177.398 -1.558 18090 5278 1 14 . 1 1 43 43 GLN CA C 169 56.230 56.230 58.096 -1.866 18090 5279 1 14 . 1 1 43 43 GLN CB C 169 29.290 29.290 29.320 -0.030 18090 5280 1 14 . 1 1 43 43 GLN H H 169 7.220 7.220 7.644 -0.424 18090 5281 1 14 . 1 1 44 44 ASN N N 170 114.130 114.130 116.241 -2.111 18090 5282 1 14 . 1 1 44 44 ASN HA H 170 5.050 5.050 4.940 0.110 18090 5283 1 14 . 1 1 44 44 ASN C C 170 172.200 172.200 173.619 -1.419 18090 5284 1 14 . 1 1 44 44 ASN CA C 170 50.780 50.780 53.396 -2.616 18090 5285 1 14 . 1 1 44 44 ASN CB C 170 38.380 38.380 39.534 -1.154 18090 5286 1 14 . 1 1 44 44 ASN H H 170 7.580 7.580 7.686 -0.106 18090 5287 1 14 . 1 1 45 45 PRO HA H 171 4.130 4.130 4.687 -0.557 18090 5288 1 14 . 1 1 45 45 PRO CA C 171 64.800 64.800 62.082 2.718 18090 5289 1 14 . 1 1 45 45 PRO CB C 171 31.360 31.360 31.919 -0.558 18090 5290 1 14 . 1 1 46 46 GLN N N 172 115.570 115.570 124.890 -9.320 18090 5291 1 14 . 1 1 46 46 GLN HA H 172 3.770 3.770 3.832 -0.062 18090 5292 1 14 . 1 1 46 46 GLN C C 172 177.360 177.360 177.602 -0.242 18090 5293 1 14 . 1 1 46 46 GLN CA C 172 57.950 57.950 58.225 -0.275 18090 5294 1 14 . 1 1 46 46 GLN CB C 172 27.050 27.050 27.663 -0.613 18090 5295 1 14 . 1 1 46 46 GLN H H 172 8.160 8.160 8.562 -0.402 18090 5296 1 14 . 1 1 47 47 ALA N N 173 121.420 121.420 121.834 -0.414 18090 5297 1 14 . 1 1 47 47 ALA HA H 173 4.050 4.050 4.168 -0.118 18090 5298 1 14 . 1 1 47 47 ALA C C 173 178.090 178.090 179.542 -1.452 18090 5299 1 14 . 1 1 47 47 ALA CA C 173 53.490 53.490 53.941 -0.451 18090 5300 1 14 . 1 1 47 47 ALA CB C 173 18.450 18.450 17.645 0.805 18090 5301 1 14 . 1 1 47 47 ALA H H 173 7.470 7.470 8.110 -0.640 18090 5302 1 14 . 1 1 48 48 ILE N N 174 118.050 118.050 118.724 -0.674 18090 5303 1 14 . 1 1 48 48 ILE HA H 174 3.180 3.180 3.897 -0.717 18090 5304 1 14 . 1 1 48 48 ILE C C 174 176.250 176.250 177.891 -1.641 18090 5305 1 14 . 1 1 48 48 ILE CA C 174 64.030 64.030 64.089 -0.059 18090 5306 1 14 . 1 1 48 48 ILE CB C 174 37.280 37.280 37.078 0.202 18090 5307 1 14 . 1 1 48 48 ILE H H 174 7.150 7.150 7.332 -0.182 18090 5308 1 14 . 1 1 49 49 GLY N N 175 105.390 105.390 106.542 -1.152 18090 5309 1 14 . 1 1 49 49 GLY C C 175 174.220 174.220 175.984 -1.764 18090 5310 1 14 . 1 1 49 49 GLY CA C 175 46.700 46.700 47.032 -0.332 18090 5311 1 14 . 1 1 49 49 GLY H H 175 7.550 7.550 7.798 -0.248 18090 5312 1 14 . 1 1 50 50 GLN N N 176 116.230 116.230 118.619 -2.389 18090 5313 1 14 . 1 1 50 50 GLN HA H 176 4.210 4.210 4.599 -0.389 18090 5314 1 14 . 1 1 50 50 GLN C C 176 178.120 178.120 178.282 -0.162 18090 5315 1 14 . 1 1 50 50 GLN CA C 176 57.320 57.320 57.999 -0.679 18090 5316 1 14 . 1 1 50 50 GLN CB C 176 28.630 28.630 29.218 -0.588 18090 5317 1 14 . 1 1 50 50 GLN H H 176 7.390 7.390 7.973 -0.583 18090 5318 1 14 . 1 1 51 51 ASP N N 177 120.000 120.000 121.000 -1.000 18090 5319 1 14 . 1 1 51 51 ASP HA H 177 4.420 4.420 4.641 -0.221 18090 5320 1 14 . 1 1 51 51 ASP C C 177 177.950 177.950 178.321 -0.371 18090 5321 1 14 . 1 1 51 51 ASP CA C 177 55.840 55.840 56.000 -0.160 18090 5322 1 14 . 1 1 51 51 ASP CB C 177 40.310 40.310 40.846 -0.536 18090 5323 1 14 . 1 1 51 51 ASP H H 177 7.870 7.870 7.926 -0.056 18090 5324 1 14 . 1 1 52 52 LEU N N 178 120.010 120.010 120.458 -0.448 18090 5325 1 14 . 1 1 52 52 LEU HA H 178 3.650 3.650 3.971 -0.321 18090 5326 1 14 . 1 1 52 52 LEU C C 178 175.810 175.810 178.260 -2.450 18090 5327 1 14 . 1 1 52 52 LEU CA C 178 57.620 57.620 57.841 -0.221 18090 5328 1 14 . 1 1 52 52 LEU CB C 178 41.880 41.880 41.673 0.207 18090 5329 1 14 . 1 1 52 52 LEU H H 178 7.860 7.860 7.633 0.227 18090 5330 1 14 . 1 1 53 53 PHE N N 179 110.580 110.580 111.841 -1.261 18090 5331 1 14 . 1 1 53 53 PHE HA H 179 4.230 4.230 4.313 -0.083 18090 5332 1 14 . 1 1 53 53 PHE C C 179 176.370 176.370 177.602 -1.232 18090 5333 1 14 . 1 1 53 53 PHE CA C 179 58.730 58.730 60.198 -1.468 18090 5334 1 14 . 1 1 53 53 PHE CB C 179 38.720 38.720 38.859 -0.139 18090 5335 1 14 . 1 1 53 53 PHE H H 179 7.210 7.210 7.892 -0.682 18090 5336 1 14 . 1 1 54 54 THR N N 180 108.190 108.190 109.589 -1.399 18090 5337 1 14 . 1 1 54 54 THR HA H 180 4.300 4.300 4.268 0.032 18090 5338 1 14 . 1 1 54 54 THR C C 180 174.400 174.400 175.380 -0.980 18090 5339 1 14 . 1 1 54 54 THR CA C 180 62.020 62.020 62.600 -0.580 18090 5340 1 14 . 1 1 54 54 THR CB C 180 69.730 69.730 70.094 -0.364 18090 5341 1 14 . 1 1 54 54 THR H H 180 7.550 7.550 7.459 0.091 18090 5342 1 14 . 1 1 55 55 ASP N N 181 120.060 120.060 123.270 -3.210 18090 5343 1 14 . 1 1 55 55 ASP HA H 181 5.020 5.020 5.100 -0.080 18090 5344 1 14 . 1 1 55 55 ASP C C 181 174.120 174.120 175.360 -1.240 18090 5345 1 14 . 1 1 55 55 ASP CA C 181 50.560 50.560 50.869 -0.309 18090 5346 1 14 . 1 1 55 55 ASP CB C 181 41.190 41.190 43.046 -1.856 18090 5347 1 14 . 1 1 55 55 ASP H H 181 7.480 7.480 8.022 -0.542 18090 5348 1 14 . 1 1 56 56 PRO HA H 182 4.320 4.320 4.339 -0.019 18090 5349 1 14 . 1 1 56 56 PRO CA C 182 64.280 64.280 64.844 -0.564 18090 5350 1 14 . 1 1 56 56 PRO CB C 182 31.980 31.980 32.531 -0.551 18090 5351 1 14 . 1 1 57 57 ARG N N 183 117.660 117.660 118.612 -0.952 18090 5352 1 14 . 1 1 57 57 ARG HA H 183 3.960 3.960 4.100 -0.140 18090 5353 1 14 . 1 1 57 57 ARG C C 183 179.030 179.030 178.594 0.436 18090 5354 1 14 . 1 1 57 57 ARG CA C 183 59.000 59.000 58.819 0.180 18090 5355 1 14 . 1 1 57 57 ARG CB C 183 29.750 29.750 29.334 0.416 18090 5356 1 14 . 1 1 57 57 ARG H H 183 7.920 7.920 8.162 -0.242 18090 5357 1 14 . 1 1 58 58 LEU N N 184 115.670 115.670 119.534 -3.864 18090 5358 1 14 . 1 1 58 58 LEU HA H 184 3.850 3.850 3.961 -0.111 18090 5359 1 14 . 1 1 58 58 LEU C C 184 178.770 178.770 179.097 -0.327 18090 5360 1 14 . 1 1 58 58 LEU CA C 184 57.110 57.110 57.730 -0.620 18090 5361 1 14 . 1 1 58 58 LEU CB C 184 41.310 41.310 41.605 -0.295 18090 5362 1 14 . 1 1 58 58 LEU H H 184 7.750 7.750 8.177 -0.427 18090 5363 1 14 . 1 1 59 59 MET N N 185 118.570 118.570 116.269 2.301 18090 5364 1 14 . 1 1 59 59 MET HA H 185 4.060 4.060 4.124 -0.064 18090 5365 1 14 . 1 1 59 59 MET C C 185 177.540 177.540 178.194 -0.654 18090 5366 1 14 . 1 1 59 59 MET CA C 185 58.090 58.090 59.274 -1.184 18090 5367 1 14 . 1 1 59 59 MET CB C 185 31.270 31.270 32.277 -1.007 18090 5368 1 14 . 1 1 59 59 MET H H 185 7.590 7.590 7.707 -0.117 18090 5369 1 14 . 1 1 60 60 THR N N 186 116.390 116.390 117.856 -1.466 18090 5370 1 14 . 1 1 60 60 THR HA H 186 3.680 3.680 3.951 -0.272 18090 5371 1 14 . 1 1 60 60 THR C C 186 177.440 177.440 176.603 0.837 18090 5372 1 14 . 1 1 60 60 THR CA C 186 66.940 66.940 66.610 0.330 18090 5373 1 14 . 1 1 60 60 THR CB C 186 68.030 68.030 68.440 -0.410 18090 5374 1 14 . 1 1 60 60 THR H H 186 7.180 7.180 7.756 -0.576 18090 5375 1 14 . 1 1 61 61 ILE N N 187 123.840 123.840 122.142 1.698 18090 5376 1 14 . 1 1 61 61 ILE HA H 187 3.290 3.290 3.753 -0.463 18090 5377 1 14 . 1 1 61 61 ILE C C 187 176.660 176.660 178.210 -1.550 18090 5378 1 14 . 1 1 61 61 ILE CA C 187 65.850 65.850 65.589 0.261 18090 5379 1 14 . 1 1 61 61 ILE CB C 187 37.640 37.640 37.902 -0.262 18090 5380 1 14 . 1 1 61 61 ILE H H 187 8.010 8.010 7.836 0.174 18090 5381 1 14 . 1 1 62 62 MET N N 188 118.210 118.210 118.312 -0.102 18090 5382 1 14 . 1 1 62 62 MET HA H 188 3.910 3.910 4.000 -0.090 18090 5383 1 14 . 1 1 62 62 MET C C 188 177.540 177.540 178.425 -0.885 18090 5384 1 14 . 1 1 62 62 MET CA C 188 58.530 58.530 58.910 -0.380 18090 5385 1 14 . 1 1 62 62 MET CB C 188 31.200 31.200 31.544 -0.344 18090 5386 1 14 . 1 1 62 62 MET H H 188 8.560 8.560 7.420 1.140 18090 5387 1 14 . 1 1 63 63 ALA N N 189 119.850 119.850 122.234 -2.384 18090 5388 1 14 . 1 1 63 63 ALA HA H 189 3.730 3.730 3.893 -0.163 18090 5389 1 14 . 1 1 63 63 ALA C C 189 179.550 179.550 179.292 0.258 18090 5390 1 14 . 1 1 63 63 ALA CA C 189 55.470 55.470 55.454 0.016 18090 5391 1 14 . 1 1 63 63 ALA CB C 189 17.640 17.640 18.208 -0.568 18090 5392 1 14 . 1 1 63 63 ALA H H 189 8.210 8.210 8.265 -0.055 18090 5393 1 14 . 1 1 64 64 THR N N 190 114.570 114.570 113.665 0.905 18090 5394 1 14 . 1 1 64 64 THR HA H 190 3.790 3.790 3.961 -0.171 18090 5395 1 14 . 1 1 64 64 THR C C 190 177.640 177.640 176.724 0.916 18090 5396 1 14 . 1 1 64 64 THR CA C 190 66.690 66.690 66.190 0.500 18090 5397 1 14 . 1 1 64 64 THR CB C 190 68.310 68.310 68.560 -0.250 18090 5398 1 14 . 1 1 64 64 THR H H 190 7.740 7.740 7.625 0.115 18090 5399 1 14 . 1 1 65 65 LEU N N 191 122.410 122.410 122.034 0.376 18090 5400 1 14 . 1 1 65 65 LEU HA H 191 3.930 3.930 3.957 -0.027 18090 5401 1 14 . 1 1 65 65 LEU C C 191 178.470 178.470 179.531 -1.061 18090 5402 1 14 . 1 1 65 65 LEU CA C 191 57.120 57.120 58.163 -1.043 18090 5403 1 14 . 1 1 65 65 LEU CB C 191 41.830 41.830 41.739 0.091 18090 5404 1 14 . 1 1 65 65 LEU H H 191 8.180 8.180 7.652 0.528 18090 5405 1 14 . 1 1 66 66 MET N N 192 115.320 115.320 117.236 -1.916 18090 5406 1 14 . 1 1 66 66 MET HA H 192 4.090 4.090 4.303 -0.213 18090 5407 1 14 . 1 1 66 66 MET C C 192 176.090 176.090 178.286 -2.196 18090 5408 1 14 . 1 1 66 66 MET CA C 192 56.390 56.390 57.420 -1.030 18090 5409 1 14 . 1 1 66 66 MET CB C 192 33.770 33.770 31.904 1.866 18090 5410 1 14 . 1 1 66 66 MET H H 192 7.880 7.880 8.605 -0.726 18090 5411 1 14 . 1 1 67 67 GLY N N 193 107.490 107.490 105.132 2.358 18090 5412 1 14 . 1 1 67 67 GLY C C 193 174.390 174.390 174.638 -0.248 18090 5413 1 14 . 1 1 67 67 GLY CA C 193 45.880 45.880 44.857 1.023 18090 5414 1 14 . 1 1 67 67 GLY H H 193 7.580 7.580 8.109 -0.529 18090 5415 1 14 . 1 1 68 68 VAL N N 194 118.520 118.520 116.794 1.726 18090 5416 1 14 . 1 1 68 68 VAL HA H 194 3.940 3.940 3.568 0.372 18090 5417 1 14 . 1 1 68 68 VAL C C 194 174.760 174.760 174.836 -0.076 18090 5418 1 14 . 1 1 68 68 VAL CA C 194 61.510 61.510 63.329 -1.819 18090 5419 1 14 . 1 1 68 68 VAL CB C 194 32.670 32.670 30.841 1.829 18090 5420 1 14 . 1 1 68 68 VAL H H 194 7.840 7.840 7.303 0.537 18090 5421 1 14 . 1 1 69 69 ASP N N 195 124.550 124.550 115.594 8.956 18090 5422 1 14 . 1 1 69 69 ASP HA H 195 4.430 4.430 4.318 0.112 18090 5423 1 14 . 1 1 69 69 ASP C C 195 175.140 175.140 176.127 -0.987 18090 5424 1 14 . 1 1 69 69 ASP CA C 195 53.760 53.760 55.777 -2.017 18090 5425 1 14 . 1 1 69 69 ASP CB C 195 40.920 40.920 39.642 1.278 18090 5426 1 14 . 1 1 69 69 ASP H H 195 8.400 8.400 7.955 0.445 18090 5427 1 14 . 1 1 70 70 LEU N N 196 123.930 123.930 118.207 5.723 18090 5428 1 14 . 1 1 70 70 LEU HA H 196 4.200 4.200 4.156 0.044 18090 5429 1 14 . 1 1 70 70 LEU C C 196 175.950 175.950 177.890 -1.940 18090 5430 1 14 . 1 1 70 70 LEU CA C 196 54.380 54.380 56.657 -2.277 18090 5431 1 14 . 1 1 70 70 LEU CB C 196 41.610 41.610 42.523 -0.913 18090 5432 1 14 . 1 1 70 70 LEU H H 196 8.160 8.160 7.584 0.576 18090 5433 1 15 . 1 1 2 2 PRO HA H 128 4.220 4.220 4.394 -0.174 18090 5434 1 15 . 1 1 2 2 PRO CA C 128 63.320 63.320 63.598 -0.278 18090 5435 1 15 . 1 1 2 2 PRO CB C 128 31.680 31.680 32.340 -0.660 18090 5436 1 15 . 1 1 3 3 ASP N N 129 119.320 119.320 116.858 2.462 18090 5437 1 15 . 1 1 3 3 ASP HA H 129 4.400 4.400 4.736 -0.336 18090 5438 1 15 . 1 1 3 3 ASP C C 129 176.120 176.120 174.431 1.689 18090 5439 1 15 . 1 1 3 3 ASP CA C 129 54.050 54.050 53.088 0.962 18090 5440 1 15 . 1 1 3 3 ASP CB C 129 40.770 40.770 42.785 -2.014 18090 5441 1 15 . 1 1 3 3 ASP H H 129 8.310 8.310 8.033 0.277 18090 5442 1 15 . 1 1 4 4 LEU N N 130 122.280 122.280 120.804 1.476 18090 5443 1 15 . 1 1 4 4 LEU HA H 130 4.130 4.130 4.369 -0.239 18090 5444 1 15 . 1 1 4 4 LEU C C 130 177.280 177.280 177.534 -0.254 18090 5445 1 15 . 1 1 4 4 LEU CA C 130 55.350 55.350 54.759 0.591 18090 5446 1 15 . 1 1 4 4 LEU CB C 130 41.490 41.490 42.490 -1.000 18090 5447 1 15 . 1 1 4 4 LEU H H 130 8.080 8.080 8.268 -0.188 18090 5448 1 15 . 1 1 5 5 GLY N N 131 107.830 107.830 109.329 -1.499 18090 5449 1 15 . 1 1 5 5 GLY C C 131 175.120 175.120 173.236 1.884 18090 5450 1 15 . 1 1 5 5 GLY CA C 131 45.300 45.300 45.379 -0.079 18090 5451 1 15 . 1 1 5 5 GLY H H 131 8.180 8.180 8.425 -0.245 18090 5452 1 15 . 1 1 6 6 LEU N N 132 121.080 121.080 116.632 4.448 18090 5453 1 15 . 1 1 6 6 LEU HA H 132 3.870 3.870 4.499 -0.629 18090 5454 1 15 . 1 1 6 6 LEU C C 132 178.000 178.000 177.758 0.242 18090 5455 1 15 . 1 1 6 6 LEU CA C 132 57.180 57.180 53.417 3.763 18090 5456 1 15 . 1 1 6 6 LEU CB C 132 41.870 41.870 44.596 -2.726 18090 5457 1 15 . 1 1 6 6 LEU H H 132 8.150 8.150 7.410 0.740 18090 5458 1 15 . 1 1 7 7 THR N N 133 111.580 111.580 113.633 -2.053 18090 5459 1 15 . 1 1 7 7 THR HA H 133 3.730 3.730 3.953 -0.223 18090 5460 1 15 . 1 1 7 7 THR C C 133 176.530 176.530 176.128 0.402 18090 5461 1 15 . 1 1 7 7 THR CA C 133 65.940 65.940 66.322 -0.382 18090 5462 1 15 . 1 1 7 7 THR CB C 133 68.130 68.130 68.786 -0.656 18090 5463 1 15 . 1 1 7 7 THR H H 133 7.970 7.970 8.684 -0.714 18090 5464 1 15 . 1 1 8 8 GLN N N 134 119.490 119.490 121.277 -1.787 18090 5465 1 15 . 1 1 8 8 GLN HA H 134 3.990 3.990 3.935 0.055 18090 5466 1 15 . 1 1 8 8 GLN C C 134 178.190 178.190 178.333 -0.143 18090 5467 1 15 . 1 1 8 8 GLN CA C 134 57.930 57.930 58.669 -0.738 18090 5468 1 15 . 1 1 8 8 GLN CB C 134 27.850 27.850 27.908 -0.058 18090 5469 1 15 . 1 1 8 8 GLN H H 134 7.890 7.890 8.416 -0.526 18090 5470 1 15 . 1 1 9 9 LEU N N 135 120.170 120.170 118.356 1.814 18090 5471 1 15 . 1 1 9 9 LEU HA H 135 3.820 3.820 3.947 -0.127 18090 5472 1 15 . 1 1 9 9 LEU C C 135 177.810 177.810 178.624 -0.814 18090 5473 1 15 . 1 1 9 9 LEU CA C 135 57.470 57.470 57.220 0.250 18090 5474 1 15 . 1 1 9 9 LEU CB C 135 41.640 41.640 41.861 -0.221 18090 5475 1 15 . 1 1 9 9 LEU H H 135 7.600 7.600 7.253 0.347 18090 5476 1 15 . 1 1 10 10 PHE N N 136 111.950 111.950 113.574 -1.624 18090 5477 1 15 . 1 1 10 10 PHE HA H 136 4.380 4.380 4.481 -0.101 18090 5478 1 15 . 1 1 10 10 PHE C C 136 174.990 174.990 177.434 -2.444 18090 5479 1 15 . 1 1 10 10 PHE CA C 136 58.450 58.450 57.605 0.845 18090 5480 1 15 . 1 1 10 10 PHE CB C 136 38.570 38.570 37.776 0.793 18090 5481 1 15 . 1 1 10 10 PHE H H 136 7.410 7.410 6.579 0.831 18090 5482 1 15 . 1 1 11 11 ALA N N 137 120.230 120.230 122.736 -2.506 18090 5483 1 15 . 1 1 11 11 ALA HA H 137 4.130 4.130 4.163 -0.033 18090 5484 1 15 . 1 1 11 11 ALA C C 137 177.090 177.090 178.198 -1.108 18090 5485 1 15 . 1 1 11 11 ALA CA C 137 52.580 52.580 53.615 -1.035 18090 5486 1 15 . 1 1 11 11 ALA CB C 137 18.660 18.660 18.660 -0.000 18090 5487 1 15 . 1 1 11 11 ALA H H 137 7.330 7.330 8.593 -1.263 18090 5488 1 15 . 1 1 12 12 ASP N N 138 119.830 119.830 120.787 -0.957 18090 5489 1 15 . 1 1 12 12 ASP HA H 138 4.510 4.510 4.715 -0.205 18090 5490 1 15 . 1 1 12 12 ASP C C 138 176.370 176.370 174.750 1.620 18090 5491 1 15 . 1 1 12 12 ASP CA C 138 51.960 51.960 52.901 -0.941 18090 5492 1 15 . 1 1 12 12 ASP CB C 138 41.990 41.990 41.589 0.402 18090 5493 1 15 . 1 1 12 12 ASP H H 138 6.980 6.980 7.637 -0.657 18090 5494 1 15 . 1 1 13 13 PRO HA H 139 4.260 4.260 4.374 -0.114 18090 5495 1 15 . 1 1 13 13 PRO CA C 139 64.350 64.350 62.858 1.492 18090 5496 1 15 . 1 1 13 13 PRO CB C 139 31.760 31.760 32.377 -0.617 18090 5497 1 15 . 1 1 14 14 ASN N N 140 116.840 116.840 117.483 -0.643 18090 5498 1 15 . 1 1 14 14 ASN HA H 140 4.840 4.840 4.480 0.360 18090 5499 1 15 . 1 1 14 14 ASN C C 140 173.840 173.840 175.336 -1.496 18090 5500 1 15 . 1 1 14 14 ASN CA C 140 52.380 52.380 54.179 -1.799 18090 5501 1 15 . 1 1 14 14 ASN CB C 140 38.330 38.330 37.007 1.323 18090 5502 1 15 . 1 1 14 14 ASN H H 140 8.670 8.670 8.680 -0.010 18090 5503 1 15 . 1 1 15 15 LEU N N 141 120.290 120.290 120.366 -0.076 18090 5504 1 15 . 1 1 15 15 LEU HA H 141 3.790 3.790 4.534 -0.744 18090 5505 1 15 . 1 1 15 15 LEU C C 141 177.120 177.120 177.542 -0.422 18090 5506 1 15 . 1 1 15 15 LEU CA C 141 59.280 59.280 55.565 3.715 18090 5507 1 15 . 1 1 15 15 LEU CB C 141 42.980 42.980 43.162 -0.182 18090 5508 1 15 . 1 1 15 15 LEU H H 141 7.200 7.200 8.425 -1.225 18090 5509 1 15 . 1 1 16 16 ILE N N 142 115.290 115.290 120.396 -5.106 18090 5510 1 15 . 1 1 16 16 ILE HA H 142 3.480 3.480 3.675 -0.195 18090 5511 1 15 . 1 1 16 16 ILE C C 142 177.990 177.990 177.372 0.618 18090 5512 1 15 . 1 1 16 16 ILE CA C 142 62.690 62.690 65.268 -2.578 18090 5513 1 15 . 1 1 16 16 ILE CB C 142 34.620 34.620 37.723 -3.103 18090 5514 1 15 . 1 1 16 16 ILE H H 142 7.940 7.940 8.409 -0.469 18090 5515 1 15 . 1 1 17 17 GLU N N 143 119.600 119.600 119.014 0.586 18090 5516 1 15 . 1 1 17 17 GLU HA H 143 3.700 3.700 3.999 -0.299 18090 5517 1 15 . 1 1 17 17 GLU C C 143 179.170 179.170 178.780 0.390 18090 5518 1 15 . 1 1 17 17 GLU CA C 143 59.360 59.360 60.035 -0.675 18090 5519 1 15 . 1 1 17 17 GLU CB C 143 28.520 28.520 29.186 -0.665 18090 5520 1 15 . 1 1 17 17 GLU H H 143 7.970 7.970 8.559 -0.589 18090 5521 1 15 . 1 1 18 18 ASN N N 144 117.170 117.170 117.942 -0.772 18090 5522 1 15 . 1 1 18 18 ASN HA H 144 4.270 4.270 4.455 -0.185 18090 5523 1 15 . 1 1 18 18 ASN C C 144 179.120 179.120 177.778 1.342 18090 5524 1 15 . 1 1 18 18 ASN CA C 144 55.490 55.490 55.609 -0.119 18090 5525 1 15 . 1 1 18 18 ASN CB C 144 36.550 36.550 37.803 -1.253 18090 5526 1 15 . 1 1 18 18 ASN H H 144 8.450 8.450 8.355 0.095 18090 5527 1 15 . 1 1 19 19 LEU N N 145 121.060 121.060 119.122 1.938 18090 5528 1 15 . 1 1 19 19 LEU HA H 145 4.020 4.020 4.017 0.003 18090 5529 1 15 . 1 1 19 19 LEU C C 145 180.260 180.260 178.233 2.027 18090 5530 1 15 . 1 1 19 19 LEU CA C 145 56.620 56.620 57.135 -0.515 18090 5531 1 15 . 1 1 19 19 LEU CB C 145 41.780 41.780 41.565 0.215 18090 5532 1 15 . 1 1 19 19 LEU H H 145 7.990 7.990 7.580 0.410 18090 5533 1 15 . 1 1 20 20 LYS N N 146 118.960 118.960 117.375 1.585 18090 5534 1 15 . 1 1 20 20 LYS HA H 146 3.610 3.610 4.010 -0.400 18090 5535 1 15 . 1 1 20 20 LYS C C 146 177.390 177.390 178.006 -0.616 18090 5536 1 15 . 1 1 20 20 LYS CA C 146 59.640 59.640 58.977 0.663 18090 5537 1 15 . 1 1 20 20 LYS CB C 146 32.450 32.450 32.289 0.161 18090 5538 1 15 . 1 1 20 20 LYS H H 146 8.250 8.250 7.776 0.474 18090 5539 1 15 . 1 1 21 21 LYS N N 147 114.720 114.720 116.737 -2.017 18090 5540 1 15 . 1 1 21 21 LYS HA H 147 4.110 4.110 4.240 -0.130 18090 5541 1 15 . 1 1 21 21 LYS C C 147 175.880 175.880 178.218 -2.338 18090 5542 1 15 . 1 1 21 21 LYS CA C 147 56.210 56.210 58.140 -1.930 18090 5543 1 15 . 1 1 21 21 LYS CB C 147 33.000 33.000 32.788 0.212 18090 5544 1 15 . 1 1 21 21 LYS H H 147 7.130 7.130 7.688 -0.558 18090 5545 1 15 . 1 1 22 22 ASN N N 148 122.180 122.180 115.412 6.768 18090 5546 1 15 . 1 1 22 22 ASN HA H 148 4.740 4.740 4.911 -0.171 18090 5547 1 15 . 1 1 22 22 ASN C C 148 174.000 174.000 173.509 0.491 18090 5548 1 15 . 1 1 22 22 ASN CA C 148 50.970 50.970 52.779 -1.809 18090 5549 1 15 . 1 1 22 22 ASN CB C 148 38.670 38.670 38.934 -0.265 18090 5550 1 15 . 1 1 22 22 ASN H H 148 6.930 6.930 7.853 -0.923 18090 5551 1 15 . 1 1 23 23 PRO HA H 149 4.300 4.300 4.698 -0.398 18090 5552 1 15 . 1 1 23 23 PRO CA C 149 64.610 64.610 61.971 2.639 18090 5553 1 15 . 1 1 23 23 PRO CB C 149 32.000 32.000 34.158 -2.158 18090 5554 1 15 . 1 1 24 24 LYS N N 150 116.060 116.060 121.120 -5.060 18090 5555 1 15 . 1 1 24 24 LYS HA H 150 4.070 4.070 3.954 0.116 18090 5556 1 15 . 1 1 24 24 LYS C C 150 178.240 178.240 178.269 -0.029 18090 5557 1 15 . 1 1 24 24 LYS CA C 150 57.950 57.950 59.651 -1.701 18090 5558 1 15 . 1 1 24 24 LYS CB C 150 32.590 32.590 31.858 0.733 18090 5559 1 15 . 1 1 24 24 LYS H H 150 8.520 8.520 8.821 -0.301 18090 5560 1 15 . 1 1 25 25 THR N N 151 105.190 105.190 110.540 -5.350 18090 5561 1 15 . 1 1 25 25 THR HA H 151 4.390 4.390 4.060 0.330 18090 5562 1 15 . 1 1 25 25 THR C C 151 176.090 176.090 176.339 -0.249 18090 5563 1 15 . 1 1 25 25 THR CA C 151 61.400 61.400 64.621 -3.221 18090 5564 1 15 . 1 1 25 25 THR CB C 151 69.440 69.440 67.135 2.304 18090 5565 1 15 . 1 1 25 25 THR H H 151 7.490 7.490 8.163 -0.673 18090 5566 1 15 . 1 1 26 26 SER N N 152 119.700 119.700 116.687 3.013 18090 5567 1 15 . 1 1 26 26 SER HA H 152 3.770 3.770 4.126 -0.356 18090 5568 1 15 . 1 1 26 26 SER C C 152 177.470 177.470 175.953 1.517 18090 5569 1 15 . 1 1 26 26 SER CA C 152 62.450 62.450 61.471 0.979 18090 5570 1 15 . 1 1 26 26 SER CB C 152 62.520 62.520 62.590 -0.070 18090 5571 1 15 . 1 1 26 26 SER H H 152 8.190 8.190 7.912 0.278 18090 5572 1 15 . 1 1 27 27 GLU N N 153 119.870 119.870 122.762 -2.892 18090 5573 1 15 . 1 1 27 27 GLU HA H 153 3.890 3.890 3.958 -0.068 18090 5574 1 15 . 1 1 27 27 GLU C C 153 180.040 180.040 178.712 1.328 18090 5575 1 15 . 1 1 27 27 GLU CA C 153 58.700 58.700 59.351 -0.651 18090 5576 1 15 . 1 1 27 27 GLU CB C 153 28.590 28.590 29.456 -0.866 18090 5577 1 15 . 1 1 27 27 GLU H H 153 8.350 8.350 7.805 0.545 18090 5578 1 15 . 1 1 28 28 MET N N 154 119.430 119.430 116.982 2.448 18090 5579 1 15 . 1 1 28 28 MET HA H 154 4.040 4.040 4.166 -0.126 18090 5580 1 15 . 1 1 28 28 MET C C 154 177.110 177.110 178.155 -1.045 18090 5581 1 15 . 1 1 28 28 MET CA C 154 58.510 58.510 58.627 -0.117 18090 5582 1 15 . 1 1 28 28 MET CB C 154 31.430 31.430 32.734 -1.304 18090 5583 1 15 . 1 1 28 28 MET H H 154 7.850 7.850 7.631 0.219 18090 5584 1 15 . 1 1 29 29 MET N N 155 112.640 112.640 114.356 -1.716 18090 5585 1 15 . 1 1 29 29 MET HA H 155 4.340 4.340 4.253 0.088 18090 5586 1 15 . 1 1 29 29 MET C C 155 175.530 175.530 177.826 -2.296 18090 5587 1 15 . 1 1 29 29 MET CA C 155 53.790 53.790 57.160 -3.370 18090 5588 1 15 . 1 1 29 29 MET CB C 155 30.380 30.380 32.076 -1.696 18090 5589 1 15 . 1 1 29 29 MET H H 155 7.200 7.200 7.351 -0.151 18090 5590 1 15 . 1 1 30 30 LYS N N 156 117.050 117.050 116.713 0.337 18090 5591 1 15 . 1 1 30 30 LYS HA H 156 3.960 3.960 4.266 -0.306 18090 5592 1 15 . 1 1 30 30 LYS C C 156 176.120 176.120 177.151 -1.031 18090 5593 1 15 . 1 1 30 30 LYS CA C 156 57.090 57.090 57.339 -0.249 18090 5594 1 15 . 1 1 30 30 LYS CB C 156 31.960 31.960 32.961 -1.001 18090 5595 1 15 . 1 1 30 30 LYS H H 156 7.130 7.130 7.629 -0.499 18090 5596 1 15 . 1 1 31 31 ASP N N 157 119.810 119.810 118.498 1.312 18090 5597 1 15 . 1 1 31 31 ASP HA H 157 4.860 4.860 4.979 -0.118 18090 5598 1 15 . 1 1 31 31 ASP C C 157 174.890 174.890 174.514 0.376 18090 5599 1 15 . 1 1 31 31 ASP CA C 157 50.520 50.520 54.242 -3.722 18090 5600 1 15 . 1 1 31 31 ASP CB C 157 41.010 41.010 40.490 0.520 18090 5601 1 15 . 1 1 31 31 ASP H H 157 7.340 7.340 7.742 -0.402 18090 5602 1 15 . 1 1 32 32 PRO HA H 158 4.130 4.130 4.474 -0.344 18090 5603 1 15 . 1 1 32 32 PRO CA C 158 64.270 64.270 62.921 1.349 18090 5604 1 15 . 1 1 32 32 PRO CB C 158 31.770 31.770 32.397 -0.627 18090 5605 1 15 . 1 1 33 33 GLN N N 159 117.760 117.760 120.262 -2.502 18090 5606 1 15 . 1 1 33 33 GLN HA H 159 4.000 4.000 4.038 -0.038 18090 5607 1 15 . 1 1 33 33 GLN C C 159 178.740 178.740 177.948 0.792 18090 5608 1 15 . 1 1 33 33 GLN CA C 159 58.220 58.220 58.055 0.165 18090 5609 1 15 . 1 1 33 33 GLN CB C 159 27.870 27.870 28.072 -0.202 18090 5610 1 15 . 1 1 33 33 GLN H H 159 8.150 8.150 8.770 -0.620 18090 5611 1 15 . 1 1 34 34 LEU N N 160 123.300 123.300 120.065 3.235 18090 5612 1 15 . 1 1 34 34 LEU HA H 160 3.970 3.970 4.006 -0.036 18090 5613 1 15 . 1 1 34 34 LEU C C 160 177.980 177.980 178.149 -0.169 18090 5614 1 15 . 1 1 34 34 LEU CA C 160 57.050 57.050 57.282 -0.233 18090 5615 1 15 . 1 1 34 34 LEU CB C 160 40.760 40.760 41.667 -0.907 18090 5616 1 15 . 1 1 34 34 LEU H H 160 7.110 7.110 7.983 -0.873 18090 5617 1 15 . 1 1 35 35 VAL N N 161 118.390 118.390 119.339 -0.949 18090 5618 1 15 . 1 1 35 35 VAL HA H 161 3.110 3.110 3.497 -0.387 18090 5619 1 15 . 1 1 35 35 VAL C C 161 176.840 176.840 177.670 -0.830 18090 5620 1 15 . 1 1 35 35 VAL CA C 161 67.700 67.700 66.934 0.766 18090 5621 1 15 . 1 1 35 35 VAL CB C 161 31.260 31.260 31.317 -0.057 18090 5622 1 15 . 1 1 35 35 VAL H H 161 7.430 7.430 7.413 0.017 18090 5623 1 15 . 1 1 36 36 ALA N N 162 117.600 117.600 121.275 -3.675 18090 5624 1 15 . 1 1 36 36 ALA HA H 162 3.810 3.810 3.946 -0.136 18090 5625 1 15 . 1 1 36 36 ALA C C 162 180.620 180.620 179.613 1.007 18090 5626 1 15 . 1 1 36 36 ALA CA C 162 54.720 54.720 55.329 -0.609 18090 5627 1 15 . 1 1 36 36 ALA CB C 162 17.490 17.490 18.105 -0.615 18090 5628 1 15 . 1 1 36 36 ALA H H 162 7.500 7.500 7.782 -0.282 18090 5629 1 15 . 1 1 37 37 LYS N N 163 119.880 119.880 118.518 1.362 18090 5630 1 15 . 1 1 37 37 LYS HA H 163 3.570 3.570 3.984 -0.414 18090 5631 1 15 . 1 1 37 37 LYS C C 163 177.800 177.800 179.118 -1.318 18090 5632 1 15 . 1 1 37 37 LYS CA C 163 58.880 58.880 58.940 -0.060 18090 5633 1 15 . 1 1 37 37 LYS CB C 163 31.610 31.610 32.032 -0.422 18090 5634 1 15 . 1 1 37 37 LYS H H 163 7.350 7.350 7.414 -0.064 18090 5635 1 15 . 1 1 38 38 LEU N N 164 118.020 118.020 119.984 -1.964 18090 5636 1 15 . 1 1 38 38 LEU HA H 164 3.670 3.670 4.060 -0.390 18090 5637 1 15 . 1 1 38 38 LEU C C 164 179.380 179.380 179.220 0.160 18090 5638 1 15 . 1 1 38 38 LEU CA C 164 57.340 57.340 57.758 -0.418 18090 5639 1 15 . 1 1 38 38 LEU CB C 164 41.660 41.660 41.703 -0.043 18090 5640 1 15 . 1 1 38 38 LEU H H 164 7.660 7.660 8.132 -0.472 18090 5641 1 15 . 1 1 39 39 ILE N N 165 118.070 118.070 118.241 -0.171 18090 5642 1 15 . 1 1 39 39 ILE HA H 165 3.510 3.510 3.643 -0.133 18090 5643 1 15 . 1 1 39 39 ILE C C 165 179.570 179.570 178.212 1.358 18090 5644 1 15 . 1 1 39 39 ILE CA C 165 64.450 64.450 65.505 -1.055 18090 5645 1 15 . 1 1 39 39 ILE CB C 165 37.310 37.310 37.462 -0.151 18090 5646 1 15 . 1 1 39 39 ILE H H 165 8.030 8.030 7.970 0.060 18090 5647 1 15 . 1 1 40 40 GLY N N 166 107.970 107.970 107.968 0.002 18090 5648 1 15 . 1 1 40 40 GLY C C 166 176.470 176.470 175.710 0.760 18090 5649 1 15 . 1 1 40 40 GLY CA C 166 46.410 46.410 46.956 -0.546 18090 5650 1 15 . 1 1 40 40 GLY H H 166 7.590 7.590 7.623 -0.033 18090 5651 1 15 . 1 1 41 41 TYR N N 167 121.270 121.270 122.334 -1.064 18090 5652 1 15 . 1 1 41 41 TYR HA H 167 4.190 4.190 4.208 -0.018 18090 5653 1 15 . 1 1 41 41 TYR C C 167 176.470 176.470 176.202 0.268 18090 5654 1 15 . 1 1 41 41 TYR CA C 167 57.130 57.130 60.427 -3.297 18090 5655 1 15 . 1 1 41 41 TYR CB C 167 35.950 35.950 38.222 -2.272 18090 5656 1 15 . 1 1 41 41 TYR H H 167 7.350 7.350 7.880 -0.530 18090 5657 1 15 . 1 1 42 42 LYS N N 168 116.520 116.520 116.064 0.456 18090 5658 1 15 . 1 1 42 42 LYS HA H 168 3.820 3.820 4.053 -0.233 18090 5659 1 15 . 1 1 42 42 LYS C C 168 177.810 177.810 177.917 -0.107 18090 5660 1 15 . 1 1 42 42 LYS CA C 168 59.390 59.390 58.387 1.003 18090 5661 1 15 . 1 1 42 42 LYS CB C 168 31.580 31.580 32.764 -1.184 18090 5662 1 15 . 1 1 42 42 LYS H H 168 7.460 7.460 8.258 -0.798 18090 5663 1 15 . 1 1 43 43 GLN N N 169 113.750 113.750 116.168 -2.418 18090 5664 1 15 . 1 1 43 43 GLN HA H 169 4.220 4.220 4.164 0.056 18090 5665 1 15 . 1 1 43 43 GLN C C 169 175.840 175.840 177.409 -1.569 18090 5666 1 15 . 1 1 43 43 GLN CA C 169 56.230 56.230 58.144 -1.914 18090 5667 1 15 . 1 1 43 43 GLN CB C 169 29.290 29.290 29.353 -0.063 18090 5668 1 15 . 1 1 43 43 GLN H H 169 7.220 7.220 7.620 -0.400 18090 5669 1 15 . 1 1 44 44 ASN N N 170 114.130 114.130 116.104 -1.974 18090 5670 1 15 . 1 1 44 44 ASN HA H 170 5.050 5.050 4.942 0.108 18090 5671 1 15 . 1 1 44 44 ASN C C 170 172.200 172.200 173.577 -1.377 18090 5672 1 15 . 1 1 44 44 ASN CA C 170 50.780 50.780 53.953 -3.173 18090 5673 1 15 . 1 1 44 44 ASN CB C 170 38.380 38.380 39.719 -1.339 18090 5674 1 15 . 1 1 44 44 ASN H H 170 7.580 7.580 7.644 -0.064 18090 5675 1 15 . 1 1 45 45 PRO HA H 171 4.130 4.130 4.658 -0.528 18090 5676 1 15 . 1 1 45 45 PRO CA C 171 64.800 64.800 62.077 2.723 18090 5677 1 15 . 1 1 45 45 PRO CB C 171 31.360 31.360 31.917 -0.557 18090 5678 1 15 . 1 1 46 46 GLN N N 172 115.570 115.570 122.944 -7.374 18090 5679 1 15 . 1 1 46 46 GLN HA H 172 3.770 3.770 3.774 -0.004 18090 5680 1 15 . 1 1 46 46 GLN C C 172 177.360 177.360 177.612 -0.252 18090 5681 1 15 . 1 1 46 46 GLN CA C 172 57.950 57.950 58.157 -0.207 18090 5682 1 15 . 1 1 46 46 GLN CB C 172 27.050 27.050 27.886 -0.836 18090 5683 1 15 . 1 1 46 46 GLN H H 172 8.160 8.160 8.698 -0.538 18090 5684 1 15 . 1 1 47 47 ALA N N 173 121.420 121.420 121.617 -0.197 18090 5685 1 15 . 1 1 47 47 ALA HA H 173 4.050 4.050 4.165 -0.116 18090 5686 1 15 . 1 1 47 47 ALA C C 173 178.090 178.090 179.443 -1.353 18090 5687 1 15 . 1 1 47 47 ALA CA C 173 53.490 53.490 54.319 -0.829 18090 5688 1 15 . 1 1 47 47 ALA CB C 173 18.450 18.450 17.636 0.814 18090 5689 1 15 . 1 1 47 47 ALA H H 173 7.470 7.470 8.262 -0.792 18090 5690 1 15 . 1 1 48 48 ILE N N 174 118.050 118.050 118.674 -0.624 18090 5691 1 15 . 1 1 48 48 ILE HA H 174 3.180 3.180 3.864 -0.684 18090 5692 1 15 . 1 1 48 48 ILE C C 174 176.250 176.250 177.869 -1.619 18090 5693 1 15 . 1 1 48 48 ILE CA C 174 64.030 64.030 64.041 -0.011 18090 5694 1 15 . 1 1 48 48 ILE CB C 174 37.280 37.280 37.087 0.193 18090 5695 1 15 . 1 1 48 48 ILE H H 174 7.150 7.150 7.343 -0.193 18090 5696 1 15 . 1 1 49 49 GLY N N 175 105.390 105.390 106.684 -1.294 18090 5697 1 15 . 1 1 49 49 GLY C C 175 174.220 174.220 175.990 -1.770 18090 5698 1 15 . 1 1 49 49 GLY CA C 175 46.700 46.700 47.048 -0.348 18090 5699 1 15 . 1 1 49 49 GLY H H 175 7.550 7.550 7.772 -0.222 18090 5700 1 15 . 1 1 50 50 GLN N N 176 116.230 116.230 118.624 -2.394 18090 5701 1 15 . 1 1 50 50 GLN HA H 176 4.210 4.210 4.566 -0.356 18090 5702 1 15 . 1 1 50 50 GLN C C 176 178.120 178.120 178.303 -0.183 18090 5703 1 15 . 1 1 50 50 GLN CA C 176 57.320 57.320 57.991 -0.671 18090 5704 1 15 . 1 1 50 50 GLN CB C 176 28.630 28.630 29.215 -0.585 18090 5705 1 15 . 1 1 50 50 GLN H H 176 7.390 7.390 8.006 -0.616 18090 5706 1 15 . 1 1 51 51 ASP N N 177 120.000 120.000 121.028 -1.028 18090 5707 1 15 . 1 1 51 51 ASP HA H 177 4.420 4.420 4.639 -0.219 18090 5708 1 15 . 1 1 51 51 ASP C C 177 177.950 177.950 178.304 -0.354 18090 5709 1 15 . 1 1 51 51 ASP CA C 177 55.840 55.840 55.992 -0.152 18090 5710 1 15 . 1 1 51 51 ASP CB C 177 40.310 40.310 40.839 -0.529 18090 5711 1 15 . 1 1 51 51 ASP H H 177 7.870 7.870 7.871 -0.001 18090 5712 1 15 . 1 1 52 52 LEU N N 178 120.010 120.010 120.458 -0.448 18090 5713 1 15 . 1 1 52 52 LEU HA H 178 3.650 3.650 3.973 -0.323 18090 5714 1 15 . 1 1 52 52 LEU C C 178 175.810 175.810 178.288 -2.478 18090 5715 1 15 . 1 1 52 52 LEU CA C 178 57.620 57.620 57.880 -0.260 18090 5716 1 15 . 1 1 52 52 LEU CB C 178 41.880 41.880 41.683 0.197 18090 5717 1 15 . 1 1 52 52 LEU H H 178 7.860 7.860 7.635 0.225 18090 5718 1 15 . 1 1 53 53 PHE N N 179 110.580 110.580 111.941 -1.361 18090 5719 1 15 . 1 1 53 53 PHE HA H 179 4.230 4.230 4.314 -0.084 18090 5720 1 15 . 1 1 53 53 PHE C C 179 176.370 176.370 177.443 -1.073 18090 5721 1 15 . 1 1 53 53 PHE CA C 179 58.730 58.730 60.146 -1.416 18090 5722 1 15 . 1 1 53 53 PHE CB C 179 38.720 38.720 38.922 -0.202 18090 5723 1 15 . 1 1 53 53 PHE H H 179 7.210 7.210 7.960 -0.750 18090 5724 1 15 . 1 1 54 54 THR N N 180 108.190 108.190 108.960 -0.770 18090 5725 1 15 . 1 1 54 54 THR HA H 180 4.300 4.300 4.290 0.010 18090 5726 1 15 . 1 1 54 54 THR C C 180 174.400 174.400 175.317 -0.917 18090 5727 1 15 . 1 1 54 54 THR CA C 180 62.020 62.020 62.644 -0.624 18090 5728 1 15 . 1 1 54 54 THR CB C 180 69.730 69.730 69.939 -0.209 18090 5729 1 15 . 1 1 54 54 THR H H 180 7.550 7.550 7.469 0.081 18090 5730 1 15 . 1 1 55 55 ASP N N 181 120.060 120.060 122.742 -2.682 18090 5731 1 15 . 1 1 55 55 ASP HA H 181 5.020 5.020 5.072 -0.051 18090 5732 1 15 . 1 1 55 55 ASP C C 181 174.120 174.120 175.426 -1.306 18090 5733 1 15 . 1 1 55 55 ASP CA C 181 50.560 50.560 50.719 -0.159 18090 5734 1 15 . 1 1 55 55 ASP CB C 181 41.190 41.190 42.903 -1.713 18090 5735 1 15 . 1 1 55 55 ASP H H 181 7.480 7.480 8.036 -0.556 18090 5736 1 15 . 1 1 56 56 PRO HA H 182 4.320 4.320 4.323 -0.003 18090 5737 1 15 . 1 1 56 56 PRO CA C 182 64.280 64.280 64.915 -0.634 18090 5738 1 15 . 1 1 56 56 PRO CB C 182 31.980 31.980 32.601 -0.621 18090 5739 1 15 . 1 1 57 57 ARG N N 183 117.660 117.660 118.350 -0.690 18090 5740 1 15 . 1 1 57 57 ARG HA H 183 3.960 3.960 4.105 -0.145 18090 5741 1 15 . 1 1 57 57 ARG C C 183 179.030 179.030 178.656 0.374 18090 5742 1 15 . 1 1 57 57 ARG CA C 183 59.000 59.000 58.762 0.238 18090 5743 1 15 . 1 1 57 57 ARG CB C 183 29.750 29.750 29.319 0.431 18090 5744 1 15 . 1 1 57 57 ARG H H 183 7.920 7.920 8.173 -0.253 18090 5745 1 15 . 1 1 58 58 LEU N N 184 115.670 115.670 119.521 -3.851 18090 5746 1 15 . 1 1 58 58 LEU HA H 184 3.850 3.850 3.960 -0.110 18090 5747 1 15 . 1 1 58 58 LEU C C 184 178.770 178.770 179.109 -0.339 18090 5748 1 15 . 1 1 58 58 LEU CA C 184 57.110 57.110 57.769 -0.659 18090 5749 1 15 . 1 1 58 58 LEU CB C 184 41.310 41.310 41.590 -0.280 18090 5750 1 15 . 1 1 58 58 LEU H H 184 7.750 7.750 8.179 -0.429 18090 5751 1 15 . 1 1 59 59 MET N N 185 118.570 118.570 116.236 2.334 18090 5752 1 15 . 1 1 59 59 MET HA H 185 4.060 4.060 4.118 -0.058 18090 5753 1 15 . 1 1 59 59 MET C C 185 177.540 177.540 178.227 -0.687 18090 5754 1 15 . 1 1 59 59 MET CA C 185 58.090 58.090 59.340 -1.250 18090 5755 1 15 . 1 1 59 59 MET CB C 185 31.270 31.270 32.148 -0.878 18090 5756 1 15 . 1 1 59 59 MET H H 185 7.590 7.590 7.659 -0.069 18090 5757 1 15 . 1 1 60 60 THR N N 186 116.390 116.390 117.334 -0.944 18090 5758 1 15 . 1 1 60 60 THR HA H 186 3.680 3.680 4.006 -0.326 18090 5759 1 15 . 1 1 60 60 THR C C 186 177.440 177.440 176.722 0.718 18090 5760 1 15 . 1 1 60 60 THR CA C 186 66.940 66.940 66.403 0.537 18090 5761 1 15 . 1 1 60 60 THR CB C 186 68.030 68.030 68.179 -0.149 18090 5762 1 15 . 1 1 60 60 THR H H 186 7.180 7.180 7.708 -0.528 18090 5763 1 15 . 1 1 61 61 ILE N N 187 123.840 123.840 121.986 1.854 18090 5764 1 15 . 1 1 61 61 ILE HA H 187 3.290 3.290 3.772 -0.482 18090 5765 1 15 . 1 1 61 61 ILE C C 187 176.660 176.660 178.266 -1.606 18090 5766 1 15 . 1 1 61 61 ILE CA C 187 65.850 65.850 65.410 0.440 18090 5767 1 15 . 1 1 61 61 ILE CB C 187 37.640 37.640 37.694 -0.054 18090 5768 1 15 . 1 1 61 61 ILE H H 187 8.010 8.010 7.892 0.118 18090 5769 1 15 . 1 1 62 62 MET N N 188 118.210 118.210 118.327 -0.117 18090 5770 1 15 . 1 1 62 62 MET HA H 188 3.910 3.910 4.011 -0.101 18090 5771 1 15 . 1 1 62 62 MET C C 188 177.540 177.540 178.455 -0.915 18090 5772 1 15 . 1 1 62 62 MET CA C 188 58.530 58.530 58.880 -0.350 18090 5773 1 15 . 1 1 62 62 MET CB C 188 31.200 31.200 31.532 -0.332 18090 5774 1 15 . 1 1 62 62 MET H H 188 8.560 8.560 7.409 1.151 18090 5775 1 15 . 1 1 63 63 ALA N N 189 119.850 119.850 122.013 -2.163 18090 5776 1 15 . 1 1 63 63 ALA HA H 189 3.730 3.730 3.923 -0.193 18090 5777 1 15 . 1 1 63 63 ALA C C 189 179.550 179.550 179.256 0.294 18090 5778 1 15 . 1 1 63 63 ALA CA C 189 55.470 55.470 55.360 0.110 18090 5779 1 15 . 1 1 63 63 ALA CB C 189 17.640 17.640 18.217 -0.577 18090 5780 1 15 . 1 1 63 63 ALA H H 189 8.210 8.210 8.119 0.091 18090 5781 1 15 . 1 1 64 64 THR N N 190 114.570 114.570 113.890 0.680 18090 5782 1 15 . 1 1 64 64 THR HA H 190 3.790 3.790 3.942 -0.152 18090 5783 1 15 . 1 1 64 64 THR C C 190 177.640 177.640 177.021 0.619 18090 5784 1 15 . 1 1 64 64 THR CA C 190 66.690 66.690 66.034 0.656 18090 5785 1 15 . 1 1 64 64 THR CB C 190 68.310 68.310 68.518 -0.208 18090 5786 1 15 . 1 1 64 64 THR H H 190 7.740 7.740 7.600 0.140 18090 5787 1 15 . 1 1 65 65 LEU N N 191 122.410 122.410 121.741 0.669 18090 5788 1 15 . 1 1 65 65 LEU HA H 191 3.930 3.930 3.963 -0.033 18090 5789 1 15 . 1 1 65 65 LEU C C 191 178.470 178.470 179.523 -1.053 18090 5790 1 15 . 1 1 65 65 LEU CA C 191 57.120 57.120 58.023 -0.903 18090 5791 1 15 . 1 1 65 65 LEU CB C 191 41.830 41.830 41.794 0.036 18090 5792 1 15 . 1 1 65 65 LEU H H 191 8.180 8.180 7.592 0.588 18090 5793 1 15 . 1 1 66 66 MET N N 192 115.320 115.320 115.944 -0.624 18090 5794 1 15 . 1 1 66 66 MET HA H 192 4.090 4.090 4.303 -0.213 18090 5795 1 15 . 1 1 66 66 MET C C 192 176.090 176.090 178.403 -2.313 18090 5796 1 15 . 1 1 66 66 MET CA C 192 56.390 56.390 56.949 -0.559 18090 5797 1 15 . 1 1 66 66 MET CB C 192 33.770 33.770 32.009 1.761 18090 5798 1 15 . 1 1 66 66 MET H H 192 7.880 7.880 8.291 -0.411 18090 5799 1 15 . 1 1 67 67 GLY N N 193 107.490 107.490 104.873 2.617 18090 5800 1 15 . 1 1 67 67 GLY C C 193 174.390 174.390 174.608 -0.218 18090 5801 1 15 . 1 1 67 67 GLY CA C 193 45.880 45.880 45.138 0.742 18090 5802 1 15 . 1 1 67 67 GLY H H 193 7.580 7.580 8.078 -0.498 18090 5803 1 15 . 1 1 68 68 VAL N N 194 118.520 118.520 116.941 1.579 18090 5804 1 15 . 1 1 68 68 VAL HA H 194 3.940 3.940 3.618 0.322 18090 5805 1 15 . 1 1 68 68 VAL C C 194 174.760 174.760 176.225 -1.465 18090 5806 1 15 . 1 1 68 68 VAL CA C 194 61.510 61.510 63.779 -2.269 18090 5807 1 15 . 1 1 68 68 VAL CB C 194 32.670 32.670 29.732 2.938 18090 5808 1 15 . 1 1 68 68 VAL H H 194 7.840 7.840 7.457 0.383 18090 5809 1 15 . 1 1 69 69 ASP N N 195 124.550 124.550 119.616 4.934 18090 5810 1 15 . 1 1 69 69 ASP HA H 195 4.430 4.430 4.490 -0.060 18090 5811 1 15 . 1 1 69 69 ASP C C 195 175.140 175.140 176.920 -1.780 18090 5812 1 15 . 1 1 69 69 ASP CA C 195 53.760 53.760 56.490 -2.730 18090 5813 1 15 . 1 1 69 69 ASP CB C 195 40.920 40.920 41.129 -0.209 18090 5814 1 15 . 1 1 69 69 ASP H H 195 8.400 8.400 7.994 0.406 18090 5815 1 15 . 1 1 70 70 LEU N N 196 123.930 123.930 119.670 4.260 18090 5816 1 15 . 1 1 70 70 LEU HA H 196 4.200 4.200 4.195 0.005 18090 5817 1 15 . 1 1 70 70 LEU C C 196 175.950 175.950 177.428 -1.478 18090 5818 1 15 . 1 1 70 70 LEU CA C 196 54.380 54.380 56.629 -2.249 18090 5819 1 15 . 1 1 70 70 LEU CB C 196 41.610 41.610 42.358 -0.747 18090 5820 1 15 . 1 1 70 70 LEU H H 196 8.160 8.160 7.414 0.746 18090 5821 1 16 . 1 1 2 2 PRO HA H 128 4.220 4.220 4.650 -0.430 18090 5822 1 16 . 1 1 2 2 PRO CA C 128 63.320 63.320 63.148 0.172 18090 5823 1 16 . 1 1 2 2 PRO CB C 128 31.680 31.680 32.381 -0.701 18090 5824 1 16 . 1 1 3 3 ASP N N 129 119.320 119.320 120.465 -1.145 18090 5825 1 16 . 1 1 3 3 ASP HA H 129 4.400 4.400 4.761 -0.361 18090 5826 1 16 . 1 1 3 3 ASP C C 129 176.120 176.120 174.528 1.592 18090 5827 1 16 . 1 1 3 3 ASP CA C 129 54.050 54.050 54.596 -0.546 18090 5828 1 16 . 1 1 3 3 ASP CB C 129 40.770 40.770 43.211 -2.441 18090 5829 1 16 . 1 1 3 3 ASP H H 129 8.310 8.310 8.733 -0.423 18090 5830 1 16 . 1 1 4 4 LEU N N 130 122.280 122.280 118.534 3.746 18090 5831 1 16 . 1 1 4 4 LEU HA H 130 4.130 4.130 4.616 -0.486 18090 5832 1 16 . 1 1 4 4 LEU C C 130 177.280 177.280 176.034 1.246 18090 5833 1 16 . 1 1 4 4 LEU CA C 130 55.350 55.350 54.265 1.085 18090 5834 1 16 . 1 1 4 4 LEU CB C 130 41.490 41.490 45.184 -3.694 18090 5835 1 16 . 1 1 4 4 LEU H H 130 8.080 8.080 7.889 0.191 18090 5836 1 16 . 1 1 5 5 GLY N N 131 107.830 107.830 108.975 -1.145 18090 5837 1 16 . 1 1 5 5 GLY C C 131 175.120 175.120 173.092 2.028 18090 5838 1 16 . 1 1 5 5 GLY CA C 131 45.300 45.300 44.482 0.818 18090 5839 1 16 . 1 1 5 5 GLY H H 131 8.180 8.180 8.330 -0.150 18090 5840 1 16 . 1 1 6 6 LEU N N 132 121.080 121.080 116.464 4.616 18090 5841 1 16 . 1 1 6 6 LEU HA H 132 3.870 3.870 4.487 -0.617 18090 5842 1 16 . 1 1 6 6 LEU C C 132 178.000 178.000 177.534 0.466 18090 5843 1 16 . 1 1 6 6 LEU CA C 132 57.180 57.180 53.567 3.613 18090 5844 1 16 . 1 1 6 6 LEU CB C 132 41.870 41.870 44.533 -2.663 18090 5845 1 16 . 1 1 6 6 LEU H H 132 8.150 8.150 7.423 0.727 18090 5846 1 16 . 1 1 7 7 THR N N 133 111.580 111.580 113.927 -2.347 18090 5847 1 16 . 1 1 7 7 THR HA H 133 3.730 3.730 4.009 -0.279 18090 5848 1 16 . 1 1 7 7 THR C C 133 176.530 176.530 176.044 0.486 18090 5849 1 16 . 1 1 7 7 THR CA C 133 65.940 65.940 65.948 -0.008 18090 5850 1 16 . 1 1 7 7 THR CB C 133 68.130 68.130 68.542 -0.412 18090 5851 1 16 . 1 1 7 7 THR H H 133 7.970 7.970 8.716 -0.746 18090 5852 1 16 . 1 1 8 8 GLN N N 134 119.490 119.490 121.373 -1.883 18090 5853 1 16 . 1 1 8 8 GLN HA H 134 3.990 3.990 3.902 0.088 18090 5854 1 16 . 1 1 8 8 GLN C C 134 178.190 178.190 178.244 -0.054 18090 5855 1 16 . 1 1 8 8 GLN CA C 134 57.930 57.930 58.751 -0.821 18090 5856 1 16 . 1 1 8 8 GLN CB C 134 27.850 27.850 27.896 -0.046 18090 5857 1 16 . 1 1 8 8 GLN H H 134 7.890 7.890 8.328 -0.438 18090 5858 1 16 . 1 1 9 9 LEU N N 135 120.170 120.170 119.211 0.959 18090 5859 1 16 . 1 1 9 9 LEU HA H 135 3.820 3.820 3.920 -0.100 18090 5860 1 16 . 1 1 9 9 LEU C C 135 177.810 177.810 178.887 -1.077 18090 5861 1 16 . 1 1 9 9 LEU CA C 135 57.470 57.470 57.377 0.093 18090 5862 1 16 . 1 1 9 9 LEU CB C 135 41.640 41.640 41.693 -0.053 18090 5863 1 16 . 1 1 9 9 LEU H H 135 7.600 7.600 7.306 0.294 18090 5864 1 16 . 1 1 10 10 PHE N N 136 111.950 111.950 113.795 -1.845 18090 5865 1 16 . 1 1 10 10 PHE HA H 136 4.380 4.380 4.477 -0.097 18090 5866 1 16 . 1 1 10 10 PHE C C 136 174.990 174.990 177.411 -2.421 18090 5867 1 16 . 1 1 10 10 PHE CA C 136 58.450 58.450 57.712 0.738 18090 5868 1 16 . 1 1 10 10 PHE CB C 136 38.570 38.570 37.553 1.017 18090 5869 1 16 . 1 1 10 10 PHE H H 136 7.410 7.410 6.725 0.685 18090 5870 1 16 . 1 1 11 11 ALA N N 137 120.230 120.230 122.059 -1.829 18090 5871 1 16 . 1 1 11 11 ALA HA H 137 4.130 4.130 4.105 0.025 18090 5872 1 16 . 1 1 11 11 ALA C C 137 177.090 177.090 177.964 -0.874 18090 5873 1 16 . 1 1 11 11 ALA CA C 137 52.580 52.580 53.438 -0.858 18090 5874 1 16 . 1 1 11 11 ALA CB C 137 18.660 18.660 18.990 -0.330 18090 5875 1 16 . 1 1 11 11 ALA H H 137 7.330 7.330 8.414 -1.084 18090 5876 1 16 . 1 1 12 12 ASP N N 138 119.830 119.830 120.827 -0.997 18090 5877 1 16 . 1 1 12 12 ASP HA H 138 4.510 4.510 4.659 -0.149 18090 5878 1 16 . 1 1 12 12 ASP C C 138 176.370 176.370 174.963 1.407 18090 5879 1 16 . 1 1 12 12 ASP CA C 138 51.960 51.960 52.715 -0.756 18090 5880 1 16 . 1 1 12 12 ASP CB C 138 41.990 41.990 41.677 0.313 18090 5881 1 16 . 1 1 12 12 ASP H H 138 6.980 6.980 7.640 -0.660 18090 5882 1 16 . 1 1 13 13 PRO HA H 139 4.260 4.260 4.366 -0.106 18090 5883 1 16 . 1 1 13 13 PRO CA C 139 64.350 64.350 62.712 1.638 18090 5884 1 16 . 1 1 13 13 PRO CB C 139 31.760 31.760 32.428 -0.669 18090 5885 1 16 . 1 1 14 14 ASN N N 140 116.840 116.840 117.362 -0.522 18090 5886 1 16 . 1 1 14 14 ASN HA H 140 4.840 4.840 4.477 0.363 18090 5887 1 16 . 1 1 14 14 ASN C C 140 173.840 173.840 175.322 -1.482 18090 5888 1 16 . 1 1 14 14 ASN CA C 140 52.380 52.380 54.205 -1.825 18090 5889 1 16 . 1 1 14 14 ASN CB C 140 38.330 38.330 36.945 1.385 18090 5890 1 16 . 1 1 14 14 ASN H H 140 8.670 8.670 8.683 -0.013 18090 5891 1 16 . 1 1 15 15 LEU N N 141 120.290 120.290 120.418 -0.128 18090 5892 1 16 . 1 1 15 15 LEU HA H 141 3.790 3.790 4.542 -0.752 18090 5893 1 16 . 1 1 15 15 LEU C C 141 177.120 177.120 177.498 -0.378 18090 5894 1 16 . 1 1 15 15 LEU CA C 141 59.280 59.280 55.564 3.716 18090 5895 1 16 . 1 1 15 15 LEU CB C 141 42.980 42.980 43.157 -0.177 18090 5896 1 16 . 1 1 15 15 LEU H H 141 7.200 7.200 8.378 -1.178 18090 5897 1 16 . 1 1 16 16 ILE N N 142 115.290 115.290 120.293 -5.003 18090 5898 1 16 . 1 1 16 16 ILE HA H 142 3.480 3.480 3.723 -0.243 18090 5899 1 16 . 1 1 16 16 ILE C C 142 177.990 177.990 177.516 0.474 18090 5900 1 16 . 1 1 16 16 ILE CA C 142 62.690 62.690 65.395 -2.705 18090 5901 1 16 . 1 1 16 16 ILE CB C 142 34.620 34.620 37.639 -3.019 18090 5902 1 16 . 1 1 16 16 ILE H H 142 7.940 7.940 8.312 -0.372 18090 5903 1 16 . 1 1 17 17 GLU N N 143 119.600 119.600 119.020 0.580 18090 5904 1 16 . 1 1 17 17 GLU HA H 143 3.700 3.700 3.996 -0.296 18090 5905 1 16 . 1 1 17 17 GLU C C 143 179.170 179.170 178.727 0.443 18090 5906 1 16 . 1 1 17 17 GLU CA C 143 59.360 59.360 60.094 -0.734 18090 5907 1 16 . 1 1 17 17 GLU CB C 143 28.520 28.520 29.224 -0.704 18090 5908 1 16 . 1 1 17 17 GLU H H 143 7.970 7.970 8.544 -0.574 18090 5909 1 16 . 1 1 18 18 ASN N N 144 117.170 117.170 117.835 -0.665 18090 5910 1 16 . 1 1 18 18 ASN HA H 144 4.270 4.270 4.450 -0.180 18090 5911 1 16 . 1 1 18 18 ASN C C 144 179.120 179.120 177.795 1.325 18090 5912 1 16 . 1 1 18 18 ASN CA C 144 55.490 55.490 55.640 -0.150 18090 5913 1 16 . 1 1 18 18 ASN CB C 144 36.550 36.550 37.801 -1.251 18090 5914 1 16 . 1 1 18 18 ASN H H 144 8.450 8.450 8.369 0.081 18090 5915 1 16 . 1 1 19 19 LEU N N 145 121.060 121.060 119.091 1.969 18090 5916 1 16 . 1 1 19 19 LEU HA H 145 4.020 4.020 4.021 -0.001 18090 5917 1 16 . 1 1 19 19 LEU C C 145 180.260 180.260 178.133 2.127 18090 5918 1 16 . 1 1 19 19 LEU CA C 145 56.620 56.620 57.057 -0.437 18090 5919 1 16 . 1 1 19 19 LEU CB C 145 41.780 41.780 41.523 0.257 18090 5920 1 16 . 1 1 19 19 LEU H H 145 7.990 7.990 7.545 0.445 18090 5921 1 16 . 1 1 20 20 LYS N N 146 118.960 118.960 117.351 1.609 18090 5922 1 16 . 1 1 20 20 LYS HA H 146 3.610 3.610 3.966 -0.356 18090 5923 1 16 . 1 1 20 20 LYS C C 146 177.390 177.390 178.099 -0.709 18090 5924 1 16 . 1 1 20 20 LYS CA C 146 59.640 59.640 59.110 0.530 18090 5925 1 16 . 1 1 20 20 LYS CB C 146 32.450 32.450 32.369 0.081 18090 5926 1 16 . 1 1 20 20 LYS H H 146 8.250 8.250 7.825 0.425 18090 5927 1 16 . 1 1 21 21 LYS N N 147 114.720 114.720 116.498 -1.778 18090 5928 1 16 . 1 1 21 21 LYS HA H 147 4.110 4.110 4.216 -0.106 18090 5929 1 16 . 1 1 21 21 LYS C C 147 175.880 175.880 178.337 -2.457 18090 5930 1 16 . 1 1 21 21 LYS CA C 147 56.210 56.210 58.106 -1.896 18090 5931 1 16 . 1 1 21 21 LYS CB C 147 33.000 33.000 32.698 0.302 18090 5932 1 16 . 1 1 21 21 LYS H H 147 7.130 7.130 7.630 -0.500 18090 5933 1 16 . 1 1 22 22 ASN N N 148 122.180 122.180 115.397 6.783 18090 5934 1 16 . 1 1 22 22 ASN HA H 148 4.740 4.740 4.917 -0.177 18090 5935 1 16 . 1 1 22 22 ASN C C 148 174.000 174.000 173.515 0.485 18090 5936 1 16 . 1 1 22 22 ASN CA C 148 50.970 50.970 52.712 -1.742 18090 5937 1 16 . 1 1 22 22 ASN CB C 148 38.670 38.670 38.983 -0.313 18090 5938 1 16 . 1 1 22 22 ASN H H 148 6.930 6.930 7.884 -0.954 18090 5939 1 16 . 1 1 23 23 PRO HA H 149 4.300 4.300 4.698 -0.398 18090 5940 1 16 . 1 1 23 23 PRO CA C 149 64.610 64.610 62.000 2.610 18090 5941 1 16 . 1 1 23 23 PRO CB C 149 32.000 32.000 34.163 -2.163 18090 5942 1 16 . 1 1 24 24 LYS N N 150 116.060 116.060 121.120 -5.060 18090 5943 1 16 . 1 1 24 24 LYS HA H 150 4.070 4.070 3.961 0.109 18090 5944 1 16 . 1 1 24 24 LYS C C 150 178.240 178.240 178.275 -0.035 18090 5945 1 16 . 1 1 24 24 LYS CA C 150 57.950 57.950 59.523 -1.573 18090 5946 1 16 . 1 1 24 24 LYS CB C 150 32.590 32.590 31.843 0.747 18090 5947 1 16 . 1 1 24 24 LYS H H 150 8.520 8.520 8.820 -0.300 18090 5948 1 16 . 1 1 25 25 THR N N 151 105.190 105.190 110.799 -5.609 18090 5949 1 16 . 1 1 25 25 THR HA H 151 4.390 4.390 4.074 0.316 18090 5950 1 16 . 1 1 25 25 THR C C 151 176.090 176.090 176.123 -0.033 18090 5951 1 16 . 1 1 25 25 THR CA C 151 61.400 61.400 64.929 -3.529 18090 5952 1 16 . 1 1 25 25 THR CB C 151 69.440 69.440 67.619 1.821 18090 5953 1 16 . 1 1 25 25 THR H H 151 7.490 7.490 8.229 -0.739 18090 5954 1 16 . 1 1 26 26 SER N N 152 119.700 119.700 116.923 2.777 18090 5955 1 16 . 1 1 26 26 SER HA H 152 3.770 3.770 4.161 -0.391 18090 5956 1 16 . 1 1 26 26 SER C C 152 177.470 177.470 176.126 1.344 18090 5957 1 16 . 1 1 26 26 SER CA C 152 62.450 62.450 61.485 0.965 18090 5958 1 16 . 1 1 26 26 SER CB C 152 62.520 62.520 62.626 -0.106 18090 5959 1 16 . 1 1 26 26 SER H H 152 8.190 8.190 7.986 0.204 18090 5960 1 16 . 1 1 27 27 GLU N N 153 119.870 119.870 122.695 -2.825 18090 5961 1 16 . 1 1 27 27 GLU HA H 153 3.890 3.890 3.969 -0.079 18090 5962 1 16 . 1 1 27 27 GLU C C 153 180.040 180.040 178.742 1.298 18090 5963 1 16 . 1 1 27 27 GLU CA C 153 58.700 58.700 59.346 -0.645 18090 5964 1 16 . 1 1 27 27 GLU CB C 153 28.590 28.590 29.446 -0.856 18090 5965 1 16 . 1 1 27 27 GLU H H 153 8.350 8.350 7.871 0.479 18090 5966 1 16 . 1 1 28 28 MET N N 154 119.430 119.430 117.062 2.368 18090 5967 1 16 . 1 1 28 28 MET HA H 154 4.040 4.040 4.169 -0.129 18090 5968 1 16 . 1 1 28 28 MET C C 154 177.110 177.110 178.082 -0.972 18090 5969 1 16 . 1 1 28 28 MET CA C 154 58.510 58.510 58.685 -0.175 18090 5970 1 16 . 1 1 28 28 MET CB C 154 31.430 31.430 32.744 -1.314 18090 5971 1 16 . 1 1 28 28 MET H H 154 7.850 7.850 7.569 0.281 18090 5972 1 16 . 1 1 29 29 MET N N 155 112.640 112.640 114.161 -1.521 18090 5973 1 16 . 1 1 29 29 MET HA H 155 4.340 4.340 4.256 0.084 18090 5974 1 16 . 1 1 29 29 MET C C 155 175.530 175.530 177.822 -2.292 18090 5975 1 16 . 1 1 29 29 MET CA C 155 53.790 53.790 57.181 -3.391 18090 5976 1 16 . 1 1 29 29 MET CB C 155 30.380 30.380 32.067 -1.687 18090 5977 1 16 . 1 1 29 29 MET H H 155 7.200 7.200 7.361 -0.161 18090 5978 1 16 . 1 1 30 30 LYS N N 156 117.050 117.050 116.674 0.376 18090 5979 1 16 . 1 1 30 30 LYS HA H 156 3.960 3.960 4.275 -0.315 18090 5980 1 16 . 1 1 30 30 LYS C C 156 176.120 176.120 177.149 -1.029 18090 5981 1 16 . 1 1 30 30 LYS CA C 156 57.090 57.090 57.290 -0.200 18090 5982 1 16 . 1 1 30 30 LYS CB C 156 31.960 31.960 32.985 -1.025 18090 5983 1 16 . 1 1 30 30 LYS H H 156 7.130 7.130 7.647 -0.517 18090 5984 1 16 . 1 1 31 31 ASP N N 157 119.810 119.810 118.661 1.149 18090 5985 1 16 . 1 1 31 31 ASP HA H 157 4.860 4.860 4.978 -0.118 18090 5986 1 16 . 1 1 31 31 ASP C C 157 174.890 174.890 174.545 0.345 18090 5987 1 16 . 1 1 31 31 ASP CA C 157 50.520 50.520 54.475 -3.955 18090 5988 1 16 . 1 1 31 31 ASP CB C 157 41.010 41.010 40.753 0.257 18090 5989 1 16 . 1 1 31 31 ASP H H 157 7.340 7.340 7.740 -0.400 18090 5990 1 16 . 1 1 32 32 PRO HA H 158 4.130 4.130 4.462 -0.332 18090 5991 1 16 . 1 1 32 32 PRO CA C 158 64.270 64.270 62.983 1.287 18090 5992 1 16 . 1 1 32 32 PRO CB C 158 31.770 31.770 32.371 -0.601 18090 5993 1 16 . 1 1 33 33 GLN N N 159 117.760 117.760 120.299 -2.539 18090 5994 1 16 . 1 1 33 33 GLN HA H 159 4.000 4.000 4.044 -0.044 18090 5995 1 16 . 1 1 33 33 GLN C C 159 178.740 178.740 177.934 0.806 18090 5996 1 16 . 1 1 33 33 GLN CA C 159 58.220 58.220 58.016 0.204 18090 5997 1 16 . 1 1 33 33 GLN CB C 159 27.870 27.870 28.095 -0.225 18090 5998 1 16 . 1 1 33 33 GLN H H 159 8.150 8.150 8.766 -0.616 18090 5999 1 16 . 1 1 34 34 LEU N N 160 123.300 123.300 120.157 3.143 18090 6000 1 16 . 1 1 34 34 LEU HA H 160 3.970 3.970 4.024 -0.054 18090 6001 1 16 . 1 1 34 34 LEU C C 160 177.980 177.980 178.216 -0.236 18090 6002 1 16 . 1 1 34 34 LEU CA C 160 57.050 57.050 57.351 -0.301 18090 6003 1 16 . 1 1 34 34 LEU CB C 160 40.760 40.760 41.638 -0.878 18090 6004 1 16 . 1 1 34 34 LEU H H 160 7.110 7.110 7.996 -0.886 18090 6005 1 16 . 1 1 35 35 VAL N N 161 118.390 118.390 119.455 -1.065 18090 6006 1 16 . 1 1 35 35 VAL HA H 161 3.110 3.110 3.570 -0.460 18090 6007 1 16 . 1 1 35 35 VAL C C 161 176.840 176.840 177.965 -1.125 18090 6008 1 16 . 1 1 35 35 VAL CA C 161 67.700 67.700 66.218 1.482 18090 6009 1 16 . 1 1 35 35 VAL CB C 161 31.260 31.260 30.396 0.864 18090 6010 1 16 . 1 1 35 35 VAL H H 161 7.430 7.430 7.431 -0.001 18090 6011 1 16 . 1 1 36 36 ALA N N 162 117.600 117.600 121.849 -4.249 18090 6012 1 16 . 1 1 36 36 ALA HA H 162 3.810 3.810 3.940 -0.130 18090 6013 1 16 . 1 1 36 36 ALA C C 162 180.620 180.620 179.745 0.875 18090 6014 1 16 . 1 1 36 36 ALA CA C 162 54.720 54.720 55.383 -0.663 18090 6015 1 16 . 1 1 36 36 ALA CB C 162 17.490 17.490 18.194 -0.704 18090 6016 1 16 . 1 1 36 36 ALA H H 162 7.500 7.500 7.810 -0.310 18090 6017 1 16 . 1 1 37 37 LYS N N 163 119.880 119.880 118.453 1.427 18090 6018 1 16 . 1 1 37 37 LYS HA H 163 3.570 3.570 3.984 -0.414 18090 6019 1 16 . 1 1 37 37 LYS C C 163 177.800 177.800 179.181 -1.381 18090 6020 1 16 . 1 1 37 37 LYS CA C 163 58.880 58.880 58.916 -0.036 18090 6021 1 16 . 1 1 37 37 LYS CB C 163 31.610 31.610 32.014 -0.404 18090 6022 1 16 . 1 1 37 37 LYS H H 163 7.350 7.350 7.420 -0.070 18090 6023 1 16 . 1 1 38 38 LEU N N 164 118.020 118.020 120.197 -2.177 18090 6024 1 16 . 1 1 38 38 LEU HA H 164 3.670 3.670 3.996 -0.326 18090 6025 1 16 . 1 1 38 38 LEU C C 164 179.380 179.380 179.022 0.358 18090 6026 1 16 . 1 1 38 38 LEU CA C 164 57.340 57.340 57.929 -0.589 18090 6027 1 16 . 1 1 38 38 LEU CB C 164 41.660 41.660 41.766 -0.106 18090 6028 1 16 . 1 1 38 38 LEU H H 164 7.660 7.660 8.240 -0.580 18090 6029 1 16 . 1 1 39 39 ILE N N 165 118.070 118.070 118.212 -0.142 18090 6030 1 16 . 1 1 39 39 ILE HA H 165 3.510 3.510 3.626 -0.116 18090 6031 1 16 . 1 1 39 39 ILE C C 165 179.570 179.570 178.159 1.411 18090 6032 1 16 . 1 1 39 39 ILE CA C 165 64.450 64.450 65.435 -0.985 18090 6033 1 16 . 1 1 39 39 ILE CB C 165 37.310 37.310 37.488 -0.178 18090 6034 1 16 . 1 1 39 39 ILE H H 165 8.030 8.030 8.138 -0.108 18090 6035 1 16 . 1 1 40 40 GLY N N 166 107.970 107.970 107.858 0.112 18090 6036 1 16 . 1 1 40 40 GLY C C 166 176.470 176.470 175.667 0.803 18090 6037 1 16 . 1 1 40 40 GLY CA C 166 46.410 46.410 46.982 -0.572 18090 6038 1 16 . 1 1 40 40 GLY H H 166 7.590 7.590 7.641 -0.051 18090 6039 1 16 . 1 1 41 41 TYR N N 167 121.270 121.270 122.317 -1.047 18090 6040 1 16 . 1 1 41 41 TYR HA H 167 4.190 4.190 4.206 -0.016 18090 6041 1 16 . 1 1 41 41 TYR C C 167 176.470 176.470 176.219 0.251 18090 6042 1 16 . 1 1 41 41 TYR CA C 167 57.130 57.130 60.470 -3.340 18090 6043 1 16 . 1 1 41 41 TYR CB C 167 35.950 35.950 38.274 -2.324 18090 6044 1 16 . 1 1 41 41 TYR H H 167 7.350 7.350 7.732 -0.382 18090 6045 1 16 . 1 1 42 42 LYS N N 168 116.520 116.520 116.403 0.117 18090 6046 1 16 . 1 1 42 42 LYS HA H 168 3.820 3.820 4.005 -0.185 18090 6047 1 16 . 1 1 42 42 LYS C C 168 177.810 177.810 177.974 -0.164 18090 6048 1 16 . 1 1 42 42 LYS CA C 168 59.390 59.390 58.671 0.719 18090 6049 1 16 . 1 1 42 42 LYS CB C 168 31.580 31.580 32.607 -1.027 18090 6050 1 16 . 1 1 42 42 LYS H H 168 7.460 7.460 8.255 -0.795 18090 6051 1 16 . 1 1 43 43 GLN N N 169 113.750 113.750 115.822 -2.072 18090 6052 1 16 . 1 1 43 43 GLN HA H 169 4.220 4.220 4.159 0.061 18090 6053 1 16 . 1 1 43 43 GLN C C 169 175.840 175.840 177.456 -1.616 18090 6054 1 16 . 1 1 43 43 GLN CA C 169 56.230 56.230 58.054 -1.824 18090 6055 1 16 . 1 1 43 43 GLN CB C 169 29.290 29.290 29.319 -0.028 18090 6056 1 16 . 1 1 43 43 GLN H H 169 7.220 7.220 7.728 -0.508 18090 6057 1 16 . 1 1 44 44 ASN N N 170 114.130 114.130 116.271 -2.141 18090 6058 1 16 . 1 1 44 44 ASN HA H 170 5.050 5.050 4.942 0.108 18090 6059 1 16 . 1 1 44 44 ASN C C 170 172.200 172.200 173.628 -1.428 18090 6060 1 16 . 1 1 44 44 ASN CA C 170 50.780 50.780 53.434 -2.654 18090 6061 1 16 . 1 1 44 44 ASN CB C 170 38.380 38.380 39.509 -1.129 18090 6062 1 16 . 1 1 44 44 ASN H H 170 7.580 7.580 7.674 -0.094 18090 6063 1 16 . 1 1 45 45 PRO HA H 171 4.130 4.130 4.688 -0.558 18090 6064 1 16 . 1 1 45 45 PRO CA C 171 64.800 64.800 62.094 2.706 18090 6065 1 16 . 1 1 45 45 PRO CB C 171 31.360 31.360 31.927 -0.567 18090 6066 1 16 . 1 1 46 46 GLN N N 172 115.570 115.570 122.927 -7.357 18090 6067 1 16 . 1 1 46 46 GLN HA H 172 3.770 3.770 3.772 -0.002 18090 6068 1 16 . 1 1 46 46 GLN C C 172 177.360 177.360 177.641 -0.281 18090 6069 1 16 . 1 1 46 46 GLN CA C 172 57.950 57.950 58.183 -0.233 18090 6070 1 16 . 1 1 46 46 GLN CB C 172 27.050 27.050 27.902 -0.853 18090 6071 1 16 . 1 1 46 46 GLN H H 172 8.160 8.160 8.682 -0.522 18090 6072 1 16 . 1 1 47 47 ALA N N 173 121.420 121.420 121.642 -0.222 18090 6073 1 16 . 1 1 47 47 ALA HA H 173 4.050 4.050 4.168 -0.118 18090 6074 1 16 . 1 1 47 47 ALA C C 173 178.090 178.090 179.455 -1.365 18090 6075 1 16 . 1 1 47 47 ALA CA C 173 53.490 53.490 54.321 -0.831 18090 6076 1 16 . 1 1 47 47 ALA CB C 173 18.450 18.450 17.637 0.813 18090 6077 1 16 . 1 1 47 47 ALA H H 173 7.470 7.470 8.265 -0.795 18090 6078 1 16 . 1 1 48 48 ILE N N 174 118.050 118.050 118.645 -0.595 18090 6079 1 16 . 1 1 48 48 ILE HA H 174 3.180 3.180 3.870 -0.690 18090 6080 1 16 . 1 1 48 48 ILE C C 174 176.250 176.250 177.874 -1.624 18090 6081 1 16 . 1 1 48 48 ILE CA C 174 64.030 64.030 64.041 -0.011 18090 6082 1 16 . 1 1 48 48 ILE CB C 174 37.280 37.280 37.080 0.201 18090 6083 1 16 . 1 1 48 48 ILE H H 174 7.150 7.150 7.359 -0.209 18090 6084 1 16 . 1 1 49 49 GLY N N 175 105.390 105.390 106.911 -1.521 18090 6085 1 16 . 1 1 49 49 GLY C C 175 174.220 174.220 176.224 -2.004 18090 6086 1 16 . 1 1 49 49 GLY CA C 175 46.700 46.700 47.114 -0.414 18090 6087 1 16 . 1 1 49 49 GLY H H 175 7.550 7.550 7.813 -0.263 18090 6088 1 16 . 1 1 50 50 GLN N N 176 116.230 116.230 118.406 -2.176 18090 6089 1 16 . 1 1 50 50 GLN HA H 176 4.210 4.210 4.725 -0.515 18090 6090 1 16 . 1 1 50 50 GLN C C 176 178.120 178.120 178.235 -0.115 18090 6091 1 16 . 1 1 50 50 GLN CA C 176 57.320 57.320 58.072 -0.752 18090 6092 1 16 . 1 1 50 50 GLN CB C 176 28.630 28.630 28.922 -0.292 18090 6093 1 16 . 1 1 50 50 GLN H H 176 7.390 7.390 8.018 -0.628 18090 6094 1 16 . 1 1 51 51 ASP N N 177 120.000 120.000 121.135 -1.135 18090 6095 1 16 . 1 1 51 51 ASP HA H 177 4.420 4.420 4.679 -0.259 18090 6096 1 16 . 1 1 51 51 ASP C C 177 177.950 177.950 178.427 -0.477 18090 6097 1 16 . 1 1 51 51 ASP CA C 177 55.840 55.840 56.025 -0.185 18090 6098 1 16 . 1 1 51 51 ASP CB C 177 40.310 40.310 40.926 -0.616 18090 6099 1 16 . 1 1 51 51 ASP H H 177 7.870 7.870 7.896 -0.026 18090 6100 1 16 . 1 1 52 52 LEU N N 178 120.010 120.010 120.318 -0.308 18090 6101 1 16 . 1 1 52 52 LEU HA H 178 3.650 3.650 3.976 -0.326 18090 6102 1 16 . 1 1 52 52 LEU C C 178 175.810 175.810 178.270 -2.460 18090 6103 1 16 . 1 1 52 52 LEU CA C 178 57.620 57.620 57.778 -0.158 18090 6104 1 16 . 1 1 52 52 LEU CB C 178 41.880 41.880 41.656 0.224 18090 6105 1 16 . 1 1 52 52 LEU H H 178 7.860 7.860 7.579 0.281 18090 6106 1 16 . 1 1 53 53 PHE N N 179 110.580 110.580 113.666 -3.086 18090 6107 1 16 . 1 1 53 53 PHE HA H 179 4.230 4.230 4.313 -0.083 18090 6108 1 16 . 1 1 53 53 PHE C C 179 176.370 176.370 178.129 -1.759 18090 6109 1 16 . 1 1 53 53 PHE CA C 179 58.730 58.730 60.580 -1.849 18090 6110 1 16 . 1 1 53 53 PHE CB C 179 38.720 38.720 38.894 -0.174 18090 6111 1 16 . 1 1 53 53 PHE H H 179 7.210 7.210 7.768 -0.558 18090 6112 1 16 . 1 1 54 54 THR N N 180 108.190 108.190 110.324 -2.134 18090 6113 1 16 . 1 1 54 54 THR HA H 180 4.300 4.300 4.292 0.008 18090 6114 1 16 . 1 1 54 54 THR C C 180 174.400 174.400 175.393 -0.993 18090 6115 1 16 . 1 1 54 54 THR CA C 180 62.020 62.020 62.621 -0.601 18090 6116 1 16 . 1 1 54 54 THR CB C 180 69.730 69.730 70.029 -0.299 18090 6117 1 16 . 1 1 54 54 THR H H 180 7.550 7.550 7.598 -0.048 18090 6118 1 16 . 1 1 55 55 ASP N N 181 120.060 120.060 123.214 -3.154 18090 6119 1 16 . 1 1 55 55 ASP HA H 181 5.020 5.020 5.098 -0.078 18090 6120 1 16 . 1 1 55 55 ASP C C 181 174.120 174.120 175.406 -1.286 18090 6121 1 16 . 1 1 55 55 ASP CA C 181 50.560 50.560 50.894 -0.334 18090 6122 1 16 . 1 1 55 55 ASP CB C 181 41.190 41.190 43.094 -1.904 18090 6123 1 16 . 1 1 55 55 ASP H H 181 7.480 7.480 8.074 -0.594 18090 6124 1 16 . 1 1 56 56 PRO HA H 182 4.320 4.320 4.354 -0.034 18090 6125 1 16 . 1 1 56 56 PRO CA C 182 64.280 64.280 64.833 -0.553 18090 6126 1 16 . 1 1 56 56 PRO CB C 182 31.980 31.980 32.680 -0.700 18090 6127 1 16 . 1 1 57 57 ARG N N 183 117.660 117.660 118.404 -0.744 18090 6128 1 16 . 1 1 57 57 ARG HA H 183 3.960 3.960 4.111 -0.151 18090 6129 1 16 . 1 1 57 57 ARG C C 183 179.030 179.030 178.662 0.368 18090 6130 1 16 . 1 1 57 57 ARG CA C 183 59.000 59.000 58.788 0.212 18090 6131 1 16 . 1 1 57 57 ARG CB C 183 29.750 29.750 29.367 0.383 18090 6132 1 16 . 1 1 57 57 ARG H H 183 7.920 7.920 8.027 -0.107 18090 6133 1 16 . 1 1 58 58 LEU N N 184 115.670 115.670 119.452 -3.782 18090 6134 1 16 . 1 1 58 58 LEU HA H 184 3.850 3.850 3.971 -0.121 18090 6135 1 16 . 1 1 58 58 LEU C C 184 178.770 178.770 179.081 -0.311 18090 6136 1 16 . 1 1 58 58 LEU CA C 184 57.110 57.110 57.705 -0.595 18090 6137 1 16 . 1 1 58 58 LEU CB C 184 41.310 41.310 41.612 -0.302 18090 6138 1 16 . 1 1 58 58 LEU H H 184 7.750 7.750 8.210 -0.460 18090 6139 1 16 . 1 1 59 59 MET N N 185 118.570 118.570 116.342 2.228 18090 6140 1 16 . 1 1 59 59 MET HA H 185 4.060 4.060 4.134 -0.074 18090 6141 1 16 . 1 1 59 59 MET C C 185 177.540 177.540 178.198 -0.658 18090 6142 1 16 . 1 1 59 59 MET CA C 185 58.090 58.090 59.252 -1.162 18090 6143 1 16 . 1 1 59 59 MET CB C 185 31.270 31.270 32.284 -1.014 18090 6144 1 16 . 1 1 59 59 MET H H 185 7.590 7.590 7.690 -0.100 18090 6145 1 16 . 1 1 60 60 THR N N 186 116.390 116.390 117.854 -1.464 18090 6146 1 16 . 1 1 60 60 THR HA H 186 3.680 3.680 3.953 -0.273 18090 6147 1 16 . 1 1 60 60 THR C C 186 177.440 177.440 176.586 0.854 18090 6148 1 16 . 1 1 60 60 THR CA C 186 66.940 66.940 66.619 0.321 18090 6149 1 16 . 1 1 60 60 THR CB C 186 68.030 68.030 68.440 -0.410 18090 6150 1 16 . 1 1 60 60 THR H H 186 7.180 7.180 7.766 -0.586 18090 6151 1 16 . 1 1 61 61 ILE N N 187 123.840 123.840 122.199 1.641 18090 6152 1 16 . 1 1 61 61 ILE HA H 187 3.290 3.290 3.757 -0.467 18090 6153 1 16 . 1 1 61 61 ILE C C 187 176.660 176.660 178.196 -1.536 18090 6154 1 16 . 1 1 61 61 ILE CA C 187 65.850 65.850 65.549 0.301 18090 6155 1 16 . 1 1 61 61 ILE CB C 187 37.640 37.640 37.886 -0.246 18090 6156 1 16 . 1 1 61 61 ILE H H 187 8.010 8.010 7.819 0.191 18090 6157 1 16 . 1 1 62 62 MET N N 188 118.210 118.210 118.286 -0.076 18090 6158 1 16 . 1 1 62 62 MET HA H 188 3.910 3.910 3.993 -0.083 18090 6159 1 16 . 1 1 62 62 MET C C 188 177.540 177.540 178.449 -0.909 18090 6160 1 16 . 1 1 62 62 MET CA C 188 58.530 58.530 58.857 -0.327 18090 6161 1 16 . 1 1 62 62 MET CB C 188 31.200 31.200 31.478 -0.278 18090 6162 1 16 . 1 1 62 62 MET H H 188 8.560 8.560 7.432 1.128 18090 6163 1 16 . 1 1 63 63 ALA N N 189 119.850 119.850 122.030 -2.180 18090 6164 1 16 . 1 1 63 63 ALA HA H 189 3.730 3.730 4.026 -0.296 18090 6165 1 16 . 1 1 63 63 ALA C C 189 179.550 179.550 179.486 0.064 18090 6166 1 16 . 1 1 63 63 ALA CA C 189 55.470 55.470 55.118 0.352 18090 6167 1 16 . 1 1 63 63 ALA CB C 189 17.640 17.640 18.460 -0.821 18090 6168 1 16 . 1 1 63 63 ALA H H 189 8.210 8.210 8.052 0.158 18090 6169 1 16 . 1 1 64 64 THR N N 190 114.570 114.570 113.785 0.785 18090 6170 1 16 . 1 1 64 64 THR HA H 190 3.790 3.790 3.970 -0.180 18090 6171 1 16 . 1 1 64 64 THR C C 190 177.640 177.640 176.748 0.892 18090 6172 1 16 . 1 1 64 64 THR CA C 190 66.690 66.690 66.159 0.531 18090 6173 1 16 . 1 1 64 64 THR CB C 190 68.310 68.310 68.559 -0.249 18090 6174 1 16 . 1 1 64 64 THR H H 190 7.740 7.740 7.640 0.100 18090 6175 1 16 . 1 1 65 65 LEU N N 191 122.410 122.410 121.935 0.475 18090 6176 1 16 . 1 1 65 65 LEU HA H 191 3.930 3.930 3.942 -0.012 18090 6177 1 16 . 1 1 65 65 LEU C C 191 178.470 178.470 179.532 -1.062 18090 6178 1 16 . 1 1 65 65 LEU CA C 191 57.120 57.120 58.147 -1.027 18090 6179 1 16 . 1 1 65 65 LEU CB C 191 41.830 41.830 41.726 0.104 18090 6180 1 16 . 1 1 65 65 LEU H H 191 8.180 8.180 7.652 0.528 18090 6181 1 16 . 1 1 66 66 MET N N 192 115.320 115.320 117.149 -1.829 18090 6182 1 16 . 1 1 66 66 MET HA H 192 4.090 4.090 4.304 -0.214 18090 6183 1 16 . 1 1 66 66 MET C C 192 176.090 176.090 178.287 -2.197 18090 6184 1 16 . 1 1 66 66 MET CA C 192 56.390 56.390 57.428 -1.038 18090 6185 1 16 . 1 1 66 66 MET CB C 192 33.770 33.770 31.874 1.896 18090 6186 1 16 . 1 1 66 66 MET H H 192 7.880 7.880 8.431 -0.551 18090 6187 1 16 . 1 1 67 67 GLY N N 193 107.490 107.490 105.074 2.416 18090 6188 1 16 . 1 1 67 67 GLY C C 193 174.390 174.390 174.841 -0.451 18090 6189 1 16 . 1 1 67 67 GLY CA C 193 45.880 45.880 44.967 0.913 18090 6190 1 16 . 1 1 67 67 GLY H H 193 7.580 7.580 8.178 -0.598 18090 6191 1 16 . 1 1 68 68 VAL N N 194 118.520 118.520 116.524 1.996 18090 6192 1 16 . 1 1 68 68 VAL HA H 194 3.940 3.940 3.626 0.314 18090 6193 1 16 . 1 1 68 68 VAL C C 194 174.760 174.760 174.781 -0.021 18090 6194 1 16 . 1 1 68 68 VAL CA C 194 61.510 61.510 63.411 -1.901 18090 6195 1 16 . 1 1 68 68 VAL CB C 194 32.670 32.670 30.099 2.571 18090 6196 1 16 . 1 1 68 68 VAL H H 194 7.840 7.840 7.344 0.496 18090 6197 1 16 . 1 1 69 69 ASP N N 195 124.550 124.550 117.494 7.056 18090 6198 1 16 . 1 1 69 69 ASP HA H 195 4.430 4.430 4.284 0.146 18090 6199 1 16 . 1 1 69 69 ASP C C 195 175.140 175.140 176.029 -0.889 18090 6200 1 16 . 1 1 69 69 ASP CA C 195 53.760 53.760 55.620 -1.860 18090 6201 1 16 . 1 1 69 69 ASP CB C 195 40.920 40.920 39.486 1.435 18090 6202 1 16 . 1 1 69 69 ASP H H 195 8.400 8.400 8.000 0.400 18090 6203 1 16 . 1 1 70 70 LEU N N 196 123.930 123.930 119.437 4.493 18090 6204 1 16 . 1 1 70 70 LEU HA H 196 4.200 4.200 4.230 -0.030 18090 6205 1 16 . 1 1 70 70 LEU C C 196 175.950 175.950 177.085 -1.135 18090 6206 1 16 . 1 1 70 70 LEU CA C 196 54.380 54.380 55.260 -0.880 18090 6207 1 16 . 1 1 70 70 LEU CB C 196 41.610 41.610 42.768 -1.158 18090 6208 1 16 . 1 1 70 70 LEU H H 196 8.160 8.160 7.751 0.409 18090 6209 1 17 . 1 1 2 2 PRO HA H 128 4.220 4.220 4.412 -0.192 18090 6210 1 17 . 1 1 2 2 PRO CA C 128 63.320 63.320 63.413 -0.093 18090 6211 1 17 . 1 1 2 2 PRO CB C 128 31.680 31.680 32.032 -0.352 18090 6212 1 17 . 1 1 3 3 ASP N N 129 119.320 119.320 119.396 -0.076 18090 6213 1 17 . 1 1 3 3 ASP HA H 129 4.400 4.400 4.391 0.009 18090 6214 1 17 . 1 1 3 3 ASP C C 129 176.120 176.120 174.807 1.313 18090 6215 1 17 . 1 1 3 3 ASP CA C 129 54.050 54.050 54.718 -0.668 18090 6216 1 17 . 1 1 3 3 ASP CB C 129 40.770 40.770 40.620 0.150 18090 6217 1 17 . 1 1 3 3 ASP H H 129 8.310 8.310 8.510 -0.200 18090 6218 1 17 . 1 1 4 4 LEU N N 130 122.280 122.280 121.621 0.659 18090 6219 1 17 . 1 1 4 4 LEU HA H 130 4.130 4.130 4.494 -0.364 18090 6220 1 17 . 1 1 4 4 LEU C C 130 177.280 177.280 176.661 0.619 18090 6221 1 17 . 1 1 4 4 LEU CA C 130 55.350 55.350 54.019 1.331 18090 6222 1 17 . 1 1 4 4 LEU CB C 130 41.490 41.490 44.998 -3.508 18090 6223 1 17 . 1 1 4 4 LEU H H 130 8.080 8.080 7.846 0.234 18090 6224 1 17 . 1 1 5 5 GLY N N 131 107.830 107.830 107.898 -0.068 18090 6225 1 17 . 1 1 5 5 GLY C C 131 175.120 175.120 172.933 2.187 18090 6226 1 17 . 1 1 5 5 GLY CA C 131 45.300 45.300 45.698 -0.398 18090 6227 1 17 . 1 1 5 5 GLY H H 131 8.180 8.180 8.248 -0.068 18090 6228 1 17 . 1 1 6 6 LEU N N 132 121.080 121.080 118.643 2.437 18090 6229 1 17 . 1 1 6 6 LEU HA H 132 3.870 3.870 4.467 -0.597 18090 6230 1 17 . 1 1 6 6 LEU C C 132 178.000 178.000 177.991 0.009 18090 6231 1 17 . 1 1 6 6 LEU CA C 132 57.180 57.180 53.648 3.532 18090 6232 1 17 . 1 1 6 6 LEU CB C 132 41.870 41.870 44.984 -3.114 18090 6233 1 17 . 1 1 6 6 LEU H H 132 8.150 8.150 7.698 0.452 18090 6234 1 17 . 1 1 7 7 THR N N 133 111.580 111.580 113.868 -2.288 18090 6235 1 17 . 1 1 7 7 THR HA H 133 3.730 3.730 4.013 -0.283 18090 6236 1 17 . 1 1 7 7 THR C C 133 176.530 176.530 176.152 0.378 18090 6237 1 17 . 1 1 7 7 THR CA C 133 65.940 65.940 66.124 -0.184 18090 6238 1 17 . 1 1 7 7 THR CB C 133 68.130 68.130 68.701 -0.571 18090 6239 1 17 . 1 1 7 7 THR H H 133 7.970 7.970 8.693 -0.723 18090 6240 1 17 . 1 1 8 8 GLN N N 134 119.490 119.490 121.271 -1.781 18090 6241 1 17 . 1 1 8 8 GLN HA H 134 3.990 3.990 3.980 0.010 18090 6242 1 17 . 1 1 8 8 GLN C C 134 178.190 178.190 178.524 -0.334 18090 6243 1 17 . 1 1 8 8 GLN CA C 134 57.930 57.930 58.550 -0.620 18090 6244 1 17 . 1 1 8 8 GLN CB C 134 27.850 27.850 27.881 -0.031 18090 6245 1 17 . 1 1 8 8 GLN H H 134 7.890 7.890 8.346 -0.456 18090 6246 1 17 . 1 1 9 9 LEU N N 135 120.170 120.170 118.375 1.795 18090 6247 1 17 . 1 1 9 9 LEU HA H 135 3.820 3.820 3.916 -0.096 18090 6248 1 17 . 1 1 9 9 LEU C C 135 177.810 177.810 178.745 -0.935 18090 6249 1 17 . 1 1 9 9 LEU CA C 135 57.470 57.470 57.173 0.297 18090 6250 1 17 . 1 1 9 9 LEU CB C 135 41.640 41.640 41.844 -0.204 18090 6251 1 17 . 1 1 9 9 LEU H H 135 7.600 7.600 7.346 0.254 18090 6252 1 17 . 1 1 10 10 PHE N N 136 111.950 111.950 113.770 -1.820 18090 6253 1 17 . 1 1 10 10 PHE HA H 136 4.380 4.380 4.514 -0.134 18090 6254 1 17 . 1 1 10 10 PHE C C 136 174.990 174.990 177.488 -2.498 18090 6255 1 17 . 1 1 10 10 PHE CA C 136 58.450 58.450 57.822 0.628 18090 6256 1 17 . 1 1 10 10 PHE CB C 136 38.570 38.570 37.741 0.829 18090 6257 1 17 . 1 1 10 10 PHE H H 136 7.410 7.410 6.579 0.831 18090 6258 1 17 . 1 1 11 11 ALA N N 137 120.230 120.230 122.849 -2.619 18090 6259 1 17 . 1 1 11 11 ALA HA H 137 4.130 4.130 4.050 0.080 18090 6260 1 17 . 1 1 11 11 ALA C C 137 177.090 177.090 177.695 -0.605 18090 6261 1 17 . 1 1 11 11 ALA CA C 137 52.580 52.580 53.480 -0.899 18090 6262 1 17 . 1 1 11 11 ALA CB C 137 18.660 18.660 18.716 -0.056 18090 6263 1 17 . 1 1 11 11 ALA H H 137 7.330 7.330 8.702 -1.372 18090 6264 1 17 . 1 1 12 12 ASP N N 138 119.830 119.830 120.302 -0.472 18090 6265 1 17 . 1 1 12 12 ASP HA H 138 4.510 4.510 4.544 -0.034 18090 6266 1 17 . 1 1 12 12 ASP C C 138 176.370 176.370 174.586 1.784 18090 6267 1 17 . 1 1 12 12 ASP CA C 138 51.960 51.960 53.407 -1.446 18090 6268 1 17 . 1 1 12 12 ASP CB C 138 41.990 41.990 41.485 0.505 18090 6269 1 17 . 1 1 12 12 ASP H H 138 6.980 6.980 7.650 -0.670 18090 6270 1 17 . 1 1 13 13 PRO HA H 139 4.260 4.260 4.373 -0.113 18090 6271 1 17 . 1 1 13 13 PRO CA C 139 64.350 64.350 63.603 0.747 18090 6272 1 17 . 1 1 13 13 PRO CB C 139 31.760 31.760 30.877 0.883 18090 6273 1 17 . 1 1 14 14 ASN N N 140 116.840 116.840 119.994 -3.154 18090 6274 1 17 . 1 1 14 14 ASN HA H 140 4.840 4.840 4.374 0.466 18090 6275 1 17 . 1 1 14 14 ASN C C 140 173.840 173.840 174.572 -0.732 18090 6276 1 17 . 1 1 14 14 ASN CA C 140 52.380 52.380 53.830 -1.450 18090 6277 1 17 . 1 1 14 14 ASN CB C 140 38.330 38.330 37.250 1.080 18090 6278 1 17 . 1 1 14 14 ASN H H 140 8.670 8.670 8.611 0.059 18090 6279 1 17 . 1 1 15 15 LEU N N 141 120.290 120.290 120.279 0.011 18090 6280 1 17 . 1 1 15 15 LEU HA H 141 3.790 3.790 4.650 -0.860 18090 6281 1 17 . 1 1 15 15 LEU C C 141 177.120 177.120 177.350 -0.230 18090 6282 1 17 . 1 1 15 15 LEU CA C 141 59.280 59.280 55.934 3.346 18090 6283 1 17 . 1 1 15 15 LEU CB C 141 42.980 42.980 42.895 0.085 18090 6284 1 17 . 1 1 15 15 LEU H H 141 7.200 7.200 8.494 -1.294 18090 6285 1 17 . 1 1 16 16 ILE N N 142 115.290 115.290 120.726 -5.436 18090 6286 1 17 . 1 1 16 16 ILE HA H 142 3.480 3.480 3.656 -0.176 18090 6287 1 17 . 1 1 16 16 ILE C C 142 177.990 177.990 177.458 0.532 18090 6288 1 17 . 1 1 16 16 ILE CA C 142 62.690 62.690 65.235 -2.545 18090 6289 1 17 . 1 1 16 16 ILE CB C 142 34.620 34.620 37.705 -3.085 18090 6290 1 17 . 1 1 16 16 ILE H H 142 7.940 7.940 8.417 -0.477 18090 6291 1 17 . 1 1 17 17 GLU N N 143 119.600 119.600 118.836 0.764 18090 6292 1 17 . 1 1 17 17 GLU HA H 143 3.700 3.700 4.033 -0.333 18090 6293 1 17 . 1 1 17 17 GLU C C 143 179.170 179.170 179.114 0.056 18090 6294 1 17 . 1 1 17 17 GLU CA C 143 59.360 59.360 60.006 -0.646 18090 6295 1 17 . 1 1 17 17 GLU CB C 143 28.520 28.520 29.205 -0.685 18090 6296 1 17 . 1 1 17 17 GLU H H 143 7.970 7.970 8.533 -0.563 18090 6297 1 17 . 1 1 18 18 ASN N N 144 117.170 117.170 118.655 -1.485 18090 6298 1 17 . 1 1 18 18 ASN HA H 144 4.270 4.270 4.466 -0.196 18090 6299 1 17 . 1 1 18 18 ASN C C 144 179.120 179.120 177.501 1.619 18090 6300 1 17 . 1 1 18 18 ASN CA C 144 55.490 55.490 55.545 -0.055 18090 6301 1 17 . 1 1 18 18 ASN CB C 144 36.550 36.550 37.816 -1.266 18090 6302 1 17 . 1 1 18 18 ASN H H 144 8.450 8.450 8.419 0.031 18090 6303 1 17 . 1 1 19 19 LEU N N 145 121.060 121.060 118.972 2.088 18090 6304 1 17 . 1 1 19 19 LEU HA H 145 4.020 4.020 4.030 -0.010 18090 6305 1 17 . 1 1 19 19 LEU C C 145 180.260 180.260 178.189 2.071 18090 6306 1 17 . 1 1 19 19 LEU CA C 145 56.620 56.620 57.083 -0.463 18090 6307 1 17 . 1 1 19 19 LEU CB C 145 41.780 41.780 41.490 0.290 18090 6308 1 17 . 1 1 19 19 LEU H H 145 7.990 7.990 7.699 0.291 18090 6309 1 17 . 1 1 20 20 LYS N N 146 118.960 118.960 118.032 0.928 18090 6310 1 17 . 1 1 20 20 LYS HA H 146 3.610 3.610 3.933 -0.323 18090 6311 1 17 . 1 1 20 20 LYS C C 146 177.390 177.390 179.118 -1.728 18090 6312 1 17 . 1 1 20 20 LYS CA C 146 59.640 59.640 59.682 -0.042 18090 6313 1 17 . 1 1 20 20 LYS CB C 146 32.450 32.450 32.236 0.214 18090 6314 1 17 . 1 1 20 20 LYS H H 146 8.250 8.250 7.881 0.369 18090 6315 1 17 . 1 1 21 21 LYS N N 147 114.720 114.720 117.869 -3.149 18090 6316 1 17 . 1 1 21 21 LYS HA H 147 4.110 4.110 4.168 -0.058 18090 6317 1 17 . 1 1 21 21 LYS C C 147 175.880 175.880 178.506 -2.626 18090 6318 1 17 . 1 1 21 21 LYS CA C 147 56.210 56.210 58.596 -2.386 18090 6319 1 17 . 1 1 21 21 LYS CB C 147 33.000 33.000 32.524 0.476 18090 6320 1 17 . 1 1 21 21 LYS H H 147 7.130 7.130 7.637 -0.507 18090 6321 1 17 . 1 1 22 22 ASN N N 148 122.180 122.180 115.439 6.741 18090 6322 1 17 . 1 1 22 22 ASN HA H 148 4.740 4.740 4.916 -0.176 18090 6323 1 17 . 1 1 22 22 ASN C C 148 174.000 174.000 173.516 0.484 18090 6324 1 17 . 1 1 22 22 ASN CA C 148 50.970 50.970 52.704 -1.734 18090 6325 1 17 . 1 1 22 22 ASN CB C 148 38.670 38.670 38.961 -0.291 18090 6326 1 17 . 1 1 22 22 ASN H H 148 6.930 6.930 7.885 -0.955 18090 6327 1 17 . 1 1 23 23 PRO HA H 149 4.300 4.300 4.744 -0.444 18090 6328 1 17 . 1 1 23 23 PRO CA C 149 64.610 64.610 61.815 2.795 18090 6329 1 17 . 1 1 23 23 PRO CB C 149 32.000 32.000 34.470 -2.470 18090 6330 1 17 . 1 1 24 24 LYS N N 150 116.060 116.060 121.238 -5.178 18090 6331 1 17 . 1 1 24 24 LYS HA H 150 4.070 4.070 3.939 0.131 18090 6332 1 17 . 1 1 24 24 LYS C C 150 178.240 178.240 178.587 -0.347 18090 6333 1 17 . 1 1 24 24 LYS CA C 150 57.950 57.950 59.712 -1.762 18090 6334 1 17 . 1 1 24 24 LYS CB C 150 32.590 32.590 31.928 0.662 18090 6335 1 17 . 1 1 24 24 LYS H H 150 8.520 8.520 8.818 -0.298 18090 6336 1 17 . 1 1 25 25 THR N N 151 105.190 105.190 109.825 -4.635 18090 6337 1 17 . 1 1 25 25 THR HA H 151 4.390 4.390 4.043 0.347 18090 6338 1 17 . 1 1 25 25 THR C C 151 176.090 176.090 176.353 -0.263 18090 6339 1 17 . 1 1 25 25 THR CA C 151 61.400 61.400 64.627 -3.227 18090 6340 1 17 . 1 1 25 25 THR CB C 151 69.440 69.440 67.791 1.649 18090 6341 1 17 . 1 1 25 25 THR H H 151 7.490 7.490 8.177 -0.687 18090 6342 1 17 . 1 1 26 26 SER N N 152 119.700 119.700 116.377 3.323 18090 6343 1 17 . 1 1 26 26 SER HA H 152 3.770 3.770 4.143 -0.373 18090 6344 1 17 . 1 1 26 26 SER C C 152 177.470 177.470 175.985 1.485 18090 6345 1 17 . 1 1 26 26 SER CA C 152 62.450 62.450 61.358 1.092 18090 6346 1 17 . 1 1 26 26 SER CB C 152 62.520 62.520 62.751 -0.231 18090 6347 1 17 . 1 1 26 26 SER H H 152 8.190 8.190 7.973 0.217 18090 6348 1 17 . 1 1 27 27 GLU N N 153 119.870 119.870 122.698 -2.828 18090 6349 1 17 . 1 1 27 27 GLU HA H 153 3.890 3.890 3.966 -0.076 18090 6350 1 17 . 1 1 27 27 GLU C C 153 180.040 180.040 178.698 1.342 18090 6351 1 17 . 1 1 27 27 GLU CA C 153 58.700 58.700 59.362 -0.662 18090 6352 1 17 . 1 1 27 27 GLU CB C 153 28.590 28.590 29.444 -0.854 18090 6353 1 17 . 1 1 27 27 GLU H H 153 8.350 8.350 7.807 0.543 18090 6354 1 17 . 1 1 28 28 MET N N 154 119.430 119.430 116.933 2.497 18090 6355 1 17 . 1 1 28 28 MET HA H 154 4.040 4.040 4.139 -0.099 18090 6356 1 17 . 1 1 28 28 MET C C 154 177.110 177.110 178.398 -1.288 18090 6357 1 17 . 1 1 28 28 MET CA C 154 58.510 58.510 58.453 0.057 18090 6358 1 17 . 1 1 28 28 MET CB C 154 31.430 31.430 32.636 -1.206 18090 6359 1 17 . 1 1 28 28 MET H H 154 7.850 7.850 7.557 0.293 18090 6360 1 17 . 1 1 29 29 MET N N 155 112.640 112.640 114.490 -1.850 18090 6361 1 17 . 1 1 29 29 MET HA H 155 4.340 4.340 4.279 0.061 18090 6362 1 17 . 1 1 29 29 MET C C 155 175.530 175.530 177.871 -2.341 18090 6363 1 17 . 1 1 29 29 MET CA C 155 53.790 53.790 56.871 -3.081 18090 6364 1 17 . 1 1 29 29 MET CB C 155 30.380 30.380 32.083 -1.703 18090 6365 1 17 . 1 1 29 29 MET H H 155 7.200 7.200 7.499 -0.299 18090 6366 1 17 . 1 1 30 30 LYS N N 156 117.050 117.050 117.145 -0.095 18090 6367 1 17 . 1 1 30 30 LYS HA H 156 3.960 3.960 4.252 -0.292 18090 6368 1 17 . 1 1 30 30 LYS C C 156 176.120 176.120 176.994 -0.874 18090 6369 1 17 . 1 1 30 30 LYS CA C 156 57.090 57.090 57.404 -0.314 18090 6370 1 17 . 1 1 30 30 LYS CB C 156 31.960 31.960 32.976 -1.016 18090 6371 1 17 . 1 1 30 30 LYS H H 156 7.130 7.130 7.678 -0.548 18090 6372 1 17 . 1 1 31 31 ASP N N 157 119.810 119.810 117.914 1.896 18090 6373 1 17 . 1 1 31 31 ASP HA H 157 4.860 4.860 4.900 -0.040 18090 6374 1 17 . 1 1 31 31 ASP C C 157 174.890 174.890 174.298 0.592 18090 6375 1 17 . 1 1 31 31 ASP CA C 157 50.520 50.520 54.501 -3.981 18090 6376 1 17 . 1 1 31 31 ASP CB C 157 41.010 41.010 40.831 0.179 18090 6377 1 17 . 1 1 31 31 ASP H H 157 7.340 7.340 7.743 -0.403 18090 6378 1 17 . 1 1 32 32 PRO HA H 158 4.130 4.130 4.456 -0.326 18090 6379 1 17 . 1 1 32 32 PRO CA C 158 64.270 64.270 62.828 1.442 18090 6380 1 17 . 1 1 32 32 PRO CB C 158 31.770 31.770 32.412 -0.642 18090 6381 1 17 . 1 1 33 33 GLN N N 159 117.760 117.760 120.274 -2.514 18090 6382 1 17 . 1 1 33 33 GLN HA H 159 4.000 4.000 4.043 -0.043 18090 6383 1 17 . 1 1 33 33 GLN C C 159 178.740 178.740 177.943 0.797 18090 6384 1 17 . 1 1 33 33 GLN CA C 159 58.220 58.220 58.015 0.205 18090 6385 1 17 . 1 1 33 33 GLN CB C 159 27.870 27.870 28.084 -0.214 18090 6386 1 17 . 1 1 33 33 GLN H H 159 8.150 8.150 8.766 -0.616 18090 6387 1 17 . 1 1 34 34 LEU N N 160 123.300 123.300 120.046 3.254 18090 6388 1 17 . 1 1 34 34 LEU HA H 160 3.970 3.970 4.006 -0.036 18090 6389 1 17 . 1 1 34 34 LEU C C 160 177.980 177.980 178.129 -0.149 18090 6390 1 17 . 1 1 34 34 LEU CA C 160 57.050 57.050 57.251 -0.201 18090 6391 1 17 . 1 1 34 34 LEU CB C 160 40.760 40.760 41.672 -0.912 18090 6392 1 17 . 1 1 34 34 LEU H H 160 7.110 7.110 7.984 -0.874 18090 6393 1 17 . 1 1 35 35 VAL N N 161 118.390 118.390 119.425 -1.035 18090 6394 1 17 . 1 1 35 35 VAL HA H 161 3.110 3.110 3.503 -0.393 18090 6395 1 17 . 1 1 35 35 VAL C C 161 176.840 176.840 177.673 -0.833 18090 6396 1 17 . 1 1 35 35 VAL CA C 161 67.700 67.700 66.942 0.758 18090 6397 1 17 . 1 1 35 35 VAL CB C 161 31.260 31.260 31.343 -0.083 18090 6398 1 17 . 1 1 35 35 VAL H H 161 7.430 7.430 7.401 0.029 18090 6399 1 17 . 1 1 36 36 ALA N N 162 117.600 117.600 121.250 -3.650 18090 6400 1 17 . 1 1 36 36 ALA HA H 162 3.810 3.810 3.939 -0.129 18090 6401 1 17 . 1 1 36 36 ALA C C 162 180.620 180.620 179.609 1.011 18090 6402 1 17 . 1 1 36 36 ALA CA C 162 54.720 54.720 55.328 -0.608 18090 6403 1 17 . 1 1 36 36 ALA CB C 162 17.490 17.490 18.093 -0.603 18090 6404 1 17 . 1 1 36 36 ALA H H 162 7.500 7.500 7.766 -0.266 18090 6405 1 17 . 1 1 37 37 LYS N N 163 119.880 119.880 118.493 1.387 18090 6406 1 17 . 1 1 37 37 LYS HA H 163 3.570 3.570 3.985 -0.415 18090 6407 1 17 . 1 1 37 37 LYS C C 163 177.800 177.800 179.128 -1.328 18090 6408 1 17 . 1 1 37 37 LYS CA C 163 58.880 58.880 58.939 -0.059 18090 6409 1 17 . 1 1 37 37 LYS CB C 163 31.610 31.610 32.024 -0.414 18090 6410 1 17 . 1 1 37 37 LYS H H 163 7.350 7.350 7.401 -0.051 18090 6411 1 17 . 1 1 38 38 LEU N N 164 118.020 118.020 119.841 -1.821 18090 6412 1 17 . 1 1 38 38 LEU HA H 164 3.670 3.670 4.020 -0.350 18090 6413 1 17 . 1 1 38 38 LEU C C 164 179.380 179.380 179.095 0.285 18090 6414 1 17 . 1 1 38 38 LEU CA C 164 57.340 57.340 57.829 -0.489 18090 6415 1 17 . 1 1 38 38 LEU CB C 164 41.660 41.660 41.720 -0.060 18090 6416 1 17 . 1 1 38 38 LEU H H 164 7.660 7.660 8.113 -0.453 18090 6417 1 17 . 1 1 39 39 ILE N N 165 118.070 118.070 118.289 -0.219 18090 6418 1 17 . 1 1 39 39 ILE HA H 165 3.510 3.510 3.682 -0.172 18090 6419 1 17 . 1 1 39 39 ILE C C 165 179.570 179.570 178.096 1.474 18090 6420 1 17 . 1 1 39 39 ILE CA C 165 64.450 64.450 65.434 -0.984 18090 6421 1 17 . 1 1 39 39 ILE CB C 165 37.310 37.310 37.420 -0.110 18090 6422 1 17 . 1 1 39 39 ILE H H 165 8.030 8.030 7.947 0.083 18090 6423 1 17 . 1 1 40 40 GLY N N 166 107.970 107.970 108.001 -0.031 18090 6424 1 17 . 1 1 40 40 GLY C C 166 176.470 176.470 175.698 0.772 18090 6425 1 17 . 1 1 40 40 GLY CA C 166 46.410 46.410 46.960 -0.550 18090 6426 1 17 . 1 1 40 40 GLY H H 166 7.590 7.590 7.635 -0.045 18090 6427 1 17 . 1 1 41 41 TYR N N 167 121.270 121.270 122.287 -1.017 18090 6428 1 17 . 1 1 41 41 TYR HA H 167 4.190 4.190 4.203 -0.013 18090 6429 1 17 . 1 1 41 41 TYR C C 167 176.470 176.470 176.169 0.301 18090 6430 1 17 . 1 1 41 41 TYR CA C 167 57.130 57.130 60.476 -3.346 18090 6431 1 17 . 1 1 41 41 TYR CB C 167 35.950 35.950 38.232 -2.282 18090 6432 1 17 . 1 1 41 41 TYR H H 167 7.350 7.350 7.895 -0.545 18090 6433 1 17 . 1 1 42 42 LYS N N 168 116.520 116.520 116.034 0.486 18090 6434 1 17 . 1 1 42 42 LYS HA H 168 3.820 3.820 4.046 -0.226 18090 6435 1 17 . 1 1 42 42 LYS C C 168 177.810 177.810 177.879 -0.069 18090 6436 1 17 . 1 1 42 42 LYS CA C 168 59.390 59.390 58.363 1.027 18090 6437 1 17 . 1 1 42 42 LYS CB C 168 31.580 31.580 32.753 -1.173 18090 6438 1 17 . 1 1 42 42 LYS H H 168 7.460 7.460 8.198 -0.738 18090 6439 1 17 . 1 1 43 43 GLN N N 169 113.750 113.750 116.173 -2.423 18090 6440 1 17 . 1 1 43 43 GLN HA H 169 4.220 4.220 4.175 0.045 18090 6441 1 17 . 1 1 43 43 GLN C C 169 175.840 175.840 177.336 -1.496 18090 6442 1 17 . 1 1 43 43 GLN CA C 169 56.230 56.230 58.151 -1.921 18090 6443 1 17 . 1 1 43 43 GLN CB C 169 29.290 29.290 29.308 -0.018 18090 6444 1 17 . 1 1 43 43 GLN H H 169 7.220 7.220 7.637 -0.417 18090 6445 1 17 . 1 1 44 44 ASN N N 170 114.130 114.130 116.340 -2.210 18090 6446 1 17 . 1 1 44 44 ASN HA H 170 5.050 5.050 4.988 0.062 18090 6447 1 17 . 1 1 44 44 ASN C C 170 172.200 172.200 173.657 -1.457 18090 6448 1 17 . 1 1 44 44 ASN CA C 170 50.780 50.780 53.507 -2.727 18090 6449 1 17 . 1 1 44 44 ASN CB C 170 38.380 38.380 39.886 -1.506 18090 6450 1 17 . 1 1 44 44 ASN H H 170 7.580 7.580 7.642 -0.062 18090 6451 1 17 . 1 1 45 45 PRO HA H 171 4.130 4.130 4.698 -0.568 18090 6452 1 17 . 1 1 45 45 PRO CA C 171 64.800 64.800 62.185 2.615 18090 6453 1 17 . 1 1 45 45 PRO CB C 171 31.360 31.360 31.722 -0.362 18090 6454 1 17 . 1 1 46 46 GLN N N 172 115.570 115.570 124.859 -9.289 18090 6455 1 17 . 1 1 46 46 GLN HA H 172 3.770 3.770 3.828 -0.058 18090 6456 1 17 . 1 1 46 46 GLN C C 172 177.360 177.360 177.604 -0.244 18090 6457 1 17 . 1 1 46 46 GLN CA C 172 57.950 57.950 58.220 -0.270 18090 6458 1 17 . 1 1 46 46 GLN CB C 172 27.050 27.050 27.662 -0.612 18090 6459 1 17 . 1 1 46 46 GLN H H 172 8.160 8.160 8.541 -0.381 18090 6460 1 17 . 1 1 47 47 ALA N N 173 121.420 121.420 121.817 -0.397 18090 6461 1 17 . 1 1 47 47 ALA HA H 173 4.050 4.050 4.157 -0.107 18090 6462 1 17 . 1 1 47 47 ALA C C 173 178.090 178.090 179.479 -1.389 18090 6463 1 17 . 1 1 47 47 ALA CA C 173 53.490 53.490 53.911 -0.421 18090 6464 1 17 . 1 1 47 47 ALA CB C 173 18.450 18.450 17.627 0.823 18090 6465 1 17 . 1 1 47 47 ALA H H 173 7.470 7.470 8.086 -0.616 18090 6466 1 17 . 1 1 48 48 ILE N N 174 118.050 118.050 118.687 -0.637 18090 6467 1 17 . 1 1 48 48 ILE HA H 174 3.180 3.180 3.863 -0.683 18090 6468 1 17 . 1 1 48 48 ILE C C 174 176.250 176.250 177.864 -1.614 18090 6469 1 17 . 1 1 48 48 ILE CA C 174 64.030 64.030 64.068 -0.038 18090 6470 1 17 . 1 1 48 48 ILE CB C 174 37.280 37.280 37.073 0.207 18090 6471 1 17 . 1 1 48 48 ILE H H 174 7.150 7.150 7.335 -0.185 18090 6472 1 17 . 1 1 49 49 GLY N N 175 105.390 105.390 106.613 -1.223 18090 6473 1 17 . 1 1 49 49 GLY C C 175 174.220 174.220 176.009 -1.789 18090 6474 1 17 . 1 1 49 49 GLY CA C 175 46.700 46.700 47.026 -0.326 18090 6475 1 17 . 1 1 49 49 GLY H H 175 7.550 7.550 7.764 -0.214 18090 6476 1 17 . 1 1 50 50 GLN N N 176 116.230 116.230 118.716 -2.486 18090 6477 1 17 . 1 1 50 50 GLN HA H 176 4.210 4.210 4.576 -0.366 18090 6478 1 17 . 1 1 50 50 GLN C C 176 178.120 178.120 178.365 -0.245 18090 6479 1 17 . 1 1 50 50 GLN CA C 176 57.320 57.320 58.057 -0.737 18090 6480 1 17 . 1 1 50 50 GLN CB C 176 28.630 28.630 29.212 -0.582 18090 6481 1 17 . 1 1 50 50 GLN H H 176 7.390 7.390 8.049 -0.659 18090 6482 1 17 . 1 1 51 51 ASP N N 177 120.000 120.000 121.016 -1.016 18090 6483 1 17 . 1 1 51 51 ASP HA H 177 4.420 4.420 4.625 -0.205 18090 6484 1 17 . 1 1 51 51 ASP C C 177 177.950 177.950 178.324 -0.374 18090 6485 1 17 . 1 1 51 51 ASP CA C 177 55.840 55.840 56.037 -0.197 18090 6486 1 17 . 1 1 51 51 ASP CB C 177 40.310 40.310 40.788 -0.478 18090 6487 1 17 . 1 1 51 51 ASP H H 177 7.870 7.870 7.851 0.019 18090 6488 1 17 . 1 1 52 52 LEU N N 178 120.010 120.010 120.475 -0.465 18090 6489 1 17 . 1 1 52 52 LEU HA H 178 3.650 3.650 3.967 -0.317 18090 6490 1 17 . 1 1 52 52 LEU C C 178 175.810 175.810 178.300 -2.490 18090 6491 1 17 . 1 1 52 52 LEU CA C 178 57.620 57.620 57.850 -0.230 18090 6492 1 17 . 1 1 52 52 LEU CB C 178 41.880 41.880 41.663 0.217 18090 6493 1 17 . 1 1 52 52 LEU H H 178 7.860 7.860 7.580 0.280 18090 6494 1 17 . 1 1 53 53 PHE N N 179 110.580 110.580 113.626 -3.046 18090 6495 1 17 . 1 1 53 53 PHE HA H 179 4.230 4.230 4.312 -0.082 18090 6496 1 17 . 1 1 53 53 PHE C C 179 176.370 176.370 178.125 -1.755 18090 6497 1 17 . 1 1 53 53 PHE CA C 179 58.730 58.730 60.452 -1.722 18090 6498 1 17 . 1 1 53 53 PHE CB C 179 38.720 38.720 38.866 -0.146 18090 6499 1 17 . 1 1 53 53 PHE H H 179 7.210 7.210 7.900 -0.690 18090 6500 1 17 . 1 1 54 54 THR N N 180 108.190 108.190 109.093 -0.903 18090 6501 1 17 . 1 1 54 54 THR HA H 180 4.300 4.300 4.275 0.025 18090 6502 1 17 . 1 1 54 54 THR C C 180 174.400 174.400 175.295 -0.895 18090 6503 1 17 . 1 1 54 54 THR CA C 180 62.020 62.020 62.188 -0.168 18090 6504 1 17 . 1 1 54 54 THR CB C 180 69.730 69.730 69.921 -0.191 18090 6505 1 17 . 1 1 54 54 THR H H 180 7.550 7.550 7.469 0.081 18090 6506 1 17 . 1 1 55 55 ASP N N 181 120.060 120.060 122.844 -2.784 18090 6507 1 17 . 1 1 55 55 ASP HA H 181 5.020 5.020 5.090 -0.070 18090 6508 1 17 . 1 1 55 55 ASP C C 181 174.120 174.120 175.318 -1.198 18090 6509 1 17 . 1 1 55 55 ASP CA C 181 50.560 50.560 50.759 -0.199 18090 6510 1 17 . 1 1 55 55 ASP CB C 181 41.190 41.190 43.022 -1.832 18090 6511 1 17 . 1 1 55 55 ASP H H 181 7.480 7.480 8.027 -0.547 18090 6512 1 17 . 1 1 56 56 PRO HA H 182 4.320 4.320 4.361 -0.041 18090 6513 1 17 . 1 1 56 56 PRO CA C 182 64.280 64.280 64.782 -0.502 18090 6514 1 17 . 1 1 56 56 PRO CB C 182 31.980 31.980 32.617 -0.637 18090 6515 1 17 . 1 1 57 57 ARG N N 183 117.660 117.660 118.396 -0.736 18090 6516 1 17 . 1 1 57 57 ARG HA H 183 3.960 3.960 4.115 -0.155 18090 6517 1 17 . 1 1 57 57 ARG C C 183 179.030 179.030 178.657 0.373 18090 6518 1 17 . 1 1 57 57 ARG CA C 183 59.000 59.000 58.771 0.229 18090 6519 1 17 . 1 1 57 57 ARG CB C 183 29.750 29.750 29.373 0.377 18090 6520 1 17 . 1 1 57 57 ARG H H 183 7.920 7.920 8.002 -0.082 18090 6521 1 17 . 1 1 58 58 LEU N N 184 115.670 115.670 119.468 -3.798 18090 6522 1 17 . 1 1 58 58 LEU HA H 184 3.850 3.850 3.962 -0.112 18090 6523 1 17 . 1 1 58 58 LEU C C 184 178.770 178.770 179.107 -0.337 18090 6524 1 17 . 1 1 58 58 LEU CA C 184 57.110 57.110 57.737 -0.627 18090 6525 1 17 . 1 1 58 58 LEU CB C 184 41.310 41.310 41.638 -0.328 18090 6526 1 17 . 1 1 58 58 LEU H H 184 7.750 7.750 8.212 -0.462 18090 6527 1 17 . 1 1 59 59 MET N N 185 118.570 118.570 116.246 2.324 18090 6528 1 17 . 1 1 59 59 MET HA H 185 4.060 4.060 4.172 -0.112 18090 6529 1 17 . 1 1 59 59 MET C C 185 177.540 177.540 178.078 -0.538 18090 6530 1 17 . 1 1 59 59 MET CA C 185 58.090 58.090 59.150 -1.060 18090 6531 1 17 . 1 1 59 59 MET CB C 185 31.270 31.270 32.282 -1.012 18090 6532 1 17 . 1 1 59 59 MET H H 185 7.590 7.590 7.677 -0.087 18090 6533 1 17 . 1 1 60 60 THR N N 186 116.390 116.390 117.629 -1.239 18090 6534 1 17 . 1 1 60 60 THR HA H 186 3.680 3.680 4.007 -0.327 18090 6535 1 17 . 1 1 60 60 THR C C 186 177.440 177.440 176.319 1.121 18090 6536 1 17 . 1 1 60 60 THR CA C 186 66.940 66.940 67.289 -0.349 18090 6537 1 17 . 1 1 60 60 THR CB C 186 68.030 68.030 68.217 -0.187 18090 6538 1 17 . 1 1 60 60 THR H H 186 7.180 7.180 7.820 -0.640 18090 6539 1 17 . 1 1 61 61 ILE N N 187 123.840 123.840 122.689 1.151 18090 6540 1 17 . 1 1 61 61 ILE HA H 187 3.290 3.290 3.742 -0.452 18090 6541 1 17 . 1 1 61 61 ILE C C 187 176.660 176.660 178.019 -1.359 18090 6542 1 17 . 1 1 61 61 ILE CA C 187 65.850 65.850 65.234 0.616 18090 6543 1 17 . 1 1 61 61 ILE CB C 187 37.640 37.640 37.687 -0.047 18090 6544 1 17 . 1 1 61 61 ILE H H 187 8.010 8.010 7.918 0.092 18090 6545 1 17 . 1 1 62 62 MET N N 188 118.210 118.210 118.498 -0.288 18090 6546 1 17 . 1 1 62 62 MET HA H 188 3.910 3.910 4.031 -0.121 18090 6547 1 17 . 1 1 62 62 MET C C 188 177.540 177.540 178.399 -0.859 18090 6548 1 17 . 1 1 62 62 MET CA C 188 58.530 58.530 57.475 1.055 18090 6549 1 17 . 1 1 62 62 MET CB C 188 31.200 31.200 31.241 -0.041 18090 6550 1 17 . 1 1 62 62 MET H H 188 8.560 8.560 7.541 1.019 18090 6551 1 17 . 1 1 63 63 ALA N N 189 119.850 119.850 122.446 -2.596 18090 6552 1 17 . 1 1 63 63 ALA HA H 189 3.730 3.730 3.887 -0.157 18090 6553 1 17 . 1 1 63 63 ALA C C 189 179.550 179.550 179.250 0.300 18090 6554 1 17 . 1 1 63 63 ALA CA C 189 55.470 55.470 55.513 -0.043 18090 6555 1 17 . 1 1 63 63 ALA CB C 189 17.640 17.640 18.220 -0.580 18090 6556 1 17 . 1 1 63 63 ALA H H 189 8.210 8.210 8.147 0.063 18090 6557 1 17 . 1 1 64 64 THR N N 190 114.570 114.570 113.551 1.019 18090 6558 1 17 . 1 1 64 64 THR HA H 190 3.790 3.790 4.013 -0.223 18090 6559 1 17 . 1 1 64 64 THR C C 190 177.640 177.640 176.837 0.803 18090 6560 1 17 . 1 1 64 64 THR CA C 190 66.690 66.690 65.342 1.348 18090 6561 1 17 . 1 1 64 64 THR CB C 190 68.310 68.310 68.767 -0.457 18090 6562 1 17 . 1 1 64 64 THR H H 190 7.740 7.740 7.603 0.137 18090 6563 1 17 . 1 1 65 65 LEU N N 191 122.410 122.410 122.207 0.203 18090 6564 1 17 . 1 1 65 65 LEU HA H 191 3.930 3.930 3.931 -0.001 18090 6565 1 17 . 1 1 65 65 LEU C C 191 178.470 178.470 179.565 -1.095 18090 6566 1 17 . 1 1 65 65 LEU CA C 191 57.120 57.120 57.996 -0.876 18090 6567 1 17 . 1 1 65 65 LEU CB C 191 41.830 41.830 41.750 0.080 18090 6568 1 17 . 1 1 65 65 LEU H H 191 8.180 8.180 7.668 0.512 18090 6569 1 17 . 1 1 66 66 MET N N 192 115.320 115.320 117.287 -1.967 18090 6570 1 17 . 1 1 66 66 MET HA H 192 4.090 4.090 4.297 -0.207 18090 6571 1 17 . 1 1 66 66 MET C C 192 176.090 176.090 178.332 -2.242 18090 6572 1 17 . 1 1 66 66 MET CA C 192 56.390 56.390 57.500 -1.110 18090 6573 1 17 . 1 1 66 66 MET CB C 192 33.770 33.770 31.897 1.873 18090 6574 1 17 . 1 1 66 66 MET H H 192 7.880 7.880 8.601 -0.721 18090 6575 1 17 . 1 1 67 67 GLY N N 193 107.490 107.490 105.030 2.460 18090 6576 1 17 . 1 1 67 67 GLY C C 193 174.390 174.390 174.723 -0.333 18090 6577 1 17 . 1 1 67 67 GLY CA C 193 45.880 45.880 45.094 0.786 18090 6578 1 17 . 1 1 67 67 GLY H H 193 7.580 7.580 8.083 -0.503 18090 6579 1 17 . 1 1 68 68 VAL N N 194 118.520 118.520 116.476 2.044 18090 6580 1 17 . 1 1 68 68 VAL HA H 194 3.940 3.940 3.576 0.364 18090 6581 1 17 . 1 1 68 68 VAL C C 194 174.760 174.760 174.864 -0.104 18090 6582 1 17 . 1 1 68 68 VAL CA C 194 61.510 61.510 63.370 -1.861 18090 6583 1 17 . 1 1 68 68 VAL CB C 194 32.670 32.670 31.031 1.639 18090 6584 1 17 . 1 1 68 68 VAL H H 194 7.840 7.840 7.294 0.546 18090 6585 1 17 . 1 1 69 69 ASP N N 195 124.550 124.550 115.801 8.749 18090 6586 1 17 . 1 1 69 69 ASP HA H 195 4.430 4.430 4.322 0.108 18090 6587 1 17 . 1 1 69 69 ASP C C 195 175.140 175.140 176.212 -1.072 18090 6588 1 17 . 1 1 69 69 ASP CA C 195 53.760 53.760 55.796 -2.036 18090 6589 1 17 . 1 1 69 69 ASP CB C 195 40.920 40.920 39.844 1.076 18090 6590 1 17 . 1 1 69 69 ASP H H 195 8.400 8.400 8.176 0.224 18090 6591 1 17 . 1 1 70 70 LEU N N 196 123.930 123.930 118.271 5.659 18090 6592 1 17 . 1 1 70 70 LEU HA H 196 4.200 4.200 4.163 0.037 18090 6593 1 17 . 1 1 70 70 LEU C C 196 175.950 175.950 177.282 -1.332 18090 6594 1 17 . 1 1 70 70 LEU CA C 196 54.380 54.380 56.620 -2.240 18090 6595 1 17 . 1 1 70 70 LEU CB C 196 41.610 41.610 42.757 -1.147 18090 6596 1 17 . 1 1 70 70 LEU H H 196 8.160 8.160 7.619 0.541 18090 6597 1 18 . 1 1 2 2 PRO HA H 128 4.220 4.220 4.579 -0.359 18090 6598 1 18 . 1 1 2 2 PRO CA C 128 63.320 63.320 62.989 0.331 18090 6599 1 18 . 1 1 2 2 PRO CB C 128 31.680 31.680 32.093 -0.413 18090 6600 1 18 . 1 1 3 3 ASP N N 129 119.320 119.320 119.073 0.247 18090 6601 1 18 . 1 1 3 3 ASP HA H 129 4.400 4.400 4.230 0.170 18090 6602 1 18 . 1 1 3 3 ASP C C 129 176.120 176.120 175.136 0.984 18090 6603 1 18 . 1 1 3 3 ASP CA C 129 54.050 54.050 55.377 -1.327 18090 6604 1 18 . 1 1 3 3 ASP CB C 129 40.770 40.770 40.970 -0.200 18090 6605 1 18 . 1 1 3 3 ASP H H 129 8.310 8.310 8.457 -0.147 18090 6606 1 18 . 1 1 4 4 LEU N N 130 122.280 122.280 118.274 4.006 18090 6607 1 18 . 1 1 4 4 LEU HA H 130 4.130 4.130 3.975 0.155 18090 6608 1 18 . 1 1 4 4 LEU C C 130 177.280 177.280 176.719 0.561 18090 6609 1 18 . 1 1 4 4 LEU CA C 130 55.350 55.350 55.262 0.088 18090 6610 1 18 . 1 1 4 4 LEU CB C 130 41.490 41.490 41.794 -0.304 18090 6611 1 18 . 1 1 4 4 LEU H H 130 8.080 8.080 8.222 -0.142 18090 6612 1 18 . 1 1 5 5 GLY N N 131 107.830 107.830 110.406 -2.576 18090 6613 1 18 . 1 1 5 5 GLY C C 131 175.120 175.120 172.987 2.133 18090 6614 1 18 . 1 1 5 5 GLY CA C 131 45.300 45.300 44.873 0.427 18090 6615 1 18 . 1 1 5 5 GLY H H 131 8.180 8.180 8.329 -0.149 18090 6616 1 18 . 1 1 6 6 LEU N N 132 121.080 121.080 116.584 4.496 18090 6617 1 18 . 1 1 6 6 LEU HA H 132 3.870 3.870 4.553 -0.683 18090 6618 1 18 . 1 1 6 6 LEU C C 132 178.000 178.000 177.721 0.279 18090 6619 1 18 . 1 1 6 6 LEU CA C 132 57.180 57.180 53.441 3.739 18090 6620 1 18 . 1 1 6 6 LEU CB C 132 41.870 41.870 44.606 -2.736 18090 6621 1 18 . 1 1 6 6 LEU H H 132 8.150 8.150 7.463 0.687 18090 6622 1 18 . 1 1 7 7 THR N N 133 111.580 111.580 113.565 -1.985 18090 6623 1 18 . 1 1 7 7 THR HA H 133 3.730 3.730 3.971 -0.241 18090 6624 1 18 . 1 1 7 7 THR C C 133 176.530 176.530 176.104 0.426 18090 6625 1 18 . 1 1 7 7 THR CA C 133 65.940 65.940 66.275 -0.335 18090 6626 1 18 . 1 1 7 7 THR CB C 133 68.130 68.130 68.823 -0.693 18090 6627 1 18 . 1 1 7 7 THR H H 133 7.970 7.970 8.649 -0.679 18090 6628 1 18 . 1 1 8 8 GLN N N 134 119.490 119.490 121.229 -1.739 18090 6629 1 18 . 1 1 8 8 GLN HA H 134 3.990 3.990 3.934 0.056 18090 6630 1 18 . 1 1 8 8 GLN C C 134 178.190 178.190 178.368 -0.178 18090 6631 1 18 . 1 1 8 8 GLN CA C 134 57.930 57.930 58.605 -0.675 18090 6632 1 18 . 1 1 8 8 GLN CB C 134 27.850 27.850 27.977 -0.127 18090 6633 1 18 . 1 1 8 8 GLN H H 134 7.890 7.890 8.401 -0.511 18090 6634 1 18 . 1 1 9 9 LEU N N 135 120.170 120.170 118.051 2.119 18090 6635 1 18 . 1 1 9 9 LEU HA H 135 3.820 3.820 3.930 -0.110 18090 6636 1 18 . 1 1 9 9 LEU C C 135 177.810 177.810 178.359 -0.549 18090 6637 1 18 . 1 1 9 9 LEU CA C 135 57.470 57.470 57.177 0.293 18090 6638 1 18 . 1 1 9 9 LEU CB C 135 41.640 41.640 41.947 -0.307 18090 6639 1 18 . 1 1 9 9 LEU H H 135 7.600 7.600 7.238 0.362 18090 6640 1 18 . 1 1 10 10 PHE N N 136 111.950 111.950 113.004 -1.054 18090 6641 1 18 . 1 1 10 10 PHE HA H 136 4.380 4.380 4.375 0.005 18090 6642 1 18 . 1 1 10 10 PHE C C 136 174.990 174.990 177.084 -2.094 18090 6643 1 18 . 1 1 10 10 PHE CA C 136 58.450 58.450 57.400 1.050 18090 6644 1 18 . 1 1 10 10 PHE CB C 136 38.570 38.570 37.963 0.607 18090 6645 1 18 . 1 1 10 10 PHE H H 136 7.410 7.410 6.585 0.825 18090 6646 1 18 . 1 1 11 11 ALA N N 137 120.230 120.230 122.048 -1.818 18090 6647 1 18 . 1 1 11 11 ALA HA H 137 4.130 4.130 4.134 -0.004 18090 6648 1 18 . 1 1 11 11 ALA C C 137 177.090 177.090 178.153 -1.063 18090 6649 1 18 . 1 1 11 11 ALA CA C 137 52.580 52.580 53.527 -0.947 18090 6650 1 18 . 1 1 11 11 ALA CB C 137 18.660 18.660 18.751 -0.091 18090 6651 1 18 . 1 1 11 11 ALA H H 137 7.330 7.330 8.405 -1.075 18090 6652 1 18 . 1 1 12 12 ASP N N 138 119.830 119.830 120.649 -0.819 18090 6653 1 18 . 1 1 12 12 ASP HA H 138 4.510 4.510 4.641 -0.131 18090 6654 1 18 . 1 1 12 12 ASP C C 138 176.370 176.370 174.930 1.440 18090 6655 1 18 . 1 1 12 12 ASP CA C 138 51.960 51.960 52.684 -0.724 18090 6656 1 18 . 1 1 12 12 ASP CB C 138 41.990 41.990 41.678 0.312 18090 6657 1 18 . 1 1 12 12 ASP H H 138 6.980 6.980 7.662 -0.682 18090 6658 1 18 . 1 1 13 13 PRO HA H 139 4.260 4.260 4.365 -0.105 18090 6659 1 18 . 1 1 13 13 PRO CA C 139 64.350 64.350 62.713 1.637 18090 6660 1 18 . 1 1 13 13 PRO CB C 139 31.760 31.760 32.428 -0.668 18090 6661 1 18 . 1 1 14 14 ASN N N 140 116.840 116.840 117.400 -0.560 18090 6662 1 18 . 1 1 14 14 ASN HA H 140 4.840 4.840 4.479 0.361 18090 6663 1 18 . 1 1 14 14 ASN C C 140 173.840 173.840 175.321 -1.481 18090 6664 1 18 . 1 1 14 14 ASN CA C 140 52.380 52.380 54.209 -1.829 18090 6665 1 18 . 1 1 14 14 ASN CB C 140 38.330 38.330 36.943 1.387 18090 6666 1 18 . 1 1 14 14 ASN H H 140 8.670 8.670 8.683 -0.013 18090 6667 1 18 . 1 1 15 15 LEU N N 141 120.290 120.290 120.440 -0.150 18090 6668 1 18 . 1 1 15 15 LEU HA H 141 3.790 3.790 4.548 -0.758 18090 6669 1 18 . 1 1 15 15 LEU C C 141 177.120 177.120 177.476 -0.356 18090 6670 1 18 . 1 1 15 15 LEU CA C 141 59.280 59.280 55.606 3.674 18090 6671 1 18 . 1 1 15 15 LEU CB C 141 42.980 42.980 43.187 -0.207 18090 6672 1 18 . 1 1 15 15 LEU H H 141 7.200 7.200 8.360 -1.160 18090 6673 1 18 . 1 1 16 16 ILE N N 142 115.290 115.290 120.567 -5.277 18090 6674 1 18 . 1 1 16 16 ILE HA H 142 3.480 3.480 3.670 -0.190 18090 6675 1 18 . 1 1 16 16 ILE C C 142 177.990 177.990 177.450 0.540 18090 6676 1 18 . 1 1 16 16 ILE CA C 142 62.690 62.690 65.301 -2.611 18090 6677 1 18 . 1 1 16 16 ILE CB C 142 34.620 34.620 37.757 -3.137 18090 6678 1 18 . 1 1 16 16 ILE H H 142 7.940 7.940 8.420 -0.480 18090 6679 1 18 . 1 1 17 17 GLU N N 143 119.600 119.600 119.060 0.540 18090 6680 1 18 . 1 1 17 17 GLU HA H 143 3.700 3.700 3.998 -0.298 18090 6681 1 18 . 1 1 17 17 GLU C C 143 179.170 179.170 178.747 0.423 18090 6682 1 18 . 1 1 17 17 GLU CA C 143 59.360 59.360 60.136 -0.776 18090 6683 1 18 . 1 1 17 17 GLU CB C 143 28.520 28.520 29.206 -0.686 18090 6684 1 18 . 1 1 17 17 GLU H H 143 7.970 7.970 8.555 -0.585 18090 6685 1 18 . 1 1 18 18 ASN N N 144 117.170 117.170 118.003 -0.833 18090 6686 1 18 . 1 1 18 18 ASN HA H 144 4.270 4.270 4.452 -0.182 18090 6687 1 18 . 1 1 18 18 ASN C C 144 179.120 179.120 177.817 1.303 18090 6688 1 18 . 1 1 18 18 ASN CA C 144 55.490 55.490 55.624 -0.134 18090 6689 1 18 . 1 1 18 18 ASN CB C 144 36.550 36.550 37.803 -1.253 18090 6690 1 18 . 1 1 18 18 ASN H H 144 8.450 8.450 8.345 0.105 18090 6691 1 18 . 1 1 19 19 LEU N N 145 121.060 121.060 120.119 0.941 18090 6692 1 18 . 1 1 19 19 LEU HA H 145 4.020 4.020 3.987 0.033 18090 6693 1 18 . 1 1 19 19 LEU C C 145 180.260 180.260 178.500 1.760 18090 6694 1 18 . 1 1 19 19 LEU CA C 145 56.620 56.620 57.429 -0.809 18090 6695 1 18 . 1 1 19 19 LEU CB C 145 41.780 41.780 41.496 0.284 18090 6696 1 18 . 1 1 19 19 LEU H H 145 7.990 7.990 7.633 0.357 18090 6697 1 18 . 1 1 20 20 LYS N N 146 118.960 118.960 117.614 1.346 18090 6698 1 18 . 1 1 20 20 LYS HA H 146 3.610 3.610 4.009 -0.399 18090 6699 1 18 . 1 1 20 20 LYS C C 146 177.390 177.390 178.153 -0.763 18090 6700 1 18 . 1 1 20 20 LYS CA C 146 59.640 59.640 59.131 0.509 18090 6701 1 18 . 1 1 20 20 LYS CB C 146 32.450 32.450 32.336 0.114 18090 6702 1 18 . 1 1 20 20 LYS H H 146 8.250 8.250 7.905 0.345 18090 6703 1 18 . 1 1 21 21 LYS N N 147 114.720 114.720 116.648 -1.928 18090 6704 1 18 . 1 1 21 21 LYS HA H 147 4.110 4.110 4.239 -0.129 18090 6705 1 18 . 1 1 21 21 LYS C C 147 175.880 175.880 178.175 -2.295 18090 6706 1 18 . 1 1 21 21 LYS CA C 147 56.210 56.210 58.134 -1.924 18090 6707 1 18 . 1 1 21 21 LYS CB C 147 33.000 33.000 32.752 0.248 18090 6708 1 18 . 1 1 21 21 LYS H H 147 7.130 7.130 7.661 -0.531 18090 6709 1 18 . 1 1 22 22 ASN N N 148 122.180 122.180 115.519 6.661 18090 6710 1 18 . 1 1 22 22 ASN HA H 148 4.740 4.740 4.908 -0.168 18090 6711 1 18 . 1 1 22 22 ASN C C 148 174.000 174.000 173.529 0.471 18090 6712 1 18 . 1 1 22 22 ASN CA C 148 50.970 50.970 52.788 -1.818 18090 6713 1 18 . 1 1 22 22 ASN CB C 148 38.670 38.670 38.932 -0.262 18090 6714 1 18 . 1 1 22 22 ASN H H 148 6.930 6.930 7.853 -0.923 18090 6715 1 18 . 1 1 23 23 PRO HA H 149 4.300 4.300 4.698 -0.398 18090 6716 1 18 . 1 1 23 23 PRO CA C 149 64.610 64.610 61.980 2.630 18090 6717 1 18 . 1 1 23 23 PRO CB C 149 32.000 32.000 34.202 -2.201 18090 6718 1 18 . 1 1 24 24 LYS N N 150 116.060 116.060 121.037 -4.977 18090 6719 1 18 . 1 1 24 24 LYS HA H 150 4.070 4.070 3.962 0.108 18090 6720 1 18 . 1 1 24 24 LYS C C 150 178.240 178.240 178.260 -0.020 18090 6721 1 18 . 1 1 24 24 LYS CA C 150 57.950 57.950 59.522 -1.572 18090 6722 1 18 . 1 1 24 24 LYS CB C 150 32.590 32.590 31.852 0.738 18090 6723 1 18 . 1 1 24 24 LYS H H 150 8.520 8.520 8.820 -0.300 18090 6724 1 18 . 1 1 25 25 THR N N 151 105.190 105.190 110.652 -5.462 18090 6725 1 18 . 1 1 25 25 THR HA H 151 4.390 4.390 4.086 0.304 18090 6726 1 18 . 1 1 25 25 THR C C 151 176.090 176.090 176.076 0.014 18090 6727 1 18 . 1 1 25 25 THR CA C 151 61.400 61.400 64.838 -3.438 18090 6728 1 18 . 1 1 25 25 THR CB C 151 69.440 69.440 67.662 1.778 18090 6729 1 18 . 1 1 25 25 THR H H 151 7.490 7.490 8.223 -0.733 18090 6730 1 18 . 1 1 26 26 SER N N 152 119.700 119.700 116.940 2.760 18090 6731 1 18 . 1 1 26 26 SER HA H 152 3.770 3.770 4.164 -0.394 18090 6732 1 18 . 1 1 26 26 SER C C 152 177.470 177.470 176.107 1.363 18090 6733 1 18 . 1 1 26 26 SER CA C 152 62.450 62.450 61.407 1.043 18090 6734 1 18 . 1 1 26 26 SER CB C 152 62.520 62.520 62.579 -0.059 18090 6735 1 18 . 1 1 26 26 SER H H 152 8.190 8.190 7.944 0.246 18090 6736 1 18 . 1 1 27 27 GLU N N 153 119.870 119.870 122.759 -2.889 18090 6737 1 18 . 1 1 27 27 GLU HA H 153 3.890 3.890 3.966 -0.076 18090 6738 1 18 . 1 1 27 27 GLU C C 153 180.040 180.040 178.676 1.364 18090 6739 1 18 . 1 1 27 27 GLU CA C 153 58.700 58.700 59.405 -0.705 18090 6740 1 18 . 1 1 27 27 GLU CB C 153 28.590 28.590 29.450 -0.860 18090 6741 1 18 . 1 1 27 27 GLU H H 153 8.350 8.350 7.754 0.596 18090 6742 1 18 . 1 1 28 28 MET N N 154 119.430 119.430 117.049 2.381 18090 6743 1 18 . 1 1 28 28 MET HA H 154 4.040 4.040 4.166 -0.126 18090 6744 1 18 . 1 1 28 28 MET C C 154 177.110 177.110 178.140 -1.030 18090 6745 1 18 . 1 1 28 28 MET CA C 154 58.510 58.510 58.674 -0.164 18090 6746 1 18 . 1 1 28 28 MET CB C 154 31.430 31.430 32.736 -1.306 18090 6747 1 18 . 1 1 28 28 MET H H 154 7.850 7.850 7.629 0.221 18090 6748 1 18 . 1 1 29 29 MET N N 155 112.640 112.640 114.295 -1.655 18090 6749 1 18 . 1 1 29 29 MET HA H 155 4.340 4.340 4.272 0.068 18090 6750 1 18 . 1 1 29 29 MET C C 155 175.530 175.530 177.873 -2.343 18090 6751 1 18 . 1 1 29 29 MET CA C 155 53.790 53.790 57.220 -3.430 18090 6752 1 18 . 1 1 29 29 MET CB C 155 30.380 30.380 31.959 -1.579 18090 6753 1 18 . 1 1 29 29 MET H H 155 7.200 7.200 7.357 -0.157 18090 6754 1 18 . 1 1 30 30 LYS N N 156 117.050 117.050 117.076 -0.026 18090 6755 1 18 . 1 1 30 30 LYS HA H 156 3.960 3.960 4.276 -0.316 18090 6756 1 18 . 1 1 30 30 LYS C C 156 176.120 176.120 177.002 -0.882 18090 6757 1 18 . 1 1 30 30 LYS CA C 156 57.090 57.090 57.576 -0.486 18090 6758 1 18 . 1 1 30 30 LYS CB C 156 31.960 31.960 33.021 -1.061 18090 6759 1 18 . 1 1 30 30 LYS H H 156 7.130 7.130 7.689 -0.559 18090 6760 1 18 . 1 1 31 31 ASP N N 157 119.810 119.810 118.243 1.567 18090 6761 1 18 . 1 1 31 31 ASP HA H 157 4.860 4.860 4.910 -0.050 18090 6762 1 18 . 1 1 31 31 ASP C C 157 174.890 174.890 174.389 0.501 18090 6763 1 18 . 1 1 31 31 ASP CA C 157 50.520 50.520 54.336 -3.816 18090 6764 1 18 . 1 1 31 31 ASP CB C 157 41.010 41.010 40.421 0.589 18090 6765 1 18 . 1 1 31 31 ASP H H 157 7.340 7.340 7.781 -0.441 18090 6766 1 18 . 1 1 32 32 PRO HA H 158 4.130 4.130 4.466 -0.336 18090 6767 1 18 . 1 1 32 32 PRO CA C 158 64.270 64.270 62.812 1.458 18090 6768 1 18 . 1 1 32 32 PRO CB C 158 31.770 31.770 32.429 -0.659 18090 6769 1 18 . 1 1 33 33 GLN N N 159 117.760 117.760 120.266 -2.506 18090 6770 1 18 . 1 1 33 33 GLN HA H 159 4.000 4.000 4.043 -0.043 18090 6771 1 18 . 1 1 33 33 GLN C C 159 178.740 178.740 177.944 0.796 18090 6772 1 18 . 1 1 33 33 GLN CA C 159 58.220 58.220 58.028 0.192 18090 6773 1 18 . 1 1 33 33 GLN CB C 159 27.870 27.870 28.084 -0.214 18090 6774 1 18 . 1 1 33 33 GLN H H 159 8.150 8.150 8.768 -0.618 18090 6775 1 18 . 1 1 34 34 LEU N N 160 123.300 123.300 120.203 3.097 18090 6776 1 18 . 1 1 34 34 LEU HA H 160 3.970 3.970 4.023 -0.053 18090 6777 1 18 . 1 1 34 34 LEU C C 160 177.980 177.980 178.165 -0.185 18090 6778 1 18 . 1 1 34 34 LEU CA C 160 57.050 57.050 57.292 -0.242 18090 6779 1 18 . 1 1 34 34 LEU CB C 160 40.760 40.760 41.642 -0.882 18090 6780 1 18 . 1 1 34 34 LEU H H 160 7.110 7.110 7.995 -0.885 18090 6781 1 18 . 1 1 35 35 VAL N N 161 118.390 118.390 119.303 -0.913 18090 6782 1 18 . 1 1 35 35 VAL HA H 161 3.110 3.110 3.550 -0.440 18090 6783 1 18 . 1 1 35 35 VAL C C 161 176.840 176.840 177.944 -1.104 18090 6784 1 18 . 1 1 35 35 VAL CA C 161 67.700 67.700 66.645 1.055 18090 6785 1 18 . 1 1 35 35 VAL CB C 161 31.260 31.260 30.611 0.649 18090 6786 1 18 . 1 1 35 35 VAL H H 161 7.430 7.430 7.424 0.006 18090 6787 1 18 . 1 1 36 36 ALA N N 162 117.600 117.600 121.704 -4.104 18090 6788 1 18 . 1 1 36 36 ALA HA H 162 3.810 3.810 3.937 -0.127 18090 6789 1 18 . 1 1 36 36 ALA C C 162 180.620 180.620 179.715 0.905 18090 6790 1 18 . 1 1 36 36 ALA CA C 162 54.720 54.720 55.369 -0.649 18090 6791 1 18 . 1 1 36 36 ALA CB C 162 17.490 17.490 18.193 -0.703 18090 6792 1 18 . 1 1 36 36 ALA H H 162 7.500 7.500 7.825 -0.325 18090 6793 1 18 . 1 1 37 37 LYS N N 163 119.880 119.880 118.508 1.372 18090 6794 1 18 . 1 1 37 37 LYS HA H 163 3.570 3.570 3.986 -0.416 18090 6795 1 18 . 1 1 37 37 LYS C C 163 177.800 177.800 179.131 -1.331 18090 6796 1 18 . 1 1 37 37 LYS CA C 163 58.880 58.880 58.936 -0.056 18090 6797 1 18 . 1 1 37 37 LYS CB C 163 31.610 31.610 32.036 -0.426 18090 6798 1 18 . 1 1 37 37 LYS H H 163 7.350 7.350 7.411 -0.061 18090 6799 1 18 . 1 1 38 38 LEU N N 164 118.020 118.020 119.814 -1.794 18090 6800 1 18 . 1 1 38 38 LEU HA H 164 3.670 3.670 4.026 -0.356 18090 6801 1 18 . 1 1 38 38 LEU C C 164 179.380 179.380 179.098 0.282 18090 6802 1 18 . 1 1 38 38 LEU CA C 164 57.340 57.340 57.866 -0.526 18090 6803 1 18 . 1 1 38 38 LEU CB C 164 41.660 41.660 41.665 -0.005 18090 6804 1 18 . 1 1 38 38 LEU H H 164 7.660 7.660 8.177 -0.517 18090 6805 1 18 . 1 1 39 39 ILE N N 165 118.070 118.070 118.319 -0.249 18090 6806 1 18 . 1 1 39 39 ILE HA H 165 3.510 3.510 3.639 -0.129 18090 6807 1 18 . 1 1 39 39 ILE C C 165 179.570 179.570 178.222 1.348 18090 6808 1 18 . 1 1 39 39 ILE CA C 165 64.450 64.450 65.540 -1.090 18090 6809 1 18 . 1 1 39 39 ILE CB C 165 37.310 37.310 37.462 -0.152 18090 6810 1 18 . 1 1 39 39 ILE H H 165 8.030 8.030 8.011 0.019 18090 6811 1 18 . 1 1 40 40 GLY N N 166 107.970 107.970 107.916 0.054 18090 6812 1 18 . 1 1 40 40 GLY C C 166 176.470 176.470 175.711 0.759 18090 6813 1 18 . 1 1 40 40 GLY CA C 166 46.410 46.410 46.962 -0.552 18090 6814 1 18 . 1 1 40 40 GLY H H 166 7.590 7.590 7.624 -0.034 18090 6815 1 18 . 1 1 41 41 TYR N N 167 121.270 121.270 122.357 -1.087 18090 6816 1 18 . 1 1 41 41 TYR HA H 167 4.190 4.190 4.208 -0.018 18090 6817 1 18 . 1 1 41 41 TYR C C 167 176.470 176.470 176.230 0.240 18090 6818 1 18 . 1 1 41 41 TYR CA C 167 57.130 57.130 60.447 -3.317 18090 6819 1 18 . 1 1 41 41 TYR CB C 167 35.950 35.950 38.233 -2.283 18090 6820 1 18 . 1 1 41 41 TYR H H 167 7.350 7.350 7.854 -0.504 18090 6821 1 18 . 1 1 42 42 LYS N N 168 116.520 116.520 115.993 0.527 18090 6822 1 18 . 1 1 42 42 LYS HA H 168 3.820 3.820 4.070 -0.250 18090 6823 1 18 . 1 1 42 42 LYS C C 168 177.810 177.810 177.924 -0.114 18090 6824 1 18 . 1 1 42 42 LYS CA C 168 59.390 59.390 58.363 1.027 18090 6825 1 18 . 1 1 42 42 LYS CB C 168 31.580 31.580 32.767 -1.187 18090 6826 1 18 . 1 1 42 42 LYS H H 168 7.460 7.460 8.281 -0.821 18090 6827 1 18 . 1 1 43 43 GLN N N 169 113.750 113.750 116.020 -2.270 18090 6828 1 18 . 1 1 43 43 GLN HA H 169 4.220 4.220 4.149 0.071 18090 6829 1 18 . 1 1 43 43 GLN C C 169 175.840 175.840 177.355 -1.515 18090 6830 1 18 . 1 1 43 43 GLN CA C 169 56.230 56.230 58.121 -1.891 18090 6831 1 18 . 1 1 43 43 GLN CB C 169 29.290 29.290 29.363 -0.073 18090 6832 1 18 . 1 1 43 43 GLN H H 169 7.220 7.220 7.623 -0.403 18090 6833 1 18 . 1 1 44 44 ASN N N 170 114.130 114.130 116.124 -1.994 18090 6834 1 18 . 1 1 44 44 ASN HA H 170 5.050 5.050 4.944 0.106 18090 6835 1 18 . 1 1 44 44 ASN C C 170 172.200 172.200 173.591 -1.391 18090 6836 1 18 . 1 1 44 44 ASN CA C 170 50.780 50.780 53.434 -2.654 18090 6837 1 18 . 1 1 44 44 ASN CB C 170 38.380 38.380 39.568 -1.188 18090 6838 1 18 . 1 1 44 44 ASN H H 170 7.580 7.580 7.673 -0.093 18090 6839 1 18 . 1 1 45 45 PRO HA H 171 4.130 4.130 4.684 -0.554 18090 6840 1 18 . 1 1 45 45 PRO CA C 171 64.800 64.800 62.100 2.700 18090 6841 1 18 . 1 1 45 45 PRO CB C 171 31.360 31.360 31.953 -0.593 18090 6842 1 18 . 1 1 46 46 GLN N N 172 115.570 115.570 122.973 -7.403 18090 6843 1 18 . 1 1 46 46 GLN HA H 172 3.770 3.770 3.774 -0.004 18090 6844 1 18 . 1 1 46 46 GLN C C 172 177.360 177.360 177.593 -0.233 18090 6845 1 18 . 1 1 46 46 GLN CA C 172 57.950 57.950 58.152 -0.202 18090 6846 1 18 . 1 1 46 46 GLN CB C 172 27.050 27.050 27.893 -0.843 18090 6847 1 18 . 1 1 46 46 GLN H H 172 8.160 8.160 8.698 -0.538 18090 6848 1 18 . 1 1 47 47 ALA N N 173 121.420 121.420 121.102 0.318 18090 6849 1 18 . 1 1 47 47 ALA HA H 173 4.050 4.050 4.159 -0.109 18090 6850 1 18 . 1 1 47 47 ALA C C 173 178.090 178.090 179.588 -1.498 18090 6851 1 18 . 1 1 47 47 ALA CA C 173 53.490 53.490 54.377 -0.887 18090 6852 1 18 . 1 1 47 47 ALA CB C 173 18.450 18.450 17.877 0.573 18090 6853 1 18 . 1 1 47 47 ALA H H 173 7.470 7.470 8.241 -0.771 18090 6854 1 18 . 1 1 48 48 ILE N N 174 118.050 118.050 118.683 -0.633 18090 6855 1 18 . 1 1 48 48 ILE HA H 174 3.180 3.180 3.875 -0.695 18090 6856 1 18 . 1 1 48 48 ILE C C 174 176.250 176.250 177.867 -1.617 18090 6857 1 18 . 1 1 48 48 ILE CA C 174 64.030 64.030 64.047 -0.017 18090 6858 1 18 . 1 1 48 48 ILE CB C 174 37.280 37.280 37.101 0.179 18090 6859 1 18 . 1 1 48 48 ILE H H 174 7.150 7.150 7.333 -0.183 18090 6860 1 18 . 1 1 49 49 GLY N N 175 105.390 105.390 106.622 -1.232 18090 6861 1 18 . 1 1 49 49 GLY C C 175 174.220 174.220 175.975 -1.755 18090 6862 1 18 . 1 1 49 49 GLY CA C 175 46.700 46.700 47.035 -0.335 18090 6863 1 18 . 1 1 49 49 GLY H H 175 7.550 7.550 7.782 -0.232 18090 6864 1 18 . 1 1 50 50 GLN N N 176 116.230 116.230 118.629 -2.399 18090 6865 1 18 . 1 1 50 50 GLN HA H 176 4.210 4.210 4.552 -0.342 18090 6866 1 18 . 1 1 50 50 GLN C C 176 178.120 178.120 178.277 -0.157 18090 6867 1 18 . 1 1 50 50 GLN CA C 176 57.320 57.320 57.973 -0.653 18090 6868 1 18 . 1 1 50 50 GLN CB C 176 28.630 28.630 29.205 -0.575 18090 6869 1 18 . 1 1 50 50 GLN H H 176 7.390 7.390 7.986 -0.596 18090 6870 1 18 . 1 1 51 51 ASP N N 177 120.000 120.000 121.024 -1.024 18090 6871 1 18 . 1 1 51 51 ASP HA H 177 4.420 4.420 4.640 -0.220 18090 6872 1 18 . 1 1 51 51 ASP C C 177 177.950 177.950 178.322 -0.372 18090 6873 1 18 . 1 1 51 51 ASP CA C 177 55.840 55.840 56.024 -0.184 18090 6874 1 18 . 1 1 51 51 ASP CB C 177 40.310 40.310 40.854 -0.544 18090 6875 1 18 . 1 1 51 51 ASP H H 177 7.870 7.870 7.908 -0.038 18090 6876 1 18 . 1 1 52 52 LEU N N 178 120.010 120.010 120.386 -0.376 18090 6877 1 18 . 1 1 52 52 LEU HA H 178 3.650 3.650 3.992 -0.342 18090 6878 1 18 . 1 1 52 52 LEU C C 178 175.810 175.810 178.308 -2.498 18090 6879 1 18 . 1 1 52 52 LEU CA C 178 57.620 57.620 57.827 -0.207 18090 6880 1 18 . 1 1 52 52 LEU CB C 178 41.880 41.880 41.701 0.179 18090 6881 1 18 . 1 1 52 52 LEU H H 178 7.860 7.860 7.630 0.230 18090 6882 1 18 . 1 1 53 53 PHE N N 179 110.580 110.580 114.022 -3.442 18090 6883 1 18 . 1 1 53 53 PHE HA H 179 4.230 4.230 4.319 -0.089 18090 6884 1 18 . 1 1 53 53 PHE C C 179 176.370 176.370 178.051 -1.681 18090 6885 1 18 . 1 1 53 53 PHE CA C 179 58.730 58.730 60.570 -1.840 18090 6886 1 18 . 1 1 53 53 PHE CB C 179 38.720 38.720 38.993 -0.273 18090 6887 1 18 . 1 1 53 53 PHE H H 179 7.210 7.210 7.925 -0.715 18090 6888 1 18 . 1 1 54 54 THR N N 180 108.190 108.190 107.839 0.351 18090 6889 1 18 . 1 1 54 54 THR HA H 180 4.300 4.300 4.302 -0.002 18090 6890 1 18 . 1 1 54 54 THR C C 180 174.400 174.400 174.968 -0.568 18090 6891 1 18 . 1 1 54 54 THR CA C 180 62.020 62.020 62.851 -0.831 18090 6892 1 18 . 1 1 54 54 THR CB C 180 69.730 69.730 69.776 -0.046 18090 6893 1 18 . 1 1 54 54 THR H H 180 7.550 7.550 7.474 0.076 18090 6894 1 18 . 1 1 55 55 ASP N N 181 120.060 120.060 123.085 -3.025 18090 6895 1 18 . 1 1 55 55 ASP HA H 181 5.020 5.020 5.088 -0.068 18090 6896 1 18 . 1 1 55 55 ASP C C 181 174.120 174.120 175.207 -1.087 18090 6897 1 18 . 1 1 55 55 ASP CA C 181 50.560 50.560 50.475 0.085 18090 6898 1 18 . 1 1 55 55 ASP CB C 181 41.190 41.190 43.037 -1.847 18090 6899 1 18 . 1 1 55 55 ASP H H 181 7.480 7.480 7.997 -0.517 18090 6900 1 18 . 1 1 56 56 PRO HA H 182 4.320 4.320 4.341 -0.021 18090 6901 1 18 . 1 1 56 56 PRO CA C 182 64.280 64.280 64.828 -0.548 18090 6902 1 18 . 1 1 56 56 PRO CB C 182 31.980 31.980 32.553 -0.573 18090 6903 1 18 . 1 1 57 57 ARG N N 183 117.660 117.660 118.659 -0.999 18090 6904 1 18 . 1 1 57 57 ARG HA H 183 3.960 3.960 4.097 -0.137 18090 6905 1 18 . 1 1 57 57 ARG C C 183 179.030 179.030 178.591 0.439 18090 6906 1 18 . 1 1 57 57 ARG CA C 183 59.000 59.000 58.852 0.148 18090 6907 1 18 . 1 1 57 57 ARG CB C 183 29.750 29.750 29.327 0.423 18090 6908 1 18 . 1 1 57 57 ARG H H 183 7.920 7.920 8.130 -0.210 18090 6909 1 18 . 1 1 58 58 LEU N N 184 115.670 115.670 119.508 -3.838 18090 6910 1 18 . 1 1 58 58 LEU HA H 184 3.850 3.850 3.959 -0.109 18090 6911 1 18 . 1 1 58 58 LEU C C 184 178.770 178.770 179.094 -0.324 18090 6912 1 18 . 1 1 58 58 LEU CA C 184 57.110 57.110 57.733 -0.624 18090 6913 1 18 . 1 1 58 58 LEU CB C 184 41.310 41.310 41.593 -0.283 18090 6914 1 18 . 1 1 58 58 LEU H H 184 7.750 7.750 8.180 -0.430 18090 6915 1 18 . 1 1 59 59 MET N N 185 118.570 118.570 116.548 2.022 18090 6916 1 18 . 1 1 59 59 MET HA H 185 4.060 4.060 4.137 -0.077 18090 6917 1 18 . 1 1 59 59 MET C C 185 177.540 177.540 178.174 -0.634 18090 6918 1 18 . 1 1 59 59 MET CA C 185 58.090 58.090 59.402 -1.312 18090 6919 1 18 . 1 1 59 59 MET CB C 185 31.270 31.270 32.192 -0.922 18090 6920 1 18 . 1 1 59 59 MET H H 185 7.590 7.590 7.685 -0.095 18090 6921 1 18 . 1 1 60 60 THR N N 186 116.390 116.390 117.362 -0.972 18090 6922 1 18 . 1 1 60 60 THR HA H 186 3.680 3.680 4.003 -0.323 18090 6923 1 18 . 1 1 60 60 THR C C 186 177.440 177.440 176.397 1.043 18090 6924 1 18 . 1 1 60 60 THR CA C 186 66.940 66.940 67.287 -0.347 18090 6925 1 18 . 1 1 60 60 THR CB C 186 68.030 68.030 68.258 -0.228 18090 6926 1 18 . 1 1 60 60 THR H H 186 7.180 7.180 7.774 -0.594 18090 6927 1 18 . 1 1 61 61 ILE N N 187 123.840 123.840 122.071 1.769 18090 6928 1 18 . 1 1 61 61 ILE HA H 187 3.290 3.290 3.759 -0.469 18090 6929 1 18 . 1 1 61 61 ILE C C 187 176.660 176.660 178.079 -1.419 18090 6930 1 18 . 1 1 61 61 ILE CA C 187 65.850 65.850 65.457 0.393 18090 6931 1 18 . 1 1 61 61 ILE CB C 187 37.640 37.640 37.819 -0.179 18090 6932 1 18 . 1 1 61 61 ILE H H 187 8.010 8.010 7.830 0.179 18090 6933 1 18 . 1 1 62 62 MET N N 188 118.210 118.210 118.333 -0.123 18090 6934 1 18 . 1 1 62 62 MET HA H 188 3.910 3.910 4.002 -0.092 18090 6935 1 18 . 1 1 62 62 MET C C 188 177.540 177.540 178.497 -0.957 18090 6936 1 18 . 1 1 62 62 MET CA C 188 58.530 58.530 59.025 -0.495 18090 6937 1 18 . 1 1 62 62 MET CB C 188 31.200 31.200 31.611 -0.411 18090 6938 1 18 . 1 1 62 62 MET H H 188 8.560 8.560 7.433 1.127 18090 6939 1 18 . 1 1 63 63 ALA N N 189 119.850 119.850 121.706 -1.856 18090 6940 1 18 . 1 1 63 63 ALA HA H 189 3.730 3.730 3.939 -0.209 18090 6941 1 18 . 1 1 63 63 ALA C C 189 179.550 179.550 179.277 0.273 18090 6942 1 18 . 1 1 63 63 ALA CA C 189 55.470 55.470 55.493 -0.023 18090 6943 1 18 . 1 1 63 63 ALA CB C 189 17.640 17.640 18.145 -0.505 18090 6944 1 18 . 1 1 63 63 ALA H H 189 8.210 8.210 8.046 0.164 18090 6945 1 18 . 1 1 64 64 THR N N 190 114.570 114.570 113.560 1.010 18090 6946 1 18 . 1 1 64 64 THR HA H 190 3.790 3.790 3.963 -0.173 18090 6947 1 18 . 1 1 64 64 THR C C 190 177.640 177.640 176.747 0.893 18090 6948 1 18 . 1 1 64 64 THR CA C 190 66.690 66.690 65.530 1.160 18090 6949 1 18 . 1 1 64 64 THR CB C 190 68.310 68.310 68.713 -0.403 18090 6950 1 18 . 1 1 64 64 THR H H 190 7.740 7.740 7.662 0.078 18090 6951 1 18 . 1 1 65 65 LEU N N 191 122.410 122.410 122.426 -0.016 18090 6952 1 18 . 1 1 65 65 LEU HA H 191 3.930 3.930 3.952 -0.022 18090 6953 1 18 . 1 1 65 65 LEU C C 191 178.470 178.470 179.569 -1.099 18090 6954 1 18 . 1 1 65 65 LEU CA C 191 57.120 57.120 58.036 -0.916 18090 6955 1 18 . 1 1 65 65 LEU CB C 191 41.830 41.830 41.775 0.055 18090 6956 1 18 . 1 1 65 65 LEU H H 191 8.180 8.180 7.530 0.650 18090 6957 1 18 . 1 1 66 66 MET N N 192 115.320 115.320 115.210 0.110 18090 6958 1 18 . 1 1 66 66 MET HA H 192 4.090 4.090 4.344 -0.254 18090 6959 1 18 . 1 1 66 66 MET C C 192 176.090 176.090 178.378 -2.288 18090 6960 1 18 . 1 1 66 66 MET CA C 192 56.390 56.390 56.412 -0.022 18090 6961 1 18 . 1 1 66 66 MET CB C 192 33.770 33.770 31.888 1.882 18090 6962 1 18 . 1 1 66 66 MET H H 192 7.880 7.880 8.263 -0.383 18090 6963 1 18 . 1 1 67 67 GLY N N 193 107.490 107.490 104.007 3.483 18090 6964 1 18 . 1 1 67 67 GLY C C 193 174.390 174.390 174.800 -0.410 18090 6965 1 18 . 1 1 67 67 GLY CA C 193 45.880 45.880 44.763 1.117 18090 6966 1 18 . 1 1 67 67 GLY H H 193 7.580 7.580 8.232 -0.652 18090 6967 1 18 . 1 1 68 68 VAL N N 194 118.520 118.520 116.575 1.945 18090 6968 1 18 . 1 1 68 68 VAL HA H 194 3.940 3.940 3.630 0.310 18090 6969 1 18 . 1 1 68 68 VAL C C 194 174.760 174.760 174.772 -0.012 18090 6970 1 18 . 1 1 68 68 VAL CA C 194 61.510 61.510 63.388 -1.878 18090 6971 1 18 . 1 1 68 68 VAL CB C 194 32.670 32.670 30.083 2.587 18090 6972 1 18 . 1 1 68 68 VAL H H 194 7.840 7.840 7.346 0.494 18090 6973 1 18 . 1 1 69 69 ASP N N 195 124.550 124.550 117.617 6.933 18090 6974 1 18 . 1 1 69 69 ASP HA H 195 4.430 4.430 4.286 0.144 18090 6975 1 18 . 1 1 69 69 ASP C C 195 175.140 175.140 176.013 -0.873 18090 6976 1 18 . 1 1 69 69 ASP CA C 195 53.760 53.760 55.589 -1.829 18090 6977 1 18 . 1 1 69 69 ASP CB C 195 40.920 40.920 39.478 1.442 18090 6978 1 18 . 1 1 69 69 ASP H H 195 8.400 8.400 8.071 0.329 18090 6979 1 18 . 1 1 70 70 LEU N N 196 123.930 123.930 121.498 2.432 18090 6980 1 18 . 1 1 70 70 LEU HA H 196 4.200 4.200 4.242 -0.042 18090 6981 1 18 . 1 1 70 70 LEU C C 196 175.950 175.950 178.283 -2.333 18090 6982 1 18 . 1 1 70 70 LEU CA C 196 54.380 54.380 54.843 -0.463 18090 6983 1 18 . 1 1 70 70 LEU CB C 196 41.610 41.610 42.336 -0.725 18090 6984 1 18 . 1 1 70 70 LEU H H 196 8.160 8.160 7.877 0.283 18090 6985 1 19 . 1 1 2 2 PRO HA H 128 4.220 4.220 4.528 -0.308 18090 6986 1 19 . 1 1 2 2 PRO CA C 128 63.320 63.320 62.806 0.514 18090 6987 1 19 . 1 1 2 2 PRO CB C 128 31.680 31.680 32.040 -0.360 18090 6988 1 19 . 1 1 3 3 ASP N N 129 119.320 119.320 118.256 1.064 18090 6989 1 19 . 1 1 3 3 ASP HA H 129 4.400 4.400 4.431 -0.031 18090 6990 1 19 . 1 1 3 3 ASP C C 129 176.120 176.120 174.835 1.285 18090 6991 1 19 . 1 1 3 3 ASP CA C 129 54.050 54.050 55.035 -0.986 18090 6992 1 19 . 1 1 3 3 ASP CB C 129 40.770 40.770 41.066 -0.296 18090 6993 1 19 . 1 1 3 3 ASP H H 129 8.310 8.310 8.332 -0.022 18090 6994 1 19 . 1 1 4 4 LEU N N 130 122.280 122.280 121.944 0.336 18090 6995 1 19 . 1 1 4 4 LEU HA H 130 4.130 4.130 4.494 -0.364 18090 6996 1 19 . 1 1 4 4 LEU C C 130 177.280 177.280 175.698 1.582 18090 6997 1 19 . 1 1 4 4 LEU CA C 130 55.350 55.350 54.110 1.240 18090 6998 1 19 . 1 1 4 4 LEU CB C 130 41.490 41.490 45.654 -4.165 18090 6999 1 19 . 1 1 4 4 LEU H H 130 8.080 8.080 8.014 0.066 18090 7000 1 19 . 1 1 5 5 GLY N N 131 107.830 107.830 109.319 -1.489 18090 7001 1 19 . 1 1 5 5 GLY C C 131 175.120 175.120 174.251 0.869 18090 7002 1 19 . 1 1 5 5 GLY CA C 131 45.300 45.300 44.530 0.770 18090 7003 1 19 . 1 1 5 5 GLY H H 131 8.180 8.180 8.383 -0.203 18090 7004 1 19 . 1 1 6 6 LEU N N 132 121.080 121.080 126.013 -4.933 18090 7005 1 19 . 1 1 6 6 LEU HA H 132 3.870 3.870 4.048 -0.178 18090 7006 1 19 . 1 1 6 6 LEU C C 132 178.000 178.000 178.036 -0.036 18090 7007 1 19 . 1 1 6 6 LEU CA C 132 57.180 57.180 56.905 0.275 18090 7008 1 19 . 1 1 6 6 LEU CB C 132 41.870 41.870 41.932 -0.062 18090 7009 1 19 . 1 1 6 6 LEU H H 132 8.150 8.150 7.899 0.252 18090 7010 1 19 . 1 1 7 7 THR N N 133 111.580 111.580 109.909 1.671 18090 7011 1 19 . 1 1 7 7 THR HA H 133 3.730 3.730 4.079 -0.349 18090 7012 1 19 . 1 1 7 7 THR C C 133 176.530 176.530 176.599 -0.069 18090 7013 1 19 . 1 1 7 7 THR CA C 133 65.940 65.940 65.719 0.221 18090 7014 1 19 . 1 1 7 7 THR CB C 133 68.130 68.130 67.711 0.419 18090 7015 1 19 . 1 1 7 7 THR H H 133 7.970 7.970 8.432 -0.462 18090 7016 1 19 . 1 1 8 8 GLN N N 134 119.490 119.490 120.109 -0.619 18090 7017 1 19 . 1 1 8 8 GLN HA H 134 3.990 3.990 3.933 0.057 18090 7018 1 19 . 1 1 8 8 GLN C C 134 178.190 178.190 178.282 -0.092 18090 7019 1 19 . 1 1 8 8 GLN CA C 134 57.930 57.930 59.291 -1.361 18090 7020 1 19 . 1 1 8 8 GLN CB C 134 27.850 27.850 27.982 -0.132 18090 7021 1 19 . 1 1 8 8 GLN H H 134 7.890 7.890 8.502 -0.612 18090 7022 1 19 . 1 1 9 9 LEU N N 135 120.170 120.170 118.194 1.976 18090 7023 1 19 . 1 1 9 9 LEU HA H 135 3.820 3.820 3.937 -0.117 18090 7024 1 19 . 1 1 9 9 LEU C C 135 177.810 177.810 178.614 -0.804 18090 7025 1 19 . 1 1 9 9 LEU CA C 135 57.470 57.470 57.191 0.280 18090 7026 1 19 . 1 1 9 9 LEU CB C 135 41.640 41.640 41.907 -0.267 18090 7027 1 19 . 1 1 9 9 LEU H H 135 7.600 7.600 7.318 0.282 18090 7028 1 19 . 1 1 10 10 PHE N N 136 111.950 111.950 113.380 -1.430 18090 7029 1 19 . 1 1 10 10 PHE HA H 136 4.380 4.380 4.478 -0.098 18090 7030 1 19 . 1 1 10 10 PHE C C 136 174.990 174.990 177.432 -2.442 18090 7031 1 19 . 1 1 10 10 PHE CA C 136 58.450 58.450 57.651 0.798 18090 7032 1 19 . 1 1 10 10 PHE CB C 136 38.570 38.570 37.777 0.793 18090 7033 1 19 . 1 1 10 10 PHE H H 136 7.410 7.410 6.583 0.827 18090 7034 1 19 . 1 1 11 11 ALA N N 137 120.230 120.230 122.697 -2.467 18090 7035 1 19 . 1 1 11 11 ALA HA H 137 4.130 4.130 4.153 -0.023 18090 7036 1 19 . 1 1 11 11 ALA C C 137 177.090 177.090 178.058 -0.968 18090 7037 1 19 . 1 1 11 11 ALA CA C 137 52.580 52.580 53.687 -1.107 18090 7038 1 19 . 1 1 11 11 ALA CB C 137 18.660 18.660 18.636 0.024 18090 7039 1 19 . 1 1 11 11 ALA H H 137 7.330 7.330 8.527 -1.197 18090 7040 1 19 . 1 1 12 12 ASP N N 138 119.830 119.830 120.748 -0.918 18090 7041 1 19 . 1 1 12 12 ASP HA H 138 4.510 4.510 4.706 -0.196 18090 7042 1 19 . 1 1 12 12 ASP C C 138 176.370 176.370 174.721 1.649 18090 7043 1 19 . 1 1 12 12 ASP CA C 138 51.960 51.960 52.377 -0.417 18090 7044 1 19 . 1 1 12 12 ASP CB C 138 41.990 41.990 41.784 0.206 18090 7045 1 19 . 1 1 12 12 ASP H H 138 6.980 6.980 7.644 -0.664 18090 7046 1 19 . 1 1 13 13 PRO HA H 139 4.260 4.260 4.388 -0.128 18090 7047 1 19 . 1 1 13 13 PRO CA C 139 64.350 64.350 62.878 1.472 18090 7048 1 19 . 1 1 13 13 PRO CB C 139 31.760 31.760 32.460 -0.700 18090 7049 1 19 . 1 1 14 14 ASN N N 140 116.840 116.840 117.300 -0.460 18090 7050 1 19 . 1 1 14 14 ASN HA H 140 4.840 4.840 4.478 0.362 18090 7051 1 19 . 1 1 14 14 ASN C C 140 173.840 173.840 175.310 -1.470 18090 7052 1 19 . 1 1 14 14 ASN CA C 140 52.380 52.380 54.201 -1.821 18090 7053 1 19 . 1 1 14 14 ASN CB C 140 38.330 38.330 36.929 1.401 18090 7054 1 19 . 1 1 14 14 ASN H H 140 8.670 8.670 8.687 -0.017 18090 7055 1 19 . 1 1 15 15 LEU N N 141 120.290 120.290 120.211 0.079 18090 7056 1 19 . 1 1 15 15 LEU HA H 141 3.790 3.790 4.544 -0.754 18090 7057 1 19 . 1 1 15 15 LEU C C 141 177.120 177.120 177.498 -0.378 18090 7058 1 19 . 1 1 15 15 LEU CA C 141 59.280 59.280 55.585 3.695 18090 7059 1 19 . 1 1 15 15 LEU CB C 141 42.980 42.980 43.152 -0.172 18090 7060 1 19 . 1 1 15 15 LEU H H 141 7.200 7.200 8.353 -1.153 18090 7061 1 19 . 1 1 16 16 ILE N N 142 115.290 115.290 120.259 -4.969 18090 7062 1 19 . 1 1 16 16 ILE HA H 142 3.480 3.480 3.721 -0.241 18090 7063 1 19 . 1 1 16 16 ILE C C 142 177.990 177.990 177.499 0.491 18090 7064 1 19 . 1 1 16 16 ILE CA C 142 62.690 62.690 65.437 -2.747 18090 7065 1 19 . 1 1 16 16 ILE CB C 142 34.620 34.620 37.614 -2.994 18090 7066 1 19 . 1 1 16 16 ILE H H 142 7.940 7.940 8.311 -0.371 18090 7067 1 19 . 1 1 17 17 GLU N N 143 119.600 119.600 119.020 0.580 18090 7068 1 19 . 1 1 17 17 GLU HA H 143 3.700 3.700 3.988 -0.288 18090 7069 1 19 . 1 1 17 17 GLU C C 143 179.170 179.170 178.760 0.410 18090 7070 1 19 . 1 1 17 17 GLU CA C 143 59.360 59.360 60.100 -0.740 18090 7071 1 19 . 1 1 17 17 GLU CB C 143 28.520 28.520 29.207 -0.687 18090 7072 1 19 . 1 1 17 17 GLU H H 143 7.970 7.970 8.552 -0.582 18090 7073 1 19 . 1 1 18 18 ASN N N 144 117.170 117.170 117.853 -0.683 18090 7074 1 19 . 1 1 18 18 ASN HA H 144 4.270 4.270 4.448 -0.178 18090 7075 1 19 . 1 1 18 18 ASN C C 144 179.120 179.120 177.812 1.308 18090 7076 1 19 . 1 1 18 18 ASN CA C 144 55.490 55.490 55.636 -0.146 18090 7077 1 19 . 1 1 18 18 ASN CB C 144 36.550 36.550 37.808 -1.258 18090 7078 1 19 . 1 1 18 18 ASN H H 144 8.450 8.450 8.364 0.086 18090 7079 1 19 . 1 1 19 19 LEU N N 145 121.060 121.060 119.065 1.995 18090 7080 1 19 . 1 1 19 19 LEU HA H 145 4.020 4.020 4.024 -0.004 18090 7081 1 19 . 1 1 19 19 LEU C C 145 180.260 180.260 178.146 2.114 18090 7082 1 19 . 1 1 19 19 LEU CA C 145 56.620 56.620 57.018 -0.398 18090 7083 1 19 . 1 1 19 19 LEU CB C 145 41.780 41.780 41.556 0.224 18090 7084 1 19 . 1 1 19 19 LEU H H 145 7.990 7.990 7.561 0.429 18090 7085 1 19 . 1 1 20 20 LYS N N 146 118.960 118.960 117.384 1.576 18090 7086 1 19 . 1 1 20 20 LYS HA H 146 3.610 3.610 4.005 -0.395 18090 7087 1 19 . 1 1 20 20 LYS C C 146 177.390 177.390 178.094 -0.704 18090 7088 1 19 . 1 1 20 20 LYS CA C 146 59.640 59.640 59.017 0.623 18090 7089 1 19 . 1 1 20 20 LYS CB C 146 32.450 32.450 32.310 0.140 18090 7090 1 19 . 1 1 20 20 LYS H H 146 8.250 8.250 7.773 0.477 18090 7091 1 19 . 1 1 21 21 LYS N N 147 114.720 114.720 116.596 -1.876 18090 7092 1 19 . 1 1 21 21 LYS HA H 147 4.110 4.110 4.242 -0.132 18090 7093 1 19 . 1 1 21 21 LYS C C 147 175.880 175.880 178.130 -2.250 18090 7094 1 19 . 1 1 21 21 LYS CA C 147 56.210 56.210 58.155 -1.945 18090 7095 1 19 . 1 1 21 21 LYS CB C 147 33.000 33.000 32.770 0.230 18090 7096 1 19 . 1 1 21 21 LYS H H 147 7.130 7.130 7.701 -0.571 18090 7097 1 19 . 1 1 22 22 ASN N N 148 122.180 122.180 115.433 6.747 18090 7098 1 19 . 1 1 22 22 ASN HA H 148 4.740 4.740 4.989 -0.249 18090 7099 1 19 . 1 1 22 22 ASN C C 148 174.000 174.000 173.351 0.649 18090 7100 1 19 . 1 1 22 22 ASN CA C 148 50.970 50.970 52.453 -1.483 18090 7101 1 19 . 1 1 22 22 ASN CB C 148 38.670 38.670 39.024 -0.354 18090 7102 1 19 . 1 1 22 22 ASN H H 148 6.930 6.930 7.864 -0.934 18090 7103 1 19 . 1 1 23 23 PRO HA H 149 4.300 4.300 5.038 -0.738 18090 7104 1 19 . 1 1 23 23 PRO CA C 149 64.610 64.610 61.695 2.915 18090 7105 1 19 . 1 1 23 23 PRO CB C 149 32.000 32.000 34.127 -2.127 18090 7106 1 19 . 1 1 24 24 LYS N N 150 116.060 116.060 120.815 -4.755 18090 7107 1 19 . 1 1 24 24 LYS HA H 150 4.070 4.070 4.027 0.043 18090 7108 1 19 . 1 1 24 24 LYS C C 150 178.240 178.240 178.666 -0.426 18090 7109 1 19 . 1 1 24 24 LYS CA C 150 57.950 57.950 59.637 -1.687 18090 7110 1 19 . 1 1 24 24 LYS CB C 150 32.590 32.590 31.893 0.697 18090 7111 1 19 . 1 1 24 24 LYS H H 150 8.520 8.520 8.921 -0.401 18090 7112 1 19 . 1 1 25 25 THR N N 151 105.190 105.190 111.500 -6.310 18090 7113 1 19 . 1 1 25 25 THR HA H 151 4.390 4.390 4.057 0.333 18090 7114 1 19 . 1 1 25 25 THR C C 151 176.090 176.090 176.021 0.069 18090 7115 1 19 . 1 1 25 25 THR CA C 151 61.400 61.400 65.489 -4.089 18090 7116 1 19 . 1 1 25 25 THR CB C 151 69.440 69.440 68.004 1.436 18090 7117 1 19 . 1 1 25 25 THR H H 151 7.490 7.490 8.421 -0.931 18090 7118 1 19 . 1 1 26 26 SER N N 152 119.700 119.700 116.995 2.705 18090 7119 1 19 . 1 1 26 26 SER HA H 152 3.770 3.770 4.159 -0.389 18090 7120 1 19 . 1 1 26 26 SER C C 152 177.470 177.470 176.121 1.349 18090 7121 1 19 . 1 1 26 26 SER CA C 152 62.450 62.450 61.506 0.944 18090 7122 1 19 . 1 1 26 26 SER CB C 152 62.520 62.520 62.607 -0.087 18090 7123 1 19 . 1 1 26 26 SER H H 152 8.190 8.190 7.993 0.197 18090 7124 1 19 . 1 1 27 27 GLU N N 153 119.870 119.870 122.673 -2.803 18090 7125 1 19 . 1 1 27 27 GLU HA H 153 3.890 3.890 3.967 -0.077 18090 7126 1 19 . 1 1 27 27 GLU C C 153 180.040 180.040 178.746 1.294 18090 7127 1 19 . 1 1 27 27 GLU CA C 153 58.700 58.700 59.332 -0.632 18090 7128 1 19 . 1 1 27 27 GLU CB C 153 28.590 28.590 29.441 -0.851 18090 7129 1 19 . 1 1 27 27 GLU H H 153 8.350 8.350 7.872 0.478 18090 7130 1 19 . 1 1 28 28 MET N N 154 119.430 119.430 116.866 2.564 18090 7131 1 19 . 1 1 28 28 MET HA H 154 4.040 4.040 4.165 -0.125 18090 7132 1 19 . 1 1 28 28 MET C C 154 177.110 177.110 178.095 -0.985 18090 7133 1 19 . 1 1 28 28 MET CA C 154 58.510 58.510 58.567 -0.057 18090 7134 1 19 . 1 1 28 28 MET CB C 154 31.430 31.430 32.723 -1.293 18090 7135 1 19 . 1 1 28 28 MET H H 154 7.850 7.850 7.585 0.265 18090 7136 1 19 . 1 1 29 29 MET N N 155 112.640 112.640 114.411 -1.771 18090 7137 1 19 . 1 1 29 29 MET HA H 155 4.340 4.340 4.255 0.085 18090 7138 1 19 . 1 1 29 29 MET C C 155 175.530 175.530 177.849 -2.319 18090 7139 1 19 . 1 1 29 29 MET CA C 155 53.790 53.790 57.142 -3.353 18090 7140 1 19 . 1 1 29 29 MET CB C 155 30.380 30.380 32.119 -1.739 18090 7141 1 19 . 1 1 29 29 MET H H 155 7.200 7.200 7.350 -0.150 18090 7142 1 19 . 1 1 30 30 LYS N N 156 117.050 117.050 116.697 0.353 18090 7143 1 19 . 1 1 30 30 LYS HA H 156 3.960 3.960 4.267 -0.307 18090 7144 1 19 . 1 1 30 30 LYS C C 156 176.120 176.120 177.188 -1.068 18090 7145 1 19 . 1 1 30 30 LYS CA C 156 57.090 57.090 57.325 -0.235 18090 7146 1 19 . 1 1 30 30 LYS CB C 156 31.960 31.960 32.947 -0.987 18090 7147 1 19 . 1 1 30 30 LYS H H 156 7.130 7.130 7.648 -0.518 18090 7148 1 19 . 1 1 31 31 ASP N N 157 119.810 119.810 118.680 1.130 18090 7149 1 19 . 1 1 31 31 ASP HA H 157 4.860 4.860 4.975 -0.115 18090 7150 1 19 . 1 1 31 31 ASP C C 157 174.890 174.890 174.559 0.331 18090 7151 1 19 . 1 1 31 31 ASP CA C 157 50.520 50.520 54.395 -3.875 18090 7152 1 19 . 1 1 31 31 ASP CB C 157 41.010 41.010 40.608 0.402 18090 7153 1 19 . 1 1 31 31 ASP H H 157 7.340 7.340 7.742 -0.402 18090 7154 1 19 . 1 1 32 32 PRO HA H 158 4.130 4.130 4.465 -0.335 18090 7155 1 19 . 1 1 32 32 PRO CA C 158 64.270 64.270 62.966 1.304 18090 7156 1 19 . 1 1 32 32 PRO CB C 158 31.770 31.770 32.373 -0.603 18090 7157 1 19 . 1 1 33 33 GLN N N 159 117.760 117.760 120.290 -2.530 18090 7158 1 19 . 1 1 33 33 GLN HA H 159 4.000 4.000 4.044 -0.044 18090 7159 1 19 . 1 1 33 33 GLN C C 159 178.740 178.740 177.937 0.803 18090 7160 1 19 . 1 1 33 33 GLN CA C 159 58.220 58.220 58.002 0.218 18090 7161 1 19 . 1 1 33 33 GLN CB C 159 27.870 27.870 28.085 -0.215 18090 7162 1 19 . 1 1 33 33 GLN H H 159 8.150 8.150 8.767 -0.617 18090 7163 1 19 . 1 1 34 34 LEU N N 160 123.300 123.300 120.037 3.263 18090 7164 1 19 . 1 1 34 34 LEU HA H 160 3.970 3.970 4.007 -0.037 18090 7165 1 19 . 1 1 34 34 LEU C C 160 177.980 177.980 178.153 -0.173 18090 7166 1 19 . 1 1 34 34 LEU CA C 160 57.050 57.050 57.269 -0.219 18090 7167 1 19 . 1 1 34 34 LEU CB C 160 40.760 40.760 41.671 -0.911 18090 7168 1 19 . 1 1 34 34 LEU H H 160 7.110 7.110 7.988 -0.878 18090 7169 1 19 . 1 1 35 35 VAL N N 161 118.390 118.390 119.415 -1.025 18090 7170 1 19 . 1 1 35 35 VAL HA H 161 3.110 3.110 3.487 -0.377 18090 7171 1 19 . 1 1 35 35 VAL C C 161 176.840 176.840 177.644 -0.804 18090 7172 1 19 . 1 1 35 35 VAL CA C 161 67.700 67.700 67.014 0.686 18090 7173 1 19 . 1 1 35 35 VAL CB C 161 31.260 31.260 31.317 -0.057 18090 7174 1 19 . 1 1 35 35 VAL H H 161 7.430 7.430 7.395 0.035 18090 7175 1 19 . 1 1 36 36 ALA N N 162 117.600 117.600 121.280 -3.680 18090 7176 1 19 . 1 1 36 36 ALA HA H 162 3.810 3.810 3.943 -0.133 18090 7177 1 19 . 1 1 36 36 ALA C C 162 180.620 180.620 179.608 1.012 18090 7178 1 19 . 1 1 36 36 ALA CA C 162 54.720 54.720 55.337 -0.617 18090 7179 1 19 . 1 1 36 36 ALA CB C 162 17.490 17.490 18.093 -0.603 18090 7180 1 19 . 1 1 36 36 ALA H H 162 7.500 7.500 7.771 -0.271 18090 7181 1 19 . 1 1 37 37 LYS N N 163 119.880 119.880 118.479 1.401 18090 7182 1 19 . 1 1 37 37 LYS HA H 163 3.570 3.570 3.980 -0.410 18090 7183 1 19 . 1 1 37 37 LYS C C 163 177.800 177.800 179.118 -1.318 18090 7184 1 19 . 1 1 37 37 LYS CA C 163 58.880 58.880 58.927 -0.047 18090 7185 1 19 . 1 1 37 37 LYS CB C 163 31.610 31.610 32.019 -0.409 18090 7186 1 19 . 1 1 37 37 LYS H H 163 7.350 7.350 7.405 -0.055 18090 7187 1 19 . 1 1 38 38 LEU N N 164 118.020 118.020 119.910 -1.890 18090 7188 1 19 . 1 1 38 38 LEU HA H 164 3.670 3.670 4.018 -0.348 18090 7189 1 19 . 1 1 38 38 LEU C C 164 179.380 179.380 179.108 0.272 18090 7190 1 19 . 1 1 38 38 LEU CA C 164 57.340 57.340 57.914 -0.574 18090 7191 1 19 . 1 1 38 38 LEU CB C 164 41.660 41.660 41.683 -0.023 18090 7192 1 19 . 1 1 38 38 LEU H H 164 7.660 7.660 8.196 -0.536 18090 7193 1 19 . 1 1 39 39 ILE N N 165 118.070 118.070 119.288 -1.218 18090 7194 1 19 . 1 1 39 39 ILE HA H 165 3.510 3.510 3.607 -0.097 18090 7195 1 19 . 1 1 39 39 ILE C C 165 179.570 179.570 178.323 1.247 18090 7196 1 19 . 1 1 39 39 ILE CA C 165 64.450 64.450 65.615 -1.165 18090 7197 1 19 . 1 1 39 39 ILE CB C 165 37.310 37.310 37.507 -0.197 18090 7198 1 19 . 1 1 39 39 ILE H H 165 8.030 8.030 7.955 0.075 18090 7199 1 19 . 1 1 40 40 GLY N N 166 107.970 107.970 107.754 0.216 18090 7200 1 19 . 1 1 40 40 GLY C C 166 176.470 176.470 175.603 0.867 18090 7201 1 19 . 1 1 40 40 GLY CA C 166 46.410 46.410 47.016 -0.606 18090 7202 1 19 . 1 1 40 40 GLY H H 166 7.590 7.590 7.684 -0.094 18090 7203 1 19 . 1 1 41 41 TYR N N 167 121.270 121.270 122.367 -1.097 18090 7204 1 19 . 1 1 41 41 TYR HA H 167 4.190 4.190 4.202 -0.012 18090 7205 1 19 . 1 1 41 41 TYR C C 167 176.470 176.470 176.222 0.248 18090 7206 1 19 . 1 1 41 41 TYR CA C 167 57.130 57.130 60.448 -3.318 18090 7207 1 19 . 1 1 41 41 TYR CB C 167 35.950 35.950 38.227 -2.277 18090 7208 1 19 . 1 1 41 41 TYR H H 167 7.350 7.350 7.857 -0.507 18090 7209 1 19 . 1 1 42 42 LYS N N 168 116.520 116.520 115.917 0.603 18090 7210 1 19 . 1 1 42 42 LYS HA H 168 3.820 3.820 4.063 -0.243 18090 7211 1 19 . 1 1 42 42 LYS C C 168 177.810 177.810 177.924 -0.114 18090 7212 1 19 . 1 1 42 42 LYS CA C 168 59.390 59.390 58.340 1.050 18090 7213 1 19 . 1 1 42 42 LYS CB C 168 31.580 31.580 32.750 -1.170 18090 7214 1 19 . 1 1 42 42 LYS H H 168 7.460 7.460 8.281 -0.821 18090 7215 1 19 . 1 1 43 43 GLN N N 169 113.750 113.750 116.093 -2.343 18090 7216 1 19 . 1 1 43 43 GLN HA H 169 4.220 4.220 4.153 0.067 18090 7217 1 19 . 1 1 43 43 GLN C C 169 175.840 175.840 177.407 -1.567 18090 7218 1 19 . 1 1 43 43 GLN CA C 169 56.230 56.230 58.146 -1.916 18090 7219 1 19 . 1 1 43 43 GLN CB C 169 29.290 29.290 29.381 -0.091 18090 7220 1 19 . 1 1 43 43 GLN H H 169 7.220 7.220 7.640 -0.420 18090 7221 1 19 . 1 1 44 44 ASN N N 170 114.130 114.130 116.209 -2.079 18090 7222 1 19 . 1 1 44 44 ASN HA H 170 5.050 5.050 4.952 0.098 18090 7223 1 19 . 1 1 44 44 ASN C C 170 172.200 172.200 173.565 -1.365 18090 7224 1 19 . 1 1 44 44 ASN CA C 170 50.780 50.780 53.674 -2.894 18090 7225 1 19 . 1 1 44 44 ASN CB C 170 38.380 38.380 39.703 -1.323 18090 7226 1 19 . 1 1 44 44 ASN H H 170 7.580 7.580 7.663 -0.083 18090 7227 1 19 . 1 1 45 45 PRO HA H 171 4.130 4.130 4.673 -0.543 18090 7228 1 19 . 1 1 45 45 PRO CA C 171 64.800 64.800 62.090 2.710 18090 7229 1 19 . 1 1 45 45 PRO CB C 171 31.360 31.360 31.946 -0.586 18090 7230 1 19 . 1 1 46 46 GLN N N 172 115.570 115.570 122.958 -7.388 18090 7231 1 19 . 1 1 46 46 GLN HA H 172 3.770 3.770 3.778 -0.008 18090 7232 1 19 . 1 1 46 46 GLN C C 172 177.360 177.360 177.579 -0.219 18090 7233 1 19 . 1 1 46 46 GLN CA C 172 57.950 57.950 58.114 -0.164 18090 7234 1 19 . 1 1 46 46 GLN CB C 172 27.050 27.050 27.889 -0.839 18090 7235 1 19 . 1 1 46 46 GLN H H 172 8.160 8.160 8.685 -0.525 18090 7236 1 19 . 1 1 47 47 ALA N N 173 121.420 121.420 121.589 -0.169 18090 7237 1 19 . 1 1 47 47 ALA HA H 173 4.050 4.050 4.159 -0.109 18090 7238 1 19 . 1 1 47 47 ALA C C 173 178.090 178.090 179.411 -1.321 18090 7239 1 19 . 1 1 47 47 ALA CA C 173 53.490 53.490 54.285 -0.795 18090 7240 1 19 . 1 1 47 47 ALA CB C 173 18.450 18.450 17.600 0.850 18090 7241 1 19 . 1 1 47 47 ALA H H 173 7.470 7.470 8.260 -0.790 18090 7242 1 19 . 1 1 48 48 ILE N N 174 118.050 118.050 118.771 -0.721 18090 7243 1 19 . 1 1 48 48 ILE HA H 174 3.180 3.180 3.828 -0.648 18090 7244 1 19 . 1 1 48 48 ILE C C 174 176.250 176.250 177.870 -1.620 18090 7245 1 19 . 1 1 48 48 ILE CA C 174 64.030 64.030 64.076 -0.046 18090 7246 1 19 . 1 1 48 48 ILE CB C 174 37.280 37.280 37.081 0.199 18090 7247 1 19 . 1 1 48 48 ILE H H 174 7.150 7.150 7.335 -0.185 18090 7248 1 19 . 1 1 49 49 GLY N N 175 105.390 105.390 106.549 -1.159 18090 7249 1 19 . 1 1 49 49 GLY C C 175 174.220 174.220 176.134 -1.914 18090 7250 1 19 . 1 1 49 49 GLY CA C 175 46.700 46.700 47.025 -0.325 18090 7251 1 19 . 1 1 49 49 GLY H H 175 7.550 7.550 7.772 -0.222 18090 7252 1 19 . 1 1 50 50 GLN N N 176 116.230 116.230 118.775 -2.545 18090 7253 1 19 . 1 1 50 50 GLN HA H 176 4.210 4.210 4.587 -0.377 18090 7254 1 19 . 1 1 50 50 GLN C C 176 178.120 178.120 178.305 -0.185 18090 7255 1 19 . 1 1 50 50 GLN CA C 176 57.320 57.320 58.064 -0.744 18090 7256 1 19 . 1 1 50 50 GLN CB C 176 28.630 28.630 29.160 -0.530 18090 7257 1 19 . 1 1 50 50 GLN H H 176 7.390 7.390 8.073 -0.683 18090 7258 1 19 . 1 1 51 51 ASP N N 177 120.000 120.000 121.073 -1.073 18090 7259 1 19 . 1 1 51 51 ASP HA H 177 4.420 4.420 4.666 -0.246 18090 7260 1 19 . 1 1 51 51 ASP C C 177 177.950 177.950 178.341 -0.391 18090 7261 1 19 . 1 1 51 51 ASP CA C 177 55.840 55.840 55.943 -0.103 18090 7262 1 19 . 1 1 51 51 ASP CB C 177 40.310 40.310 40.901 -0.591 18090 7263 1 19 . 1 1 51 51 ASP H H 177 7.870 7.870 7.973 -0.103 18090 7264 1 19 . 1 1 52 52 LEU N N 178 120.010 120.010 119.985 0.025 18090 7265 1 19 . 1 1 52 52 LEU HA H 178 3.650 3.650 3.965 -0.315 18090 7266 1 19 . 1 1 52 52 LEU C C 178 175.810 175.810 178.217 -2.407 18090 7267 1 19 . 1 1 52 52 LEU CA C 178 57.620 57.620 57.882 -0.262 18090 7268 1 19 . 1 1 52 52 LEU CB C 178 41.880 41.880 41.597 0.283 18090 7269 1 19 . 1 1 52 52 LEU H H 178 7.860 7.860 7.760 0.100 18090 7270 1 19 . 1 1 53 53 PHE N N 179 110.580 110.580 113.676 -3.096 18090 7271 1 19 . 1 1 53 53 PHE HA H 179 4.230 4.230 4.300 -0.070 18090 7272 1 19 . 1 1 53 53 PHE C C 179 176.370 176.370 178.337 -1.967 18090 7273 1 19 . 1 1 53 53 PHE CA C 179 58.730 58.730 60.444 -1.714 18090 7274 1 19 . 1 1 53 53 PHE CB C 179 38.720 38.720 38.935 -0.215 18090 7275 1 19 . 1 1 53 53 PHE H H 179 7.210 7.210 8.105 -0.895 18090 7276 1 19 . 1 1 54 54 THR N N 180 108.190 108.190 110.218 -2.028 18090 7277 1 19 . 1 1 54 54 THR HA H 180 4.300 4.300 4.284 0.016 18090 7278 1 19 . 1 1 54 54 THR C C 180 174.400 174.400 175.352 -0.952 18090 7279 1 19 . 1 1 54 54 THR CA C 180 62.020 62.020 62.683 -0.663 18090 7280 1 19 . 1 1 54 54 THR CB C 180 69.730 69.730 69.940 -0.210 18090 7281 1 19 . 1 1 54 54 THR H H 180 7.550 7.550 7.515 0.035 18090 7282 1 19 . 1 1 55 55 ASP N N 181 120.060 120.060 123.462 -3.402 18090 7283 1 19 . 1 1 55 55 ASP HA H 181 5.020 5.020 5.128 -0.108 18090 7284 1 19 . 1 1 55 55 ASP C C 181 174.120 174.120 174.817 -0.697 18090 7285 1 19 . 1 1 55 55 ASP CA C 181 50.560 50.560 51.027 -0.467 18090 7286 1 19 . 1 1 55 55 ASP CB C 181 41.190 41.190 42.761 -1.571 18090 7287 1 19 . 1 1 55 55 ASP H H 181 7.480 7.480 8.044 -0.564 18090 7288 1 19 . 1 1 56 56 PRO HA H 182 4.320 4.320 4.241 0.079 18090 7289 1 19 . 1 1 56 56 PRO CA C 182 64.280 64.280 64.968 -0.688 18090 7290 1 19 . 1 1 56 56 PRO CB C 182 31.980 31.980 32.307 -0.327 18090 7291 1 19 . 1 1 57 57 ARG N N 183 117.660 117.660 117.308 0.352 18090 7292 1 19 . 1 1 57 57 ARG HA H 183 3.960 3.960 4.072 -0.112 18090 7293 1 19 . 1 1 57 57 ARG C C 183 179.030 179.030 178.531 0.499 18090 7294 1 19 . 1 1 57 57 ARG CA C 183 59.000 59.000 58.820 0.180 18090 7295 1 19 . 1 1 57 57 ARG CB C 183 29.750 29.750 29.531 0.219 18090 7296 1 19 . 1 1 57 57 ARG H H 183 7.920 7.920 7.986 -0.066 18090 7297 1 19 . 1 1 58 58 LEU N N 184 115.670 115.670 119.459 -3.789 18090 7298 1 19 . 1 1 58 58 LEU HA H 184 3.850 3.850 3.981 -0.131 18090 7299 1 19 . 1 1 58 58 LEU C C 184 178.770 178.770 179.119 -0.349 18090 7300 1 19 . 1 1 58 58 LEU CA C 184 57.110 57.110 57.755 -0.645 18090 7301 1 19 . 1 1 58 58 LEU CB C 184 41.310 41.310 41.615 -0.305 18090 7302 1 19 . 1 1 58 58 LEU H H 184 7.750 7.750 8.172 -0.422 18090 7303 1 19 . 1 1 59 59 MET N N 185 118.570 118.570 116.409 2.161 18090 7304 1 19 . 1 1 59 59 MET HA H 185 4.060 4.060 4.155 -0.095 18090 7305 1 19 . 1 1 59 59 MET C C 185 177.540 177.540 178.156 -0.616 18090 7306 1 19 . 1 1 59 59 MET CA C 185 58.090 58.090 59.263 -1.173 18090 7307 1 19 . 1 1 59 59 MET CB C 185 31.270 31.270 32.266 -0.995 18090 7308 1 19 . 1 1 59 59 MET H H 185 7.590 7.590 7.666 -0.076 18090 7309 1 19 . 1 1 60 60 THR N N 186 116.390 116.390 117.541 -1.151 18090 7310 1 19 . 1 1 60 60 THR HA H 186 3.680 3.680 4.011 -0.332 18090 7311 1 19 . 1 1 60 60 THR C C 186 177.440 177.440 176.303 1.137 18090 7312 1 19 . 1 1 60 60 THR CA C 186 66.940 66.940 67.292 -0.352 18090 7313 1 19 . 1 1 60 60 THR CB C 186 68.030 68.030 68.241 -0.211 18090 7314 1 19 . 1 1 60 60 THR H H 186 7.180 7.180 7.804 -0.624 18090 7315 1 19 . 1 1 61 61 ILE N N 187 123.840 123.840 122.458 1.382 18090 7316 1 19 . 1 1 61 61 ILE HA H 187 3.290 3.290 3.760 -0.469 18090 7317 1 19 . 1 1 61 61 ILE C C 187 176.660 176.660 178.001 -1.341 18090 7318 1 19 . 1 1 61 61 ILE CA C 187 65.850 65.850 65.497 0.353 18090 7319 1 19 . 1 1 61 61 ILE CB C 187 37.640 37.640 37.952 -0.312 18090 7320 1 19 . 1 1 61 61 ILE H H 187 8.010 8.010 7.871 0.139 18090 7321 1 19 . 1 1 62 62 MET N N 188 118.210 118.210 118.335 -0.125 18090 7322 1 19 . 1 1 62 62 MET HA H 188 3.910 3.910 4.071 -0.161 18090 7323 1 19 . 1 1 62 62 MET C C 188 177.540 177.540 178.511 -0.971 18090 7324 1 19 . 1 1 62 62 MET CA C 188 58.530 58.530 58.106 0.424 18090 7325 1 19 . 1 1 62 62 MET CB C 188 31.200 31.200 31.085 0.115 18090 7326 1 19 . 1 1 62 62 MET H H 188 8.560 8.560 7.441 1.119 18090 7327 1 19 . 1 1 63 63 ALA N N 189 119.850 119.850 122.590 -2.740 18090 7328 1 19 . 1 1 63 63 ALA HA H 189 3.730 3.730 3.894 -0.164 18090 7329 1 19 . 1 1 63 63 ALA C C 189 179.550 179.550 179.461 0.089 18090 7330 1 19 . 1 1 63 63 ALA CA C 189 55.470 55.470 55.617 -0.146 18090 7331 1 19 . 1 1 63 63 ALA CB C 189 17.640 17.640 18.157 -0.517 18090 7332 1 19 . 1 1 63 63 ALA H H 189 8.210 8.210 8.182 0.028 18090 7333 1 19 . 1 1 64 64 THR N N 190 114.570 114.570 114.219 0.351 18090 7334 1 19 . 1 1 64 64 THR HA H 190 3.790 3.790 4.171 -0.381 18090 7335 1 19 . 1 1 64 64 THR C C 190 177.640 177.640 176.845 0.795 18090 7336 1 19 . 1 1 64 64 THR CA C 190 66.690 66.690 65.430 1.260 18090 7337 1 19 . 1 1 64 64 THR CB C 190 68.310 68.310 68.350 -0.040 18090 7338 1 19 . 1 1 64 64 THR H H 190 7.740 7.740 7.687 0.053 18090 7339 1 19 . 1 1 65 65 LEU N N 191 122.410 122.410 122.121 0.289 18090 7340 1 19 . 1 1 65 65 LEU HA H 191 3.930 3.930 3.996 -0.066 18090 7341 1 19 . 1 1 65 65 LEU C C 191 178.470 178.470 179.899 -1.429 18090 7342 1 19 . 1 1 65 65 LEU CA C 191 57.120 57.120 57.920 -0.800 18090 7343 1 19 . 1 1 65 65 LEU CB C 191 41.830 41.830 41.818 0.012 18090 7344 1 19 . 1 1 65 65 LEU H H 191 8.180 8.180 7.759 0.421 18090 7345 1 19 . 1 1 66 66 MET N N 192 115.320 115.320 117.472 -2.152 18090 7346 1 19 . 1 1 66 66 MET HA H 192 4.090 4.090 4.295 -0.205 18090 7347 1 19 . 1 1 66 66 MET C C 192 176.090 176.090 178.216 -2.126 18090 7348 1 19 . 1 1 66 66 MET CA C 192 56.390 56.390 57.627 -1.237 18090 7349 1 19 . 1 1 66 66 MET CB C 192 33.770 33.770 31.887 1.883 18090 7350 1 19 . 1 1 66 66 MET H H 192 7.880 7.880 8.683 -0.803 18090 7351 1 19 . 1 1 67 67 GLY N N 193 107.490 107.490 105.171 2.319 18090 7352 1 19 . 1 1 67 67 GLY C C 193 174.390 174.390 174.792 -0.402 18090 7353 1 19 . 1 1 67 67 GLY CA C 193 45.880 45.880 45.180 0.700 18090 7354 1 19 . 1 1 67 67 GLY H H 193 7.580 7.580 8.129 -0.549 18090 7355 1 19 . 1 1 68 68 VAL N N 194 118.520 118.520 116.890 1.630 18090 7356 1 19 . 1 1 68 68 VAL HA H 194 3.940 3.940 3.610 0.330 18090 7357 1 19 . 1 1 68 68 VAL C C 194 174.760 174.760 174.877 -0.117 18090 7358 1 19 . 1 1 68 68 VAL CA C 194 61.510 61.510 64.087 -2.577 18090 7359 1 19 . 1 1 68 68 VAL CB C 194 32.670 32.670 30.541 2.129 18090 7360 1 19 . 1 1 68 68 VAL H H 194 7.840 7.840 7.450 0.390 18090 7361 1 19 . 1 1 69 69 ASP N N 195 124.550 124.550 118.726 5.824 18090 7362 1 19 . 1 1 69 69 ASP HA H 195 4.430 4.430 4.775 -0.345 18090 7363 1 19 . 1 1 69 69 ASP C C 195 175.140 175.140 175.213 -0.073 18090 7364 1 19 . 1 1 69 69 ASP CA C 195 53.760 53.760 53.969 -0.209 18090 7365 1 19 . 1 1 69 69 ASP CB C 195 40.920 40.920 42.683 -1.763 18090 7366 1 19 . 1 1 69 69 ASP H H 195 8.400 8.400 7.610 0.790 18090 7367 1 19 . 1 1 70 70 LEU N N 196 123.930 123.930 120.718 3.212 18090 7368 1 19 . 1 1 70 70 LEU HA H 196 4.200 4.200 3.912 0.288 18090 7369 1 19 . 1 1 70 70 LEU C C 196 175.950 175.950 176.079 -0.129 18090 7370 1 19 . 1 1 70 70 LEU CA C 196 54.380 54.380 55.077 -0.697 18090 7371 1 19 . 1 1 70 70 LEU CB C 196 41.610 41.610 41.834 -0.224 18090 7372 1 19 . 1 1 70 70 LEU H H 196 8.160 8.160 8.433 -0.273 18090 7373 1 20 . 1 1 2 2 PRO HA H 128 4.220 4.220 4.440 -0.220 18090 7374 1 20 . 1 1 2 2 PRO CA C 128 63.320 63.320 62.999 0.321 18090 7375 1 20 . 1 1 2 2 PRO CB C 128 31.680 31.680 31.904 -0.224 18090 7376 1 20 . 1 1 3 3 ASP N N 129 119.320 119.320 120.192 -0.872 18090 7377 1 20 . 1 1 3 3 ASP HA H 129 4.400 4.400 4.414 -0.014 18090 7378 1 20 . 1 1 3 3 ASP C C 129 176.120 176.120 174.836 1.284 18090 7379 1 20 . 1 1 3 3 ASP CA C 129 54.050 54.050 54.883 -0.833 18090 7380 1 20 . 1 1 3 3 ASP CB C 129 40.770 40.770 40.818 -0.048 18090 7381 1 20 . 1 1 3 3 ASP H H 129 8.310 8.310 8.593 -0.283 18090 7382 1 20 . 1 1 4 4 LEU N N 130 122.280 122.280 121.871 0.409 18090 7383 1 20 . 1 1 4 4 LEU HA H 130 4.130 4.130 4.549 -0.419 18090 7384 1 20 . 1 1 4 4 LEU C C 130 177.280 177.280 176.109 1.171 18090 7385 1 20 . 1 1 4 4 LEU CA C 130 55.350 55.350 53.933 1.417 18090 7386 1 20 . 1 1 4 4 LEU CB C 130 41.490 41.490 45.518 -4.028 18090 7387 1 20 . 1 1 4 4 LEU H H 130 8.080 8.080 7.900 0.180 18090 7388 1 20 . 1 1 5 5 GLY N N 131 107.830 107.830 107.747 0.083 18090 7389 1 20 . 1 1 5 5 GLY C C 131 175.120 175.120 173.177 1.943 18090 7390 1 20 . 1 1 5 5 GLY CA C 131 45.300 45.300 45.484 -0.184 18090 7391 1 20 . 1 1 5 5 GLY H H 131 8.180 8.180 8.320 -0.140 18090 7392 1 20 . 1 1 6 6 LEU N N 132 121.080 121.080 116.452 4.628 18090 7393 1 20 . 1 1 6 6 LEU HA H 132 3.870 3.870 4.502 -0.632 18090 7394 1 20 . 1 1 6 6 LEU C C 132 178.000 178.000 177.695 0.305 18090 7395 1 20 . 1 1 6 6 LEU CA C 132 57.180 57.180 53.455 3.725 18090 7396 1 20 . 1 1 6 6 LEU CB C 132 41.870 41.870 44.591 -2.721 18090 7397 1 20 . 1 1 6 6 LEU H H 132 8.150 8.150 7.444 0.706 18090 7398 1 20 . 1 1 7 7 THR N N 133 111.580 111.580 113.474 -1.894 18090 7399 1 20 . 1 1 7 7 THR HA H 133 3.730 3.730 3.973 -0.243 18090 7400 1 20 . 1 1 7 7 THR C C 133 176.530 176.530 176.075 0.455 18090 7401 1 20 . 1 1 7 7 THR CA C 133 65.940 65.940 66.225 -0.285 18090 7402 1 20 . 1 1 7 7 THR CB C 133 68.130 68.130 68.822 -0.692 18090 7403 1 20 . 1 1 7 7 THR H H 133 7.970 7.970 8.658 -0.688 18090 7404 1 20 . 1 1 8 8 GLN N N 134 119.490 119.490 121.215 -1.725 18090 7405 1 20 . 1 1 8 8 GLN HA H 134 3.990 3.990 3.933 0.057 18090 7406 1 20 . 1 1 8 8 GLN C C 134 178.190 178.190 178.303 -0.113 18090 7407 1 20 . 1 1 8 8 GLN CA C 134 57.930 57.930 58.650 -0.720 18090 7408 1 20 . 1 1 8 8 GLN CB C 134 27.850 27.850 27.956 -0.106 18090 7409 1 20 . 1 1 8 8 GLN H H 134 7.890 7.890 8.395 -0.504 18090 7410 1 20 . 1 1 9 9 LEU N N 135 120.170 120.170 118.013 2.157 18090 7411 1 20 . 1 1 9 9 LEU HA H 135 3.820 3.820 3.935 -0.115 18090 7412 1 20 . 1 1 9 9 LEU C C 135 177.810 177.810 178.409 -0.599 18090 7413 1 20 . 1 1 9 9 LEU CA C 135 57.470 57.470 57.166 0.304 18090 7414 1 20 . 1 1 9 9 LEU CB C 135 41.640 41.640 41.935 -0.295 18090 7415 1 20 . 1 1 9 9 LEU H H 135 7.600 7.600 7.251 0.349 18090 7416 1 20 . 1 1 10 10 PHE N N 136 111.950 111.950 113.028 -1.078 18090 7417 1 20 . 1 1 10 10 PHE HA H 136 4.380 4.380 4.386 -0.006 18090 7418 1 20 . 1 1 10 10 PHE C C 136 174.990 174.990 177.131 -2.141 18090 7419 1 20 . 1 1 10 10 PHE CA C 136 58.450 58.450 57.375 1.075 18090 7420 1 20 . 1 1 10 10 PHE CB C 136 38.570 38.570 37.954 0.616 18090 7421 1 20 . 1 1 10 10 PHE H H 136 7.410 7.410 6.594 0.816 18090 7422 1 20 . 1 1 11 11 ALA N N 137 120.230 120.230 122.098 -1.868 18090 7423 1 20 . 1 1 11 11 ALA HA H 137 4.130 4.130 4.055 0.075 18090 7424 1 20 . 1 1 11 11 ALA C C 137 177.090 177.090 178.167 -1.077 18090 7425 1 20 . 1 1 11 11 ALA CA C 137 52.580 52.580 53.515 -0.935 18090 7426 1 20 . 1 1 11 11 ALA CB C 137 18.660 18.660 18.745 -0.085 18090 7427 1 20 . 1 1 11 11 ALA H H 137 7.330 7.330 8.465 -1.135 18090 7428 1 20 . 1 1 12 12 ASP N N 138 119.830 119.830 120.682 -0.852 18090 7429 1 20 . 1 1 12 12 ASP HA H 138 4.510 4.510 4.681 -0.171 18090 7430 1 20 . 1 1 12 12 ASP C C 138 176.370 176.370 174.913 1.457 18090 7431 1 20 . 1 1 12 12 ASP CA C 138 51.960 51.960 52.518 -0.558 18090 7432 1 20 . 1 1 12 12 ASP CB C 138 41.990 41.990 41.715 0.275 18090 7433 1 20 . 1 1 12 12 ASP H H 138 6.980 6.980 7.655 -0.675 18090 7434 1 20 . 1 1 13 13 PRO HA H 139 4.260 4.260 4.406 -0.146 18090 7435 1 20 . 1 1 13 13 PRO CA C 139 64.350 64.350 63.066 1.284 18090 7436 1 20 . 1 1 13 13 PRO CB C 139 31.760 31.760 32.459 -0.699 18090 7437 1 20 . 1 1 14 14 ASN N N 140 116.840 116.840 117.917 -1.077 18090 7438 1 20 . 1 1 14 14 ASN HA H 140 4.840 4.840 4.470 0.370 18090 7439 1 20 . 1 1 14 14 ASN C C 140 173.840 173.840 175.600 -1.760 18090 7440 1 20 . 1 1 14 14 ASN CA C 140 52.380 52.380 54.049 -1.669 18090 7441 1 20 . 1 1 14 14 ASN CB C 140 38.330 38.330 36.740 1.590 18090 7442 1 20 . 1 1 14 14 ASN H H 140 8.670 8.670 8.727 -0.057 18090 7443 1 20 . 1 1 15 15 LEU N N 141 120.290 120.290 119.959 0.331 18090 7444 1 20 . 1 1 15 15 LEU HA H 141 3.790 3.790 4.544 -0.754 18090 7445 1 20 . 1 1 15 15 LEU C C 141 177.120 177.120 177.479 -0.359 18090 7446 1 20 . 1 1 15 15 LEU CA C 141 59.280 59.280 55.488 3.792 18090 7447 1 20 . 1 1 15 15 LEU CB C 141 42.980 42.980 43.144 -0.164 18090 7448 1 20 . 1 1 15 15 LEU H H 141 7.200 7.200 8.264 -1.064 18090 7449 1 20 . 1 1 16 16 ILE N N 142 115.290 115.290 120.720 -5.430 18090 7450 1 20 . 1 1 16 16 ILE HA H 142 3.480 3.480 3.661 -0.181 18090 7451 1 20 . 1 1 16 16 ILE C C 142 177.990 177.990 177.480 0.510 18090 7452 1 20 . 1 1 16 16 ILE CA C 142 62.690 62.690 65.409 -2.719 18090 7453 1 20 . 1 1 16 16 ILE CB C 142 34.620 34.620 37.755 -3.135 18090 7454 1 20 . 1 1 16 16 ILE H H 142 7.940 7.940 8.443 -0.503 18090 7455 1 20 . 1 1 17 17 GLU N N 143 119.600 119.600 119.081 0.519 18090 7456 1 20 . 1 1 17 17 GLU HA H 143 3.700 3.700 3.990 -0.290 18090 7457 1 20 . 1 1 17 17 GLU C C 143 179.170 179.170 178.776 0.394 18090 7458 1 20 . 1 1 17 17 GLU CA C 143 59.360 59.360 60.170 -0.810 18090 7459 1 20 . 1 1 17 17 GLU CB C 143 28.520 28.520 29.199 -0.679 18090 7460 1 20 . 1 1 17 17 GLU H H 143 7.970 7.970 8.573 -0.603 18090 7461 1 20 . 1 1 18 18 ASN N N 144 117.170 117.170 117.906 -0.736 18090 7462 1 20 . 1 1 18 18 ASN HA H 144 4.270 4.270 4.452 -0.182 18090 7463 1 20 . 1 1 18 18 ASN C C 144 179.120 179.120 177.812 1.308 18090 7464 1 20 . 1 1 18 18 ASN CA C 144 55.490 55.490 55.653 -0.162 18090 7465 1 20 . 1 1 18 18 ASN CB C 144 36.550 36.550 37.817 -1.267 18090 7466 1 20 . 1 1 18 18 ASN H H 144 8.450 8.450 8.372 0.078 18090 7467 1 20 . 1 1 19 19 LEU N N 145 121.060 121.060 120.181 0.879 18090 7468 1 20 . 1 1 19 19 LEU HA H 145 4.020 4.020 3.992 0.028 18090 7469 1 20 . 1 1 19 19 LEU C C 145 180.260 180.260 178.499 1.761 18090 7470 1 20 . 1 1 19 19 LEU CA C 145 56.620 56.620 57.398 -0.778 18090 7471 1 20 . 1 1 19 19 LEU CB C 145 41.780 41.780 41.527 0.253 18090 7472 1 20 . 1 1 19 19 LEU H H 145 7.990 7.990 7.541 0.449 18090 7473 1 20 . 1 1 20 20 LYS N N 146 118.960 118.960 118.445 0.515 18090 7474 1 20 . 1 1 20 20 LYS HA H 146 3.610 3.610 3.950 -0.340 18090 7475 1 20 . 1 1 20 20 LYS C C 146 177.390 177.390 178.686 -1.296 18090 7476 1 20 . 1 1 20 20 LYS CA C 146 59.640 59.640 59.539 0.101 18090 7477 1 20 . 1 1 20 20 LYS CB C 146 32.450 32.450 32.307 0.143 18090 7478 1 20 . 1 1 20 20 LYS H H 146 8.250 8.250 8.013 0.237 18090 7479 1 20 . 1 1 21 21 LYS N N 147 114.720 114.720 116.816 -2.096 18090 7480 1 20 . 1 1 21 21 LYS HA H 147 4.110 4.110 4.224 -0.114 18090 7481 1 20 . 1 1 21 21 LYS C C 147 175.880 175.880 178.493 -2.613 18090 7482 1 20 . 1 1 21 21 LYS CA C 147 56.210 56.210 58.411 -2.201 18090 7483 1 20 . 1 1 21 21 LYS CB C 147 33.000 33.000 32.751 0.249 18090 7484 1 20 . 1 1 21 21 LYS H H 147 7.130 7.130 7.577 -0.447 18090 7485 1 20 . 1 1 22 22 ASN N N 148 122.180 122.180 115.671 6.509 18090 7486 1 20 . 1 1 22 22 ASN HA H 148 4.740 4.740 4.955 -0.215 18090 7487 1 20 . 1 1 22 22 ASN C C 148 174.000 174.000 173.273 0.727 18090 7488 1 20 . 1 1 22 22 ASN CA C 148 50.970 50.970 52.516 -1.546 18090 7489 1 20 . 1 1 22 22 ASN CB C 148 38.670 38.670 39.060 -0.390 18090 7490 1 20 . 1 1 22 22 ASN H H 148 6.930 6.930 7.872 -0.942 18090 7491 1 20 . 1 1 23 23 PRO HA H 149 4.300 4.300 4.736 -0.436 18090 7492 1 20 . 1 1 23 23 PRO CA C 149 64.610 64.610 61.888 2.722 18090 7493 1 20 . 1 1 23 23 PRO CB C 149 32.000 32.000 34.327 -2.327 18090 7494 1 20 . 1 1 24 24 LYS N N 150 116.060 116.060 121.247 -5.187 18090 7495 1 20 . 1 1 24 24 LYS HA H 150 4.070 4.070 3.939 0.131 18090 7496 1 20 . 1 1 24 24 LYS C C 150 178.240 178.240 178.575 -0.335 18090 7497 1 20 . 1 1 24 24 LYS CA C 150 57.950 57.950 59.920 -1.970 18090 7498 1 20 . 1 1 24 24 LYS CB C 150 32.590 32.590 31.846 0.744 18090 7499 1 20 . 1 1 24 24 LYS H H 150 8.520 8.520 8.820 -0.300 18090 7500 1 20 . 1 1 25 25 THR N N 151 105.190 105.190 109.933 -4.743 18090 7501 1 20 . 1 1 25 25 THR HA H 151 4.390 4.390 4.047 0.343 18090 7502 1 20 . 1 1 25 25 THR C C 151 176.090 176.090 176.375 -0.285 18090 7503 1 20 . 1 1 25 25 THR CA C 151 61.400 61.400 64.674 -3.274 18090 7504 1 20 . 1 1 25 25 THR CB C 151 69.440 69.440 67.767 1.673 18090 7505 1 20 . 1 1 25 25 THR H H 151 7.490 7.490 8.150 -0.660 18090 7506 1 20 . 1 1 26 26 SER N N 152 119.700 119.700 116.421 3.279 18090 7507 1 20 . 1 1 26 26 SER HA H 152 3.770 3.770 4.141 -0.371 18090 7508 1 20 . 1 1 26 26 SER C C 152 177.470 177.470 175.990 1.480 18090 7509 1 20 . 1 1 26 26 SER CA C 152 62.450 62.450 61.319 1.131 18090 7510 1 20 . 1 1 26 26 SER CB C 152 62.520 62.520 62.707 -0.187 18090 7511 1 20 . 1 1 26 26 SER H H 152 8.190 8.190 7.929 0.261 18090 7512 1 20 . 1 1 27 27 GLU N N 153 119.870 119.870 122.777 -2.907 18090 7513 1 20 . 1 1 27 27 GLU HA H 153 3.890 3.890 3.962 -0.072 18090 7514 1 20 . 1 1 27 27 GLU C C 153 180.040 180.040 178.709 1.331 18090 7515 1 20 . 1 1 27 27 GLU CA C 153 58.700 58.700 59.367 -0.667 18090 7516 1 20 . 1 1 27 27 GLU CB C 153 28.590 28.590 29.456 -0.866 18090 7517 1 20 . 1 1 27 27 GLU H H 153 8.350 8.350 7.781 0.569 18090 7518 1 20 . 1 1 28 28 MET N N 154 119.430 119.430 117.032 2.398 18090 7519 1 20 . 1 1 28 28 MET HA H 154 4.040 4.040 4.167 -0.127 18090 7520 1 20 . 1 1 28 28 MET C C 154 177.110 177.110 178.141 -1.031 18090 7521 1 20 . 1 1 28 28 MET CA C 154 58.510 58.510 58.657 -0.147 18090 7522 1 20 . 1 1 28 28 MET CB C 154 31.430 31.430 32.735 -1.305 18090 7523 1 20 . 1 1 28 28 MET H H 154 7.850 7.850 7.639 0.211 18090 7524 1 20 . 1 1 29 29 MET N N 155 112.640 112.640 114.372 -1.732 18090 7525 1 20 . 1 1 29 29 MET HA H 155 4.340 4.340 4.270 0.070 18090 7526 1 20 . 1 1 29 29 MET C C 155 175.530 175.530 177.874 -2.344 18090 7527 1 20 . 1 1 29 29 MET CA C 155 53.790 53.790 57.258 -3.468 18090 7528 1 20 . 1 1 29 29 MET CB C 155 30.380 30.380 31.907 -1.527 18090 7529 1 20 . 1 1 29 29 MET H H 155 7.200 7.200 7.344 -0.144 18090 7530 1 20 . 1 1 30 30 LYS N N 156 117.050 117.050 116.875 0.175 18090 7531 1 20 . 1 1 30 30 LYS HA H 156 3.960 3.960 4.286 -0.326 18090 7532 1 20 . 1 1 30 30 LYS C C 156 176.120 176.120 177.092 -0.972 18090 7533 1 20 . 1 1 30 30 LYS CA C 156 57.090 57.090 57.554 -0.464 18090 7534 1 20 . 1 1 30 30 LYS CB C 156 31.960 31.960 32.988 -1.028 18090 7535 1 20 . 1 1 30 30 LYS H H 156 7.130 7.130 7.694 -0.564 18090 7536 1 20 . 1 1 31 31 ASP N N 157 119.810 119.810 118.636 1.174 18090 7537 1 20 . 1 1 31 31 ASP HA H 157 4.860 4.860 4.977 -0.117 18090 7538 1 20 . 1 1 31 31 ASP C C 157 174.890 174.890 174.531 0.359 18090 7539 1 20 . 1 1 31 31 ASP CA C 157 50.520 50.520 54.517 -3.997 18090 7540 1 20 . 1 1 31 31 ASP CB C 157 41.010 41.010 40.872 0.138 18090 7541 1 20 . 1 1 31 31 ASP H H 157 7.340 7.340 7.731 -0.391 18090 7542 1 20 . 1 1 32 32 PRO HA H 158 4.130 4.130 4.458 -0.328 18090 7543 1 20 . 1 1 32 32 PRO CA C 158 64.270 64.270 62.995 1.274 18090 7544 1 20 . 1 1 32 32 PRO CB C 158 31.770 31.770 32.367 -0.597 18090 7545 1 20 . 1 1 33 33 GLN N N 159 117.760 117.760 120.270 -2.510 18090 7546 1 20 . 1 1 33 33 GLN HA H 159 4.000 4.000 4.040 -0.040 18090 7547 1 20 . 1 1 33 33 GLN C C 159 178.740 178.740 177.948 0.792 18090 7548 1 20 . 1 1 33 33 GLN CA C 159 58.220 58.220 58.050 0.170 18090 7549 1 20 . 1 1 33 33 GLN CB C 159 27.870 27.870 28.081 -0.211 18090 7550 1 20 . 1 1 33 33 GLN H H 159 8.150 8.150 8.770 -0.620 18090 7551 1 20 . 1 1 34 34 LEU N N 160 123.300 123.300 120.198 3.102 18090 7552 1 20 . 1 1 34 34 LEU HA H 160 3.970 3.970 4.025 -0.055 18090 7553 1 20 . 1 1 34 34 LEU C C 160 177.980 177.980 178.181 -0.201 18090 7554 1 20 . 1 1 34 34 LEU CA C 160 57.050 57.050 57.294 -0.244 18090 7555 1 20 . 1 1 34 34 LEU CB C 160 40.760 40.760 41.638 -0.878 18090 7556 1 20 . 1 1 34 34 LEU H H 160 7.110 7.110 7.990 -0.880 18090 7557 1 20 . 1 1 35 35 VAL N N 161 118.390 118.390 119.324 -0.934 18090 7558 1 20 . 1 1 35 35 VAL HA H 161 3.110 3.110 3.550 -0.440 18090 7559 1 20 . 1 1 35 35 VAL C C 161 176.840 176.840 177.942 -1.102 18090 7560 1 20 . 1 1 35 35 VAL CA C 161 67.700 67.700 66.647 1.054 18090 7561 1 20 . 1 1 35 35 VAL CB C 161 31.260 31.260 30.608 0.652 18090 7562 1 20 . 1 1 35 35 VAL H H 161 7.430 7.430 7.437 -0.007 18090 7563 1 20 . 1 1 36 36 ALA N N 162 117.600 117.600 121.710 -4.110 18090 7564 1 20 . 1 1 36 36 ALA HA H 162 3.810 3.810 3.940 -0.130 18090 7565 1 20 . 1 1 36 36 ALA C C 162 180.620 180.620 179.722 0.898 18090 7566 1 20 . 1 1 36 36 ALA CA C 162 54.720 54.720 55.370 -0.649 18090 7567 1 20 . 1 1 36 36 ALA CB C 162 17.490 17.490 18.200 -0.710 18090 7568 1 20 . 1 1 36 36 ALA H H 162 7.500 7.500 7.830 -0.330 18090 7569 1 20 . 1 1 37 37 LYS N N 163 119.880 119.880 118.518 1.362 18090 7570 1 20 . 1 1 37 37 LYS HA H 163 3.570 3.570 3.986 -0.416 18090 7571 1 20 . 1 1 37 37 LYS C C 163 177.800 177.800 179.121 -1.321 18090 7572 1 20 . 1 1 37 37 LYS CA C 163 58.880 58.880 58.933 -0.053 18090 7573 1 20 . 1 1 37 37 LYS CB C 163 31.610 31.610 32.034 -0.424 18090 7574 1 20 . 1 1 37 37 LYS H H 163 7.350 7.350 7.416 -0.066 18090 7575 1 20 . 1 1 38 38 LEU N N 164 118.020 118.020 120.034 -2.014 18090 7576 1 20 . 1 1 38 38 LEU HA H 164 3.670 3.670 4.066 -0.396 18090 7577 1 20 . 1 1 38 38 LEU C C 164 179.380 179.380 179.219 0.161 18090 7578 1 20 . 1 1 38 38 LEU CA C 164 57.340 57.340 57.776 -0.436 18090 7579 1 20 . 1 1 38 38 LEU CB C 164 41.660 41.660 41.707 -0.047 18090 7580 1 20 . 1 1 38 38 LEU H H 164 7.660 7.660 8.166 -0.506 18090 7581 1 20 . 1 1 39 39 ILE N N 165 118.070 118.070 118.291 -0.221 18090 7582 1 20 . 1 1 39 39 ILE HA H 165 3.510 3.510 3.649 -0.139 18090 7583 1 20 . 1 1 39 39 ILE C C 165 179.570 179.570 178.235 1.335 18090 7584 1 20 . 1 1 39 39 ILE CA C 165 64.450 64.450 65.525 -1.075 18090 7585 1 20 . 1 1 39 39 ILE CB C 165 37.310 37.310 37.464 -0.154 18090 7586 1 20 . 1 1 39 39 ILE H H 165 8.030 8.030 8.009 0.021 18090 7587 1 20 . 1 1 40 40 GLY N N 166 107.970 107.970 107.963 0.007 18090 7588 1 20 . 1 1 40 40 GLY C C 166 176.470 176.470 175.718 0.752 18090 7589 1 20 . 1 1 40 40 GLY CA C 166 46.410 46.410 46.962 -0.552 18090 7590 1 20 . 1 1 40 40 GLY H H 166 7.590 7.590 7.627 -0.037 18090 7591 1 20 . 1 1 41 41 TYR N N 167 121.270 121.270 122.372 -1.102 18090 7592 1 20 . 1 1 41 41 TYR HA H 167 4.190 4.190 4.211 -0.021 18090 7593 1 20 . 1 1 41 41 TYR C C 167 176.470 176.470 176.234 0.236 18090 7594 1 20 . 1 1 41 41 TYR CA C 167 57.130 57.130 60.448 -3.318 18090 7595 1 20 . 1 1 41 41 TYR CB C 167 35.950 35.950 38.236 -2.286 18090 7596 1 20 . 1 1 41 41 TYR H H 167 7.350 7.350 7.882 -0.532 18090 7597 1 20 . 1 1 42 42 LYS N N 168 116.520 116.520 116.001 0.519 18090 7598 1 20 . 1 1 42 42 LYS HA H 168 3.820 3.820 4.073 -0.253 18090 7599 1 20 . 1 1 42 42 LYS C C 168 177.810 177.810 177.912 -0.102 18090 7600 1 20 . 1 1 42 42 LYS CA C 168 59.390 59.390 58.360 1.030 18090 7601 1 20 . 1 1 42 42 LYS CB C 168 31.580 31.580 32.778 -1.198 18090 7602 1 20 . 1 1 42 42 LYS H H 168 7.460 7.460 8.293 -0.833 18090 7603 1 20 . 1 1 43 43 GLN N N 169 113.750 113.750 116.097 -2.347 18090 7604 1 20 . 1 1 43 43 GLN HA H 169 4.220 4.220 4.159 0.061 18090 7605 1 20 . 1 1 43 43 GLN C C 169 175.840 175.840 177.326 -1.486 18090 7606 1 20 . 1 1 43 43 GLN CA C 169 56.230 56.230 58.199 -1.969 18090 7607 1 20 . 1 1 43 43 GLN CB C 169 29.290 29.290 29.424 -0.134 18090 7608 1 20 . 1 1 43 43 GLN H H 169 7.220 7.220 7.621 -0.401 18090 7609 1 20 . 1 1 44 44 ASN N N 170 114.130 114.130 116.098 -1.968 18090 7610 1 20 . 1 1 44 44 ASN HA H 170 5.050 5.050 4.952 0.098 18090 7611 1 20 . 1 1 44 44 ASN C C 170 172.200 172.200 173.538 -1.338 18090 7612 1 20 . 1 1 44 44 ASN CA C 170 50.780 50.780 53.946 -3.166 18090 7613 1 20 . 1 1 44 44 ASN CB C 170 38.380 38.380 39.789 -1.409 18090 7614 1 20 . 1 1 44 44 ASN H H 170 7.580 7.580 7.624 -0.044 18090 7615 1 20 . 1 1 45 45 PRO HA H 171 4.130 4.130 4.649 -0.519 18090 7616 1 20 . 1 1 45 45 PRO CA C 171 64.800 64.800 62.083 2.717 18090 7617 1 20 . 1 1 45 45 PRO CB C 171 31.360 31.360 31.917 -0.557 18090 7618 1 20 . 1 1 46 46 GLN N N 172 115.570 115.570 124.359 -8.789 18090 7619 1 20 . 1 1 46 46 GLN HA H 172 3.770 3.770 3.767 0.003 18090 7620 1 20 . 1 1 46 46 GLN C C 172 177.360 177.360 177.726 -0.366 18090 7621 1 20 . 1 1 46 46 GLN CA C 172 57.950 57.950 58.151 -0.201 18090 7622 1 20 . 1 1 46 46 GLN CB C 172 27.050 27.050 27.817 -0.766 18090 7623 1 20 . 1 1 46 46 GLN H H 172 8.160 8.160 8.565 -0.405 18090 7624 1 20 . 1 1 47 47 ALA N N 173 121.420 121.420 121.890 -0.470 18090 7625 1 20 . 1 1 47 47 ALA HA H 173 4.050 4.050 4.158 -0.108 18090 7626 1 20 . 1 1 47 47 ALA C C 173 178.090 178.090 179.515 -1.425 18090 7627 1 20 . 1 1 47 47 ALA CA C 173 53.490 53.490 53.959 -0.469 18090 7628 1 20 . 1 1 47 47 ALA CB C 173 18.450 18.450 17.647 0.803 18090 7629 1 20 . 1 1 47 47 ALA H H 173 7.470 7.470 8.106 -0.636 18090 7630 1 20 . 1 1 48 48 ILE N N 174 118.050 118.050 118.653 -0.603 18090 7631 1 20 . 1 1 48 48 ILE HA H 174 3.180 3.180 3.863 -0.683 18090 7632 1 20 . 1 1 48 48 ILE C C 174 176.250 176.250 177.859 -1.609 18090 7633 1 20 . 1 1 48 48 ILE CA C 174 64.030 64.030 64.033 -0.003 18090 7634 1 20 . 1 1 48 48 ILE CB C 174 37.280 37.280 37.086 0.194 18090 7635 1 20 . 1 1 48 48 ILE H H 174 7.150 7.150 7.343 -0.193 18090 7636 1 20 . 1 1 49 49 GLY N N 175 105.390 105.390 106.668 -1.278 18090 7637 1 20 . 1 1 49 49 GLY C C 175 174.220 174.220 176.002 -1.782 18090 7638 1 20 . 1 1 49 49 GLY CA C 175 46.700 46.700 47.035 -0.334 18090 7639 1 20 . 1 1 49 49 GLY H H 175 7.550 7.550 7.778 -0.228 18090 7640 1 20 . 1 1 50 50 GLN N N 176 116.230 116.230 118.655 -2.425 18090 7641 1 20 . 1 1 50 50 GLN HA H 176 4.210 4.210 4.555 -0.345 18090 7642 1 20 . 1 1 50 50 GLN C C 176 178.120 178.120 178.298 -0.178 18090 7643 1 20 . 1 1 50 50 GLN CA C 176 57.320 57.320 57.990 -0.670 18090 7644 1 20 . 1 1 50 50 GLN CB C 176 28.630 28.630 29.201 -0.571 18090 7645 1 20 . 1 1 50 50 GLN H H 176 7.390 7.390 8.021 -0.631 18090 7646 1 20 . 1 1 51 51 ASP N N 177 120.000 120.000 121.010 -1.010 18090 7647 1 20 . 1 1 51 51 ASP HA H 177 4.420 4.420 4.638 -0.218 18090 7648 1 20 . 1 1 51 51 ASP C C 177 177.950 177.950 178.309 -0.359 18090 7649 1 20 . 1 1 51 51 ASP CA C 177 55.840 55.840 56.005 -0.166 18090 7650 1 20 . 1 1 51 51 ASP CB C 177 40.310 40.310 40.848 -0.538 18090 7651 1 20 . 1 1 51 51 ASP H H 177 7.870 7.870 7.903 -0.033 18090 7652 1 20 . 1 1 52 52 LEU N N 178 120.010 120.010 120.426 -0.416 18090 7653 1 20 . 1 1 52 52 LEU HA H 178 3.650 3.650 3.986 -0.336 18090 7654 1 20 . 1 1 52 52 LEU C C 178 175.810 175.810 178.261 -2.451 18090 7655 1 20 . 1 1 52 52 LEU CA C 178 57.620 57.620 57.827 -0.207 18090 7656 1 20 . 1 1 52 52 LEU CB C 178 41.880 41.880 41.702 0.178 18090 7657 1 20 . 1 1 52 52 LEU H H 178 7.860 7.860 7.615 0.245 18090 7658 1 20 . 1 1 53 53 PHE N N 179 110.580 110.580 113.809 -3.229 18090 7659 1 20 . 1 1 53 53 PHE HA H 179 4.230 4.230 4.333 -0.103 18090 7660 1 20 . 1 1 53 53 PHE C C 179 176.370 176.370 178.060 -1.690 18090 7661 1 20 . 1 1 53 53 PHE CA C 179 58.730 58.730 60.438 -1.708 18090 7662 1 20 . 1 1 53 53 PHE CB C 179 38.720 38.720 38.843 -0.123 18090 7663 1 20 . 1 1 53 53 PHE H H 179 7.210 7.210 7.987 -0.777 18090 7664 1 20 . 1 1 54 54 THR N N 180 108.190 108.190 108.146 0.044 18090 7665 1 20 . 1 1 54 54 THR HA H 180 4.300 4.300 4.329 -0.029 18090 7666 1 20 . 1 1 54 54 THR C C 180 174.400 174.400 174.684 -0.284 18090 7667 1 20 . 1 1 54 54 THR CA C 180 62.020 62.020 63.120 -1.100 18090 7668 1 20 . 1 1 54 54 THR CB C 180 69.730 69.730 69.678 0.052 18090 7669 1 20 . 1 1 54 54 THR H H 180 7.550 7.550 7.469 0.081 18090 7670 1 20 . 1 1 55 55 ASP N N 181 120.060 120.060 122.644 -2.584 18090 7671 1 20 . 1 1 55 55 ASP HA H 181 5.020 5.020 5.060 -0.040 18090 7672 1 20 . 1 1 55 55 ASP C C 181 174.120 174.120 175.356 -1.236 18090 7673 1 20 . 1 1 55 55 ASP CA C 181 50.560 50.560 50.620 -0.060 18090 7674 1 20 . 1 1 55 55 ASP CB C 181 41.190 41.190 43.293 -2.103 18090 7675 1 20 . 1 1 55 55 ASP H H 181 7.480 7.480 7.929 -0.449 18090 7676 1 20 . 1 1 56 56 PRO HA H 182 4.320 4.320 4.320 0.000 18090 7677 1 20 . 1 1 56 56 PRO CA C 182 64.280 64.280 64.911 -0.631 18090 7678 1 20 . 1 1 56 56 PRO CB C 182 31.980 31.980 32.604 -0.624 18090 7679 1 20 . 1 1 57 57 ARG N N 183 117.660 117.660 118.367 -0.707 18090 7680 1 20 . 1 1 57 57 ARG HA H 183 3.960 3.960 4.098 -0.138 18090 7681 1 20 . 1 1 57 57 ARG C C 183 179.030 179.030 178.676 0.354 18090 7682 1 20 . 1 1 57 57 ARG CA C 183 59.000 59.000 58.803 0.197 18090 7683 1 20 . 1 1 57 57 ARG CB C 183 29.750 29.750 29.346 0.404 18090 7684 1 20 . 1 1 57 57 ARG H H 183 7.920 7.920 8.095 -0.175 18090 7685 1 20 . 1 1 58 58 LEU N N 184 115.670 115.670 119.473 -3.803 18090 7686 1 20 . 1 1 58 58 LEU HA H 184 3.850 3.850 3.952 -0.102 18090 7687 1 20 . 1 1 58 58 LEU C C 184 178.770 178.770 179.108 -0.338 18090 7688 1 20 . 1 1 58 58 LEU CA C 184 57.110 57.110 57.749 -0.639 18090 7689 1 20 . 1 1 58 58 LEU CB C 184 41.310 41.310 41.590 -0.280 18090 7690 1 20 . 1 1 58 58 LEU H H 184 7.750 7.750 8.177 -0.427 18090 7691 1 20 . 1 1 59 59 MET N N 185 118.570 118.570 116.408 2.162 18090 7692 1 20 . 1 1 59 59 MET HA H 185 4.060 4.060 4.141 -0.081 18090 7693 1 20 . 1 1 59 59 MET C C 185 177.540 177.540 178.142 -0.602 18090 7694 1 20 . 1 1 59 59 MET CA C 185 58.090 58.090 59.340 -1.250 18090 7695 1 20 . 1 1 59 59 MET CB C 185 31.270 31.270 32.190 -0.920 18090 7696 1 20 . 1 1 59 59 MET H H 185 7.590 7.590 7.678 -0.087 18090 7697 1 20 . 1 1 60 60 THR N N 186 116.390 116.390 117.045 -0.655 18090 7698 1 20 . 1 1 60 60 THR HA H 186 3.680 3.680 4.023 -0.343 18090 7699 1 20 . 1 1 60 60 THR C C 186 177.440 177.440 176.418 1.022 18090 7700 1 20 . 1 1 60 60 THR CA C 186 66.940 66.940 67.346 -0.406 18090 7701 1 20 . 1 1 60 60 THR CB C 186 68.030 68.030 68.160 -0.130 18090 7702 1 20 . 1 1 60 60 THR H H 186 7.180 7.180 7.771 -0.591 18090 7703 1 20 . 1 1 61 61 ILE N N 187 123.840 123.840 121.978 1.862 18090 7704 1 20 . 1 1 61 61 ILE HA H 187 3.290 3.290 3.754 -0.464 18090 7705 1 20 . 1 1 61 61 ILE C C 187 176.660 176.660 178.079 -1.419 18090 7706 1 20 . 1 1 61 61 ILE CA C 187 65.850 65.850 65.463 0.387 18090 7707 1 20 . 1 1 61 61 ILE CB C 187 37.640 37.640 37.813 -0.173 18090 7708 1 20 . 1 1 61 61 ILE H H 187 8.010 8.010 7.841 0.169 18090 7709 1 20 . 1 1 62 62 MET N N 188 118.210 118.210 118.385 -0.175 18090 7710 1 20 . 1 1 62 62 MET HA H 188 3.910 3.910 4.011 -0.101 18090 7711 1 20 . 1 1 62 62 MET C C 188 177.540 177.540 178.392 -0.852 18090 7712 1 20 . 1 1 62 62 MET CA C 188 58.530 58.530 58.900 -0.370 18090 7713 1 20 . 1 1 62 62 MET CB C 188 31.200 31.200 31.576 -0.376 18090 7714 1 20 . 1 1 62 62 MET H H 188 8.560 8.560 7.416 1.144 18090 7715 1 20 . 1 1 63 63 ALA N N 189 119.850 119.850 122.073 -2.223 18090 7716 1 20 . 1 1 63 63 ALA HA H 189 3.730 3.730 3.902 -0.172 18090 7717 1 20 . 1 1 63 63 ALA C C 189 179.550 179.550 179.266 0.284 18090 7718 1 20 . 1 1 63 63 ALA CA C 189 55.470 55.470 55.446 0.024 18090 7719 1 20 . 1 1 63 63 ALA CB C 189 17.640 17.640 18.180 -0.540 18090 7720 1 20 . 1 1 63 63 ALA H H 189 8.210 8.210 8.181 0.029 18090 7721 1 20 . 1 1 64 64 THR N N 190 114.570 114.570 113.825 0.745 18090 7722 1 20 . 1 1 64 64 THR HA H 190 3.790 3.790 3.920 -0.130 18090 7723 1 20 . 1 1 64 64 THR C C 190 177.640 177.640 176.954 0.686 18090 7724 1 20 . 1 1 64 64 THR CA C 190 66.690 66.690 66.214 0.476 18090 7725 1 20 . 1 1 64 64 THR CB C 190 68.310 68.310 68.564 -0.255 18090 7726 1 20 . 1 1 64 64 THR H H 190 7.740 7.740 7.575 0.165 18090 7727 1 20 . 1 1 65 65 LEU N N 191 122.410 122.410 121.448 0.962 18090 7728 1 20 . 1 1 65 65 LEU HA H 191 3.930 3.930 3.988 -0.058 18090 7729 1 20 . 1 1 65 65 LEU C C 191 178.470 178.470 179.546 -1.076 18090 7730 1 20 . 1 1 65 65 LEU CA C 191 57.120 57.120 57.969 -0.849 18090 7731 1 20 . 1 1 65 65 LEU CB C 191 41.830 41.830 41.797 0.033 18090 7732 1 20 . 1 1 65 65 LEU H H 191 8.180 8.180 7.575 0.605 18090 7733 1 20 . 1 1 66 66 MET N N 192 115.320 115.320 117.211 -1.891 18090 7734 1 20 . 1 1 66 66 MET HA H 192 4.090 4.090 4.297 -0.207 18090 7735 1 20 . 1 1 66 66 MET C C 192 176.090 176.090 178.344 -2.254 18090 7736 1 20 . 1 1 66 66 MET CA C 192 56.390 56.390 57.648 -1.258 18090 7737 1 20 . 1 1 66 66 MET CB C 192 33.770 33.770 32.243 1.527 18090 7738 1 20 . 1 1 66 66 MET H H 192 7.880 7.880 8.515 -0.635 18090 7739 1 20 . 1 1 67 67 GLY N N 193 107.490 107.490 105.861 1.629 18090 7740 1 20 . 1 1 67 67 GLY C C 193 174.390 174.390 175.072 -0.682 18090 7741 1 20 . 1 1 67 67 GLY CA C 193 45.880 45.880 45.658 0.222 18090 7742 1 20 . 1 1 67 67 GLY H H 193 7.580 7.580 8.293 -0.713 18090 7743 1 20 . 1 1 68 68 VAL N N 194 118.520 118.520 115.672 2.848 18090 7744 1 20 . 1 1 68 68 VAL HA H 194 3.940 3.940 3.573 0.367 18090 7745 1 20 . 1 1 68 68 VAL C C 194 174.760 174.760 175.431 -0.671 18090 7746 1 20 . 1 1 68 68 VAL CA C 194 61.510 61.510 63.998 -2.488 18090 7747 1 20 . 1 1 68 68 VAL CB C 194 32.670 32.670 29.525 3.145 18090 7748 1 20 . 1 1 68 68 VAL H H 194 7.840 7.840 7.760 0.080 18090 7749 1 20 . 1 1 69 69 ASP N N 195 124.550 124.550 119.728 4.822 18090 7750 1 20 . 1 1 69 69 ASP HA H 195 4.430 4.430 4.867 -0.437 18090 7751 1 20 . 1 1 69 69 ASP C C 195 175.140 175.140 176.169 -1.029 18090 7752 1 20 . 1 1 69 69 ASP CA C 195 53.760 53.760 53.609 0.151 18090 7753 1 20 . 1 1 69 69 ASP CB C 195 40.920 40.920 42.167 -1.247 18090 7754 1 20 . 1 1 69 69 ASP H H 195 8.400 8.400 7.896 0.504 18090 7755 1 20 . 1 1 70 70 LEU N N 196 123.930 123.930 120.933 2.997 18090 7756 1 20 . 1 1 70 70 LEU HA H 196 4.200 4.200 4.483 -0.283 18090 7757 1 20 . 1 1 70 70 LEU C C 196 175.950 175.950 175.906 0.044 18090 7758 1 20 . 1 1 70 70 LEU CA C 196 54.380 54.380 54.464 -0.084 18090 7759 1 20 . 1 1 70 70 LEU CB C 196 41.610 41.610 45.017 -3.407 18090 7760 1 20 . 1 1 70 70 LEU H H 196 8.160 8.160 8.143 0.017 18090 7761 1 21 . 1 1 2 2 PRO HA H 128 4.220 4.220 4.402 -0.182 18090 7762 1 21 . 1 1 2 2 PRO CA C 128 63.320 63.320 63.777 -0.457 18090 7763 1 21 . 1 1 2 2 PRO CB C 128 31.680 31.680 32.256 -0.576 18090 7764 1 21 . 1 1 3 3 ASP N N 129 119.320 119.320 116.862 2.458 18090 7765 1 21 . 1 1 3 3 ASP HA H 129 4.400 4.400 4.725 -0.325 18090 7766 1 21 . 1 1 3 3 ASP C C 129 176.120 176.120 174.716 1.404 18090 7767 1 21 . 1 1 3 3 ASP CA C 129 54.050 54.050 53.325 0.725 18090 7768 1 21 . 1 1 3 3 ASP CB C 129 40.770 40.770 43.182 -2.412 18090 7769 1 21 . 1 1 3 3 ASP H H 129 8.310 8.310 8.145 0.165 18090 7770 1 21 . 1 1 4 4 LEU N N 130 122.280 122.280 118.998 3.282 18090 7771 1 21 . 1 1 4 4 LEU HA H 130 4.130 4.130 4.022 0.108 18090 7772 1 21 . 1 1 4 4 LEU C C 130 177.280 177.280 177.113 0.167 18090 7773 1 21 . 1 1 4 4 LEU CA C 130 55.350 55.350 55.434 -0.084 18090 7774 1 21 . 1 1 4 4 LEU CB C 130 41.490 41.490 42.264 -0.774 18090 7775 1 21 . 1 1 4 4 LEU H H 130 8.080 8.080 8.339 -0.259 18090 7776 1 21 . 1 1 5 5 GLY N N 131 107.830 107.830 106.127 1.703 18090 7777 1 21 . 1 1 5 5 GLY C C 131 175.120 175.120 173.142 1.978 18090 7778 1 21 . 1 1 5 5 GLY CA C 131 45.300 45.300 45.188 0.112 18090 7779 1 21 . 1 1 5 5 GLY H H 131 8.180 8.180 8.360 -0.180 18090 7780 1 21 . 1 1 6 6 LEU N N 132 121.080 121.080 116.332 4.748 18090 7781 1 21 . 1 1 6 6 LEU HA H 132 3.870 3.870 4.476 -0.606 18090 7782 1 21 . 1 1 6 6 LEU C C 132 178.000 178.000 177.651 0.349 18090 7783 1 21 . 1 1 6 6 LEU CA C 132 57.180 57.180 53.482 3.698 18090 7784 1 21 . 1 1 6 6 LEU CB C 132 41.870 41.870 44.816 -2.946 18090 7785 1 21 . 1 1 6 6 LEU H H 132 8.150 8.150 7.415 0.735 18090 7786 1 21 . 1 1 7 7 THR N N 133 111.580 111.580 113.889 -2.309 18090 7787 1 21 . 1 1 7 7 THR HA H 133 3.730 3.730 4.008 -0.278 18090 7788 1 21 . 1 1 7 7 THR C C 133 176.530 176.530 176.082 0.448 18090 7789 1 21 . 1 1 7 7 THR CA C 133 65.940 65.940 66.196 -0.256 18090 7790 1 21 . 1 1 7 7 THR CB C 133 68.130 68.130 68.516 -0.386 18090 7791 1 21 . 1 1 7 7 THR H H 133 7.970 7.970 8.712 -0.742 18090 7792 1 21 . 1 1 8 8 GLN N N 134 119.490 119.490 121.451 -1.961 18090 7793 1 21 . 1 1 8 8 GLN HA H 134 3.990 3.990 3.928 0.062 18090 7794 1 21 . 1 1 8 8 GLN C C 134 178.190 178.190 178.356 -0.166 18090 7795 1 21 . 1 1 8 8 GLN CA C 134 57.930 57.930 58.757 -0.827 18090 7796 1 21 . 1 1 8 8 GLN CB C 134 27.850 27.850 27.865 -0.015 18090 7797 1 21 . 1 1 8 8 GLN H H 134 7.890 7.890 8.383 -0.493 18090 7798 1 21 . 1 1 9 9 LEU N N 135 120.170 120.170 117.847 2.323 18090 7799 1 21 . 1 1 9 9 LEU HA H 135 3.820 3.820 3.953 -0.133 18090 7800 1 21 . 1 1 9 9 LEU C C 135 177.810 177.810 178.314 -0.504 18090 7801 1 21 . 1 1 9 9 LEU CA C 135 57.470 57.470 57.120 0.350 18090 7802 1 21 . 1 1 9 9 LEU CB C 135 41.640 41.640 41.970 -0.330 18090 7803 1 21 . 1 1 9 9 LEU H H 135 7.600 7.600 7.254 0.346 18090 7804 1 21 . 1 1 10 10 PHE N N 136 111.950 111.950 113.137 -1.187 18090 7805 1 21 . 1 1 10 10 PHE HA H 136 4.380 4.380 4.406 -0.026 18090 7806 1 21 . 1 1 10 10 PHE C C 136 174.990 174.990 176.944 -1.954 18090 7807 1 21 . 1 1 10 10 PHE CA C 136 58.450 58.450 57.425 1.025 18090 7808 1 21 . 1 1 10 10 PHE CB C 136 38.570 38.570 37.978 0.592 18090 7809 1 21 . 1 1 10 10 PHE H H 136 7.410 7.410 6.569 0.841 18090 7810 1 21 . 1 1 11 11 ALA N N 137 120.230 120.230 121.984 -1.754 18090 7811 1 21 . 1 1 11 11 ALA HA H 137 4.130 4.130 4.154 -0.024 18090 7812 1 21 . 1 1 11 11 ALA C C 137 177.090 177.090 178.209 -1.119 18090 7813 1 21 . 1 1 11 11 ALA CA C 137 52.580 52.580 53.544 -0.964 18090 7814 1 21 . 1 1 11 11 ALA CB C 137 18.660 18.660 18.750 -0.090 18090 7815 1 21 . 1 1 11 11 ALA H H 137 7.330 7.330 8.583 -1.253 18090 7816 1 21 . 1 1 12 12 ASP N N 138 119.830 119.830 120.835 -1.005 18090 7817 1 21 . 1 1 12 12 ASP HA H 138 4.510 4.510 4.722 -0.212 18090 7818 1 21 . 1 1 12 12 ASP C C 138 176.370 176.370 174.861 1.509 18090 7819 1 21 . 1 1 12 12 ASP CA C 138 51.960 51.960 52.869 -0.909 18090 7820 1 21 . 1 1 12 12 ASP CB C 138 41.990 41.990 41.604 0.386 18090 7821 1 21 . 1 1 12 12 ASP H H 138 6.980 6.980 7.626 -0.646 18090 7822 1 21 . 1 1 13 13 PRO HA H 139 4.260 4.260 4.374 -0.114 18090 7823 1 21 . 1 1 13 13 PRO CA C 139 64.350 64.350 62.843 1.507 18090 7824 1 21 . 1 1 13 13 PRO CB C 139 31.760 31.760 32.378 -0.618 18090 7825 1 21 . 1 1 14 14 ASN N N 140 116.840 116.840 117.354 -0.514 18090 7826 1 21 . 1 1 14 14 ASN HA H 140 4.840 4.840 4.481 0.359 18090 7827 1 21 . 1 1 14 14 ASN C C 140 173.840 173.840 175.301 -1.461 18090 7828 1 21 . 1 1 14 14 ASN CA C 140 52.380 52.380 54.179 -1.799 18090 7829 1 21 . 1 1 14 14 ASN CB C 140 38.330 38.330 36.954 1.376 18090 7830 1 21 . 1 1 14 14 ASN H H 140 8.670 8.670 8.687 -0.017 18090 7831 1 21 . 1 1 15 15 LEU N N 141 120.290 120.290 120.132 0.158 18090 7832 1 21 . 1 1 15 15 LEU HA H 141 3.790 3.790 4.537 -0.747 18090 7833 1 21 . 1 1 15 15 LEU C C 141 177.120 177.120 177.517 -0.397 18090 7834 1 21 . 1 1 15 15 LEU CA C 141 59.280 59.280 55.525 3.755 18090 7835 1 21 . 1 1 15 15 LEU CB C 141 42.980 42.980 43.162 -0.182 18090 7836 1 21 . 1 1 15 15 LEU H H 141 7.200 7.200 8.360 -1.160 18090 7837 1 21 . 1 1 16 16 ILE N N 142 115.290 115.290 120.580 -5.290 18090 7838 1 21 . 1 1 16 16 ILE HA H 142 3.480 3.480 3.670 -0.190 18090 7839 1 21 . 1 1 16 16 ILE C C 142 177.990 177.990 177.469 0.521 18090 7840 1 21 . 1 1 16 16 ILE CA C 142 62.690 62.690 65.324 -2.634 18090 7841 1 21 . 1 1 16 16 ILE CB C 142 34.620 34.620 37.748 -3.128 18090 7842 1 21 . 1 1 16 16 ILE H H 142 7.940 7.940 8.421 -0.481 18090 7843 1 21 . 1 1 17 17 GLU N N 143 119.600 119.600 119.105 0.495 18090 7844 1 21 . 1 1 17 17 GLU HA H 143 3.700 3.700 3.994 -0.294 18090 7845 1 21 . 1 1 17 17 GLU C C 143 179.170 179.170 178.769 0.401 18090 7846 1 21 . 1 1 17 17 GLU CA C 143 59.360 59.360 60.149 -0.789 18090 7847 1 21 . 1 1 17 17 GLU CB C 143 28.520 28.520 29.205 -0.685 18090 7848 1 21 . 1 1 17 17 GLU H H 143 7.970 7.970 8.566 -0.596 18090 7849 1 21 . 1 1 18 18 ASN N N 144 117.170 117.170 117.895 -0.725 18090 7850 1 21 . 1 1 18 18 ASN HA H 144 4.270 4.270 4.453 -0.183 18090 7851 1 21 . 1 1 18 18 ASN C C 144 179.120 179.120 177.816 1.304 18090 7852 1 21 . 1 1 18 18 ASN CA C 144 55.490 55.490 55.648 -0.158 18090 7853 1 21 . 1 1 18 18 ASN CB C 144 36.550 36.550 37.825 -1.275 18090 7854 1 21 . 1 1 18 18 ASN H H 144 8.450 8.450 8.374 0.076 18090 7855 1 21 . 1 1 19 19 LEU N N 145 121.060 121.060 120.131 0.929 18090 7856 1 21 . 1 1 19 19 LEU HA H 145 4.020 4.020 3.996 0.024 18090 7857 1 21 . 1 1 19 19 LEU C C 145 180.260 180.260 178.531 1.729 18090 7858 1 21 . 1 1 19 19 LEU CA C 145 56.620 56.620 57.387 -0.767 18090 7859 1 21 . 1 1 19 19 LEU CB C 145 41.780 41.780 41.552 0.228 18090 7860 1 21 . 1 1 19 19 LEU H H 145 7.990 7.990 7.547 0.443 18090 7861 1 21 . 1 1 20 20 LYS N N 146 118.960 118.960 118.300 0.660 18090 7862 1 21 . 1 1 20 20 LYS HA H 146 3.610 3.610 3.991 -0.381 18090 7863 1 21 . 1 1 20 20 LYS C C 146 177.390 177.390 178.374 -0.984 18090 7864 1 21 . 1 1 20 20 LYS CA C 146 59.640 59.640 59.298 0.342 18090 7865 1 21 . 1 1 20 20 LYS CB C 146 32.450 32.450 32.366 0.084 18090 7866 1 21 . 1 1 20 20 LYS H H 146 8.250 8.250 7.941 0.309 18090 7867 1 21 . 1 1 21 21 LYS N N 147 114.720 114.720 116.427 -1.707 18090 7868 1 21 . 1 1 21 21 LYS HA H 147 4.110 4.110 4.247 -0.137 18090 7869 1 21 . 1 1 21 21 LYS C C 147 175.880 175.880 178.211 -2.331 18090 7870 1 21 . 1 1 21 21 LYS CA C 147 56.210 56.210 58.238 -2.028 18090 7871 1 21 . 1 1 21 21 LYS CB C 147 33.000 33.000 32.861 0.139 18090 7872 1 21 . 1 1 21 21 LYS H H 147 7.130 7.130 7.626 -0.496 18090 7873 1 21 . 1 1 22 22 ASN N N 148 122.180 122.180 115.481 6.699 18090 7874 1 21 . 1 1 22 22 ASN HA H 148 4.740 4.740 4.907 -0.167 18090 7875 1 21 . 1 1 22 22 ASN C C 148 174.000 174.000 173.524 0.476 18090 7876 1 21 . 1 1 22 22 ASN CA C 148 50.970 50.970 52.783 -1.813 18090 7877 1 21 . 1 1 22 22 ASN CB C 148 38.670 38.670 38.920 -0.250 18090 7878 1 21 . 1 1 22 22 ASN H H 148 6.930 6.930 7.858 -0.928 18090 7879 1 21 . 1 1 23 23 PRO HA H 149 4.300 4.300 4.737 -0.437 18090 7880 1 21 . 1 1 23 23 PRO CA C 149 64.610 64.610 61.801 2.809 18090 7881 1 21 . 1 1 23 23 PRO CB C 149 32.000 32.000 34.491 -2.491 18090 7882 1 21 . 1 1 24 24 LYS N N 150 116.060 116.060 121.187 -5.127 18090 7883 1 21 . 1 1 24 24 LYS HA H 150 4.070 4.070 3.941 0.129 18090 7884 1 21 . 1 1 24 24 LYS C C 150 178.240 178.240 178.559 -0.319 18090 7885 1 21 . 1 1 24 24 LYS CA C 150 57.950 57.950 59.685 -1.735 18090 7886 1 21 . 1 1 24 24 LYS CB C 150 32.590 32.590 31.903 0.687 18090 7887 1 21 . 1 1 24 24 LYS H H 150 8.520 8.520 8.822 -0.302 18090 7888 1 21 . 1 1 25 25 THR N N 151 105.190 105.190 109.940 -4.750 18090 7889 1 21 . 1 1 25 25 THR HA H 151 4.390 4.390 4.048 0.342 18090 7890 1 21 . 1 1 25 25 THR C C 151 176.090 176.090 176.368 -0.278 18090 7891 1 21 . 1 1 25 25 THR CA C 151 61.400 61.400 64.649 -3.249 18090 7892 1 21 . 1 1 25 25 THR CB C 151 69.440 69.440 67.796 1.644 18090 7893 1 21 . 1 1 25 25 THR H H 151 7.490 7.490 8.154 -0.664 18090 7894 1 21 . 1 1 26 26 SER N N 152 119.700 119.700 116.443 3.257 18090 7895 1 21 . 1 1 26 26 SER HA H 152 3.770 3.770 4.142 -0.372 18090 7896 1 21 . 1 1 26 26 SER C C 152 177.470 177.470 176.000 1.470 18090 7897 1 21 . 1 1 26 26 SER CA C 152 62.450 62.450 61.325 1.125 18090 7898 1 21 . 1 1 26 26 SER CB C 152 62.520 62.520 62.714 -0.194 18090 7899 1 21 . 1 1 26 26 SER H H 152 8.190 8.190 7.922 0.268 18090 7900 1 21 . 1 1 27 27 GLU N N 153 119.870 119.870 122.756 -2.886 18090 7901 1 21 . 1 1 27 27 GLU HA H 153 3.890 3.890 3.964 -0.074 18090 7902 1 21 . 1 1 27 27 GLU C C 153 180.040 180.040 178.703 1.337 18090 7903 1 21 . 1 1 27 27 GLU CA C 153 58.700 58.700 59.372 -0.672 18090 7904 1 21 . 1 1 27 27 GLU CB C 153 28.590 28.590 29.452 -0.862 18090 7905 1 21 . 1 1 27 27 GLU H H 153 8.350 8.350 7.801 0.549 18090 7906 1 21 . 1 1 28 28 MET N N 154 119.430 119.430 117.023 2.407 18090 7907 1 21 . 1 1 28 28 MET HA H 154 4.040 4.040 4.168 -0.128 18090 7908 1 21 . 1 1 28 28 MET C C 154 177.110 177.110 178.141 -1.031 18090 7909 1 21 . 1 1 28 28 MET CA C 154 58.510 58.510 58.642 -0.132 18090 7910 1 21 . 1 1 28 28 MET CB C 154 31.430 31.430 32.739 -1.309 18090 7911 1 21 . 1 1 28 28 MET H H 154 7.850 7.850 7.639 0.211 18090 7912 1 21 . 1 1 29 29 MET N N 155 112.640 112.640 114.625 -1.985 18090 7913 1 21 . 1 1 29 29 MET HA H 155 4.340 4.340 4.265 0.075 18090 7914 1 21 . 1 1 29 29 MET C C 155 175.530 175.530 177.904 -2.374 18090 7915 1 21 . 1 1 29 29 MET CA C 155 53.790 53.790 57.230 -3.440 18090 7916 1 21 . 1 1 29 29 MET CB C 155 30.380 30.380 31.903 -1.523 18090 7917 1 21 . 1 1 29 29 MET H H 155 7.200 7.200 7.341 -0.141 18090 7918 1 21 . 1 1 30 30 LYS N N 156 117.050 117.050 117.156 -0.106 18090 7919 1 21 . 1 1 30 30 LYS HA H 156 3.960 3.960 4.259 -0.299 18090 7920 1 21 . 1 1 30 30 LYS C C 156 176.120 176.120 177.061 -0.941 18090 7921 1 21 . 1 1 30 30 LYS CA C 156 57.090 57.090 57.675 -0.585 18090 7922 1 21 . 1 1 30 30 LYS CB C 156 31.960 31.960 33.051 -1.091 18090 7923 1 21 . 1 1 30 30 LYS H H 156 7.130 7.130 7.722 -0.592 18090 7924 1 21 . 1 1 31 31 ASP N N 157 119.810 119.810 118.179 1.631 18090 7925 1 21 . 1 1 31 31 ASP HA H 157 4.860 4.860 4.891 -0.031 18090 7926 1 21 . 1 1 31 31 ASP C C 157 174.890 174.890 174.353 0.537 18090 7927 1 21 . 1 1 31 31 ASP CA C 157 50.520 50.520 54.563 -4.043 18090 7928 1 21 . 1 1 31 31 ASP CB C 157 41.010 41.010 40.715 0.295 18090 7929 1 21 . 1 1 31 31 ASP H H 157 7.340 7.340 7.776 -0.436 18090 7930 1 21 . 1 1 32 32 PRO HA H 158 4.130 4.130 4.451 -0.321 18090 7931 1 21 . 1 1 32 32 PRO CA C 158 64.270 64.270 62.826 1.444 18090 7932 1 21 . 1 1 32 32 PRO CB C 158 31.770 31.770 32.416 -0.646 18090 7933 1 21 . 1 1 33 33 GLN N N 159 117.760 117.760 120.271 -2.511 18090 7934 1 21 . 1 1 33 33 GLN HA H 159 4.000 4.000 4.037 -0.037 18090 7935 1 21 . 1 1 33 33 GLN C C 159 178.740 178.740 177.948 0.792 18090 7936 1 21 . 1 1 33 33 GLN CA C 159 58.220 58.220 58.054 0.166 18090 7937 1 21 . 1 1 33 33 GLN CB C 159 27.870 27.870 28.070 -0.200 18090 7938 1 21 . 1 1 33 33 GLN H H 159 8.150 8.150 8.770 -0.620 18090 7939 1 21 . 1 1 34 34 LEU N N 160 123.300 123.300 120.214 3.086 18090 7940 1 21 . 1 1 34 34 LEU HA H 160 3.970 3.970 4.020 -0.050 18090 7941 1 21 . 1 1 34 34 LEU C C 160 177.980 177.980 178.178 -0.198 18090 7942 1 21 . 1 1 34 34 LEU CA C 160 57.050 57.050 57.310 -0.260 18090 7943 1 21 . 1 1 34 34 LEU CB C 160 40.760 40.760 41.634 -0.874 18090 7944 1 21 . 1 1 34 34 LEU H H 160 7.110 7.110 7.992 -0.882 18090 7945 1 21 . 1 1 35 35 VAL N N 161 118.390 118.390 119.280 -0.890 18090 7946 1 21 . 1 1 35 35 VAL HA H 161 3.110 3.110 3.555 -0.445 18090 7947 1 21 . 1 1 35 35 VAL C C 161 176.840 176.840 177.954 -1.114 18090 7948 1 21 . 1 1 35 35 VAL CA C 161 67.700 67.700 66.631 1.069 18090 7949 1 21 . 1 1 35 35 VAL CB C 161 31.260 31.260 30.615 0.645 18090 7950 1 21 . 1 1 35 35 VAL H H 161 7.430 7.430 7.438 -0.008 18090 7951 1 21 . 1 1 36 36 ALA N N 162 117.600 117.600 121.705 -4.105 18090 7952 1 21 . 1 1 36 36 ALA HA H 162 3.810 3.810 3.941 -0.131 18090 7953 1 21 . 1 1 36 36 ALA C C 162 180.620 180.620 179.720 0.900 18090 7954 1 21 . 1 1 36 36 ALA CA C 162 54.720 54.720 55.365 -0.645 18090 7955 1 21 . 1 1 36 36 ALA CB C 162 17.490 17.490 18.202 -0.712 18090 7956 1 21 . 1 1 36 36 ALA H H 162 7.500 7.500 7.831 -0.331 18090 7957 1 21 . 1 1 37 37 LYS N N 163 119.880 119.880 118.538 1.342 18090 7958 1 21 . 1 1 37 37 LYS HA H 163 3.570 3.570 3.986 -0.416 18090 7959 1 21 . 1 1 37 37 LYS C C 163 177.800 177.800 179.109 -1.309 18090 7960 1 21 . 1 1 37 37 LYS CA C 163 58.880 58.880 58.934 -0.054 18090 7961 1 21 . 1 1 37 37 LYS CB C 163 31.610 31.610 32.034 -0.424 18090 7962 1 21 . 1 1 37 37 LYS H H 163 7.350 7.350 7.419 -0.069 18090 7963 1 21 . 1 1 38 38 LEU N N 164 118.020 118.020 119.950 -1.930 18090 7964 1 21 . 1 1 38 38 LEU HA H 164 3.670 3.670 4.068 -0.398 18090 7965 1 21 . 1 1 38 38 LEU C C 164 179.380 179.380 179.274 0.106 18090 7966 1 21 . 1 1 38 38 LEU CA C 164 57.340 57.340 57.728 -0.388 18090 7967 1 21 . 1 1 38 38 LEU CB C 164 41.660 41.660 41.699 -0.039 18090 7968 1 21 . 1 1 38 38 LEU H H 164 7.660 7.660 8.143 -0.483 18090 7969 1 21 . 1 1 39 39 ILE N N 165 118.070 118.070 118.339 -0.269 18090 7970 1 21 . 1 1 39 39 ILE HA H 165 3.510 3.510 3.653 -0.143 18090 7971 1 21 . 1 1 39 39 ILE C C 165 179.570 179.570 178.205 1.365 18090 7972 1 21 . 1 1 39 39 ILE CA C 165 64.450 64.450 65.514 -1.064 18090 7973 1 21 . 1 1 39 39 ILE CB C 165 37.310 37.310 37.468 -0.157 18090 7974 1 21 . 1 1 39 39 ILE H H 165 8.030 8.030 7.978 0.052 18090 7975 1 21 . 1 1 40 40 GLY N N 166 107.970 107.970 108.022 -0.052 18090 7976 1 21 . 1 1 40 40 GLY C C 166 176.470 176.470 175.725 0.745 18090 7977 1 21 . 1 1 40 40 GLY CA C 166 46.410 46.410 46.968 -0.557 18090 7978 1 21 . 1 1 40 40 GLY H H 166 7.590 7.590 7.629 -0.039 18090 7979 1 21 . 1 1 41 41 TYR N N 167 121.270 121.270 122.357 -1.087 18090 7980 1 21 . 1 1 41 41 TYR HA H 167 4.190 4.190 4.212 -0.022 18090 7981 1 21 . 1 1 41 41 TYR C C 167 176.470 176.470 176.244 0.226 18090 7982 1 21 . 1 1 41 41 TYR CA C 167 57.130 57.130 60.466 -3.336 18090 7983 1 21 . 1 1 41 41 TYR CB C 167 35.950 35.950 38.243 -2.293 18090 7984 1 21 . 1 1 41 41 TYR H H 167 7.350 7.350 7.919 -0.569 18090 7985 1 21 . 1 1 42 42 LYS N N 168 116.520 116.520 116.093 0.427 18090 7986 1 21 . 1 1 42 42 LYS HA H 168 3.820 3.820 4.052 -0.232 18090 7987 1 21 . 1 1 42 42 LYS C C 168 177.810 177.810 177.905 -0.095 18090 7988 1 21 . 1 1 42 42 LYS CA C 168 59.390 59.390 58.405 0.985 18090 7989 1 21 . 1 1 42 42 LYS CB C 168 31.580 31.580 32.752 -1.172 18090 7990 1 21 . 1 1 42 42 LYS H H 168 7.460 7.460 8.274 -0.814 18090 7991 1 21 . 1 1 43 43 GLN N N 169 113.750 113.750 116.117 -2.367 18090 7992 1 21 . 1 1 43 43 GLN HA H 169 4.220 4.220 4.168 0.052 18090 7993 1 21 . 1 1 43 43 GLN C C 169 175.840 175.840 177.392 -1.552 18090 7994 1 21 . 1 1 43 43 GLN CA C 169 56.230 56.230 58.170 -1.940 18090 7995 1 21 . 1 1 43 43 GLN CB C 169 29.290 29.290 29.347 -0.057 18090 7996 1 21 . 1 1 43 43 GLN H H 169 7.220 7.220 7.615 -0.395 18090 7997 1 21 . 1 1 44 44 ASN N N 170 114.130 114.130 115.997 -1.867 18090 7998 1 21 . 1 1 44 44 ASN HA H 170 5.050 5.050 4.939 0.111 18090 7999 1 21 . 1 1 44 44 ASN C C 170 172.200 172.200 173.558 -1.358 18090 8000 1 21 . 1 1 44 44 ASN CA C 170 50.780 50.780 53.909 -3.129 18090 8001 1 21 . 1 1 44 44 ASN CB C 170 38.380 38.380 39.731 -1.351 18090 8002 1 21 . 1 1 44 44 ASN H H 170 7.580 7.580 7.639 -0.059 18090 8003 1 21 . 1 1 45 45 PRO HA H 171 4.130 4.130 4.653 -0.523 18090 8004 1 21 . 1 1 45 45 PRO CA C 171 64.800 64.800 62.089 2.711 18090 8005 1 21 . 1 1 45 45 PRO CB C 171 31.360 31.360 31.932 -0.572 18090 8006 1 21 . 1 1 46 46 GLN N N 172 115.570 115.570 124.913 -9.343 18090 8007 1 21 . 1 1 46 46 GLN HA H 172 3.770 3.770 3.829 -0.059 18090 8008 1 21 . 1 1 46 46 GLN C C 172 177.360 177.360 177.620 -0.260 18090 8009 1 21 . 1 1 46 46 GLN CA C 172 57.950 57.950 58.235 -0.285 18090 8010 1 21 . 1 1 46 46 GLN CB C 172 27.050 27.050 27.645 -0.595 18090 8011 1 21 . 1 1 46 46 GLN H H 172 8.160 8.160 8.576 -0.416 18090 8012 1 21 . 1 1 47 47 ALA N N 173 121.420 121.420 121.920 -0.500 18090 8013 1 21 . 1 1 47 47 ALA HA H 173 4.050 4.050 4.156 -0.106 18090 8014 1 21 . 1 1 47 47 ALA C C 173 178.090 178.090 179.538 -1.448 18090 8015 1 21 . 1 1 47 47 ALA CA C 173 53.490 53.490 53.970 -0.480 18090 8016 1 21 . 1 1 47 47 ALA CB C 173 18.450 18.450 17.645 0.805 18090 8017 1 21 . 1 1 47 47 ALA H H 173 7.470 7.470 8.098 -0.628 18090 8018 1 21 . 1 1 48 48 ILE N N 174 118.050 118.050 118.689 -0.639 18090 8019 1 21 . 1 1 48 48 ILE HA H 174 3.180 3.180 3.874 -0.694 18090 8020 1 21 . 1 1 48 48 ILE C C 174 176.250 176.250 177.886 -1.636 18090 8021 1 21 . 1 1 48 48 ILE CA C 174 64.030 64.030 64.081 -0.051 18090 8022 1 21 . 1 1 48 48 ILE CB C 174 37.280 37.280 37.072 0.208 18090 8023 1 21 . 1 1 48 48 ILE H H 174 7.150 7.150 7.343 -0.193 18090 8024 1 21 . 1 1 49 49 GLY N N 175 105.390 105.390 106.802 -1.412 18090 8025 1 21 . 1 1 49 49 GLY C C 175 174.220 174.220 176.312 -2.092 18090 8026 1 21 . 1 1 49 49 GLY CA C 175 46.700 46.700 47.122 -0.422 18090 8027 1 21 . 1 1 49 49 GLY H H 175 7.550 7.550 7.827 -0.277 18090 8028 1 21 . 1 1 50 50 GLN N N 176 116.230 116.230 118.509 -2.279 18090 8029 1 21 . 1 1 50 50 GLN HA H 176 4.210 4.210 4.636 -0.426 18090 8030 1 21 . 1 1 50 50 GLN C C 176 178.120 178.120 178.278 -0.158 18090 8031 1 21 . 1 1 50 50 GLN CA C 176 57.320 57.320 57.993 -0.673 18090 8032 1 21 . 1 1 50 50 GLN CB C 176 28.630 28.630 28.819 -0.189 18090 8033 1 21 . 1 1 50 50 GLN H H 176 7.390 7.390 8.025 -0.635 18090 8034 1 21 . 1 1 51 51 ASP N N 177 120.000 120.000 121.208 -1.208 18090 8035 1 21 . 1 1 51 51 ASP HA H 177 4.420 4.420 4.661 -0.241 18090 8036 1 21 . 1 1 51 51 ASP C C 177 177.950 177.950 178.475 -0.525 18090 8037 1 21 . 1 1 51 51 ASP CA C 177 55.840 55.840 56.032 -0.192 18090 8038 1 21 . 1 1 51 51 ASP CB C 177 40.310 40.310 40.901 -0.591 18090 8039 1 21 . 1 1 51 51 ASP H H 177 7.870 7.870 7.939 -0.069 18090 8040 1 21 . 1 1 52 52 LEU N N 178 120.010 120.010 120.508 -0.498 18090 8041 1 21 . 1 1 52 52 LEU HA H 178 3.650 3.650 3.986 -0.336 18090 8042 1 21 . 1 1 52 52 LEU C C 178 175.810 175.810 178.280 -2.470 18090 8043 1 21 . 1 1 52 52 LEU CA C 178 57.620 57.620 57.862 -0.242 18090 8044 1 21 . 1 1 52 52 LEU CB C 178 41.880 41.880 41.719 0.161 18090 8045 1 21 . 1 1 52 52 LEU H H 178 7.860 7.860 7.678 0.182 18090 8046 1 21 . 1 1 53 53 PHE N N 179 110.580 110.580 113.831 -3.251 18090 8047 1 21 . 1 1 53 53 PHE HA H 179 4.230 4.230 4.330 -0.100 18090 8048 1 21 . 1 1 53 53 PHE C C 179 176.370 176.370 178.054 -1.684 18090 8049 1 21 . 1 1 53 53 PHE CA C 179 58.730 58.730 60.467 -1.736 18090 8050 1 21 . 1 1 53 53 PHE CB C 179 38.720 38.720 38.834 -0.114 18090 8051 1 21 . 1 1 53 53 PHE H H 179 7.210 7.210 8.027 -0.817 18090 8052 1 21 . 1 1 54 54 THR N N 180 108.190 108.190 108.053 0.137 18090 8053 1 21 . 1 1 54 54 THR HA H 180 4.300 4.300 4.329 -0.029 18090 8054 1 21 . 1 1 54 54 THR C C 180 174.400 174.400 174.665 -0.265 18090 8055 1 21 . 1 1 54 54 THR CA C 180 62.020 62.020 63.114 -1.094 18090 8056 1 21 . 1 1 54 54 THR CB C 180 69.730 69.730 69.657 0.073 18090 8057 1 21 . 1 1 54 54 THR H H 180 7.550 7.550 7.461 0.089 18090 8058 1 21 . 1 1 55 55 ASP N N 181 120.060 120.060 122.681 -2.621 18090 8059 1 21 . 1 1 55 55 ASP HA H 181 5.020 5.020 5.061 -0.041 18090 8060 1 21 . 1 1 55 55 ASP C C 181 174.120 174.120 175.339 -1.219 18090 8061 1 21 . 1 1 55 55 ASP CA C 181 50.560 50.560 50.618 -0.058 18090 8062 1 21 . 1 1 55 55 ASP CB C 181 41.190 41.190 43.246 -2.056 18090 8063 1 21 . 1 1 55 55 ASP H H 181 7.480 7.480 7.949 -0.469 18090 8064 1 21 . 1 1 56 56 PRO HA H 182 4.320 4.320 4.323 -0.003 18090 8065 1 21 . 1 1 56 56 PRO CA C 182 64.280 64.280 64.904 -0.624 18090 8066 1 21 . 1 1 56 56 PRO CB C 182 31.980 31.980 32.607 -0.627 18090 8067 1 21 . 1 1 57 57 ARG N N 183 117.660 117.660 118.365 -0.705 18090 8068 1 21 . 1 1 57 57 ARG HA H 183 3.960 3.960 4.101 -0.141 18090 8069 1 21 . 1 1 57 57 ARG C C 183 179.030 179.030 178.667 0.363 18090 8070 1 21 . 1 1 57 57 ARG CA C 183 59.000 59.000 58.778 0.222 18090 8071 1 21 . 1 1 57 57 ARG CB C 183 29.750 29.750 29.327 0.423 18090 8072 1 21 . 1 1 57 57 ARG H H 183 7.920 7.920 8.123 -0.203 18090 8073 1 21 . 1 1 58 58 LEU N N 184 115.670 115.670 119.528 -3.858 18090 8074 1 21 . 1 1 58 58 LEU HA H 184 3.850 3.850 3.960 -0.110 18090 8075 1 21 . 1 1 58 58 LEU C C 184 178.770 178.770 179.108 -0.338 18090 8076 1 21 . 1 1 58 58 LEU CA C 184 57.110 57.110 57.769 -0.659 18090 8077 1 21 . 1 1 58 58 LEU CB C 184 41.310 41.310 41.603 -0.293 18090 8078 1 21 . 1 1 58 58 LEU H H 184 7.750 7.750 8.173 -0.423 18090 8079 1 21 . 1 1 59 59 MET N N 185 118.570 118.570 116.365 2.205 18090 8080 1 21 . 1 1 59 59 MET HA H 185 4.060 4.060 4.139 -0.079 18090 8081 1 21 . 1 1 59 59 MET C C 185 177.540 177.540 178.148 -0.608 18090 8082 1 21 . 1 1 59 59 MET CA C 185 58.090 58.090 59.348 -1.258 18090 8083 1 21 . 1 1 59 59 MET CB C 185 31.270 31.270 32.192 -0.922 18090 8084 1 21 . 1 1 59 59 MET H H 185 7.590 7.590 7.674 -0.084 18090 8085 1 21 . 1 1 60 60 THR N N 186 116.390 116.390 117.448 -1.058 18090 8086 1 21 . 1 1 60 60 THR HA H 186 3.680 3.680 3.996 -0.316 18090 8087 1 21 . 1 1 60 60 THR C C 186 177.440 177.440 176.380 1.060 18090 8088 1 21 . 1 1 60 60 THR CA C 186 66.940 66.940 67.292 -0.352 18090 8089 1 21 . 1 1 60 60 THR CB C 186 68.030 68.030 68.242 -0.212 18090 8090 1 21 . 1 1 60 60 THR H H 186 7.180 7.180 7.754 -0.574 18090 8091 1 21 . 1 1 61 61 ILE N N 187 123.840 123.840 122.028 1.812 18090 8092 1 21 . 1 1 61 61 ILE HA H 187 3.290 3.290 3.756 -0.466 18090 8093 1 21 . 1 1 61 61 ILE C C 187 176.660 176.660 178.073 -1.413 18090 8094 1 21 . 1 1 61 61 ILE CA C 187 65.850 65.850 65.479 0.371 18090 8095 1 21 . 1 1 61 61 ILE CB C 187 37.640 37.640 37.825 -0.185 18090 8096 1 21 . 1 1 61 61 ILE H H 187 8.010 8.010 7.845 0.165 18090 8097 1 21 . 1 1 62 62 MET N N 188 118.210 118.210 118.365 -0.155 18090 8098 1 21 . 1 1 62 62 MET HA H 188 3.910 3.910 4.009 -0.099 18090 8099 1 21 . 1 1 62 62 MET C C 188 177.540 177.540 178.420 -0.880 18090 8100 1 21 . 1 1 62 62 MET CA C 188 58.530 58.530 58.911 -0.381 18090 8101 1 21 . 1 1 62 62 MET CB C 188 31.200 31.200 31.569 -0.369 18090 8102 1 21 . 1 1 62 62 MET H H 188 8.560 8.560 7.414 1.146 18090 8103 1 21 . 1 1 63 63 ALA N N 189 119.850 119.850 122.095 -2.245 18090 8104 1 21 . 1 1 63 63 ALA HA H 189 3.730 3.730 3.908 -0.178 18090 8105 1 21 . 1 1 63 63 ALA C C 189 179.550 179.550 179.433 0.117 18090 8106 1 21 . 1 1 63 63 ALA CA C 189 55.470 55.470 55.736 -0.266 18090 8107 1 21 . 1 1 63 63 ALA CB C 189 17.640 17.640 18.153 -0.513 18090 8108 1 21 . 1 1 63 63 ALA H H 189 8.210 8.210 8.189 0.021 18090 8109 1 21 . 1 1 64 64 THR N N 190 114.570 114.570 113.754 0.816 18090 8110 1 21 . 1 1 64 64 THR HA H 190 3.790 3.790 4.025 -0.235 18090 8111 1 21 . 1 1 64 64 THR C C 190 177.640 177.640 176.688 0.952 18090 8112 1 21 . 1 1 64 64 THR CA C 190 66.690 66.690 65.543 1.147 18090 8113 1 21 . 1 1 64 64 THR CB C 190 68.310 68.310 68.168 0.142 18090 8114 1 21 . 1 1 64 64 THR H H 190 7.740 7.740 7.677 0.063 18090 8115 1 21 . 1 1 65 65 LEU N N 191 122.410 122.410 122.439 -0.029 18090 8116 1 21 . 1 1 65 65 LEU HA H 191 3.930 3.930 3.949 -0.019 18090 8117 1 21 . 1 1 65 65 LEU C C 191 178.470 178.470 179.802 -1.332 18090 8118 1 21 . 1 1 65 65 LEU CA C 191 57.120 57.120 58.090 -0.970 18090 8119 1 21 . 1 1 65 65 LEU CB C 191 41.830 41.830 41.705 0.125 18090 8120 1 21 . 1 1 65 65 LEU H H 191 8.180 8.180 7.578 0.602 18090 8121 1 21 . 1 1 66 66 MET N N 192 115.320 115.320 117.253 -1.933 18090 8122 1 21 . 1 1 66 66 MET HA H 192 4.090 4.090 4.301 -0.211 18090 8123 1 21 . 1 1 66 66 MET C C 192 176.090 176.090 178.312 -2.222 18090 8124 1 21 . 1 1 66 66 MET CA C 192 56.390 56.390 57.464 -1.074 18090 8125 1 21 . 1 1 66 66 MET CB C 192 33.770 33.770 31.899 1.871 18090 8126 1 21 . 1 1 66 66 MET H H 192 7.880 7.880 8.530 -0.650 18090 8127 1 21 . 1 1 67 67 GLY N N 193 107.490 107.490 105.365 2.125 18090 8128 1 21 . 1 1 67 67 GLY C C 193 174.390 174.390 174.705 -0.315 18090 8129 1 21 . 1 1 67 67 GLY CA C 193 45.880 45.880 45.072 0.808 18090 8130 1 21 . 1 1 67 67 GLY H H 193 7.580 7.580 8.224 -0.644 18090 8131 1 21 . 1 1 68 68 VAL N N 194 118.520 118.520 116.929 1.591 18090 8132 1 21 . 1 1 68 68 VAL HA H 194 3.940 3.940 3.688 0.252 18090 8133 1 21 . 1 1 68 68 VAL C C 194 174.760 174.760 175.255 -0.495 18090 8134 1 21 . 1 1 68 68 VAL CA C 194 61.510 61.510 63.123 -1.613 18090 8135 1 21 . 1 1 68 68 VAL CB C 194 32.670 32.670 30.549 2.120 18090 8136 1 21 . 1 1 68 68 VAL H H 194 7.840 7.840 7.437 0.403 18090 8137 1 21 . 1 1 69 69 ASP N N 195 124.550 124.550 117.716 6.834 18090 8138 1 21 . 1 1 69 69 ASP HA H 195 4.430 4.430 4.333 0.097 18090 8139 1 21 . 1 1 69 69 ASP C C 195 175.140 175.140 175.208 -0.068 18090 8140 1 21 . 1 1 69 69 ASP CA C 195 53.760 53.760 55.712 -1.952 18090 8141 1 21 . 1 1 69 69 ASP CB C 195 40.920 40.920 39.935 0.985 18090 8142 1 21 . 1 1 69 69 ASP H H 195 8.400 8.400 8.306 0.094 18090 8143 1 21 . 1 1 70 70 LEU N N 196 123.930 123.930 117.688 6.242 18090 8144 1 21 . 1 1 70 70 LEU HA H 196 4.200 4.200 4.575 -0.375 18090 8145 1 21 . 1 1 70 70 LEU C C 196 175.950 175.950 174.513 1.437 18090 8146 1 21 . 1 1 70 70 LEU CA C 196 54.380 54.380 54.176 0.204 18090 8147 1 21 . 1 1 70 70 LEU CB C 196 41.610 41.610 45.068 -3.458 18090 8148 1 21 . 1 1 70 70 LEU H H 196 8.160 8.160 7.419 0.741 18090 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 63 2.829 0.458 2.814 18090 2 1 1 "Average Difference" HA 73 0.268 0.154 0.220 18090 3 1 1 "Average Difference" C 63 1.197 0.324 1.161 18090 4 1 1 "Average Difference" CA 69 1.539 0.423 1.491 18090 5 1 1 "Average Difference" CB 65 1.022 0.307 0.982 18090 6 1 1 "Average Difference" HN 63 0.516 0.180 0.487 18090 7 1 2 "Average Difference" N 63 2.758 0.349 2.758 18090 8 1 2 "Average Difference" HA 73 0.264 0.158 0.213 18090 9 1 2 "Average Difference" C 63 1.166 0.320 1.131 18090 10 1 2 "Average Difference" CA 69 1.517 0.402 1.474 18090 11 1 2 "Average Difference" CB 65 1.113 0.401 1.047 18090 12 1 2 "Average Difference" HN 63 0.516 0.186 0.485 18090 13 1 3 "Average Difference" N 63 2.648 0.386 2.640 18090 14 1 3 "Average Difference" HA 73 0.257 0.153 0.209 18090 15 1 3 "Average Difference" C 63 1.163 0.362 1.114 18090 16 1 3 "Average Difference" CA 69 1.521 0.410 1.476 18090 17 1 3 "Average Difference" CB 65 1.052 0.335 1.005 18090 18 1 3 "Average Difference" HN 63 0.522 0.180 0.494 18090 19 1 4 "Average Difference" N 63 2.649 0.457 2.630 18090 20 1 4 "Average Difference" HA 73 0.268 0.157 0.219 18090 21 1 4 "Average Difference" C 63 1.250 0.380 1.201 18090 22 1 4 "Average Difference" CA 69 1.550 0.444 1.496 18090 23 1 4 "Average Difference" CB 65 1.180 0.345 1.137 18090 24 1 4 "Average Difference" HN 63 0.507 0.190 0.474 18090 25 1 5 "Average Difference" N 63 2.776 0.339 2.777 18090 26 1 5 "Average Difference" HA 73 0.270 0.165 0.216 18090 27 1 5 "Average Difference" C 63 1.222 0.317 1.189 18090 28 1 5 "Average Difference" CA 69 1.518 0.418 1.470 18090 29 1 5 "Average Difference" CB 65 1.100 0.374 1.043 18090 30 1 5 "Average Difference" HN 63 0.533 0.179 0.506 18090 31 1 6 "Average Difference" N 63 2.769 0.474 2.750 18090 32 1 6 "Average Difference" HA 73 0.270 0.166 0.214 18090 33 1 6 "Average Difference" C 63 1.162 0.306 1.130 18090 34 1 6 "Average Difference" CA 69 1.526 0.420 1.477 18090 35 1 6 "Average Difference" CB 65 1.063 0.395 0.995 18090 36 1 6 "Average Difference" HN 63 0.505 0.198 0.468 18090 37 1 7 "Average Difference" N 63 2.831 0.276 2.841 18090 38 1 7 "Average Difference" HA 73 0.260 0.143 0.218 18090 39 1 7 "Average Difference" C 63 1.160 0.354 1.113 18090 40 1 7 "Average Difference" CA 69 1.522 0.456 1.463 18090 41 1 7 "Average Difference" CB 65 1.052 0.325 1.008 18090 42 1 7 "Average Difference" HN 63 0.525 0.188 0.495 18090 43 1 8 "Average Difference" N 63 2.609 0.469 2.587 18090 44 1 8 "Average Difference" HA 73 0.257 0.154 0.208 18090 45 1 8 "Average Difference" C 63 1.176 0.327 1.139 18090 46 1 8 "Average Difference" CA 69 1.497 0.410 1.450 18090 47 1 8 "Average Difference" CB 65 1.103 0.374 1.045 18090 48 1 8 "Average Difference" HN 63 0.520 0.190 0.488 18090 49 1 9 "Average Difference" N 63 2.748 0.556 2.713 18090 50 1 9 "Average Difference" HA 73 0.262 0.163 0.207 18090 51 1 9 "Average Difference" C 63 1.165 0.307 1.133 18090 52 1 9 "Average Difference" CA 69 1.468 0.407 1.421 18090 53 1 9 "Average Difference" CB 65 1.188 0.372 1.137 18090 54 1 9 "Average Difference" HN 63 0.521 0.196 0.487 18090 55 1 10 "Average Difference" N 63 2.942 0.476 2.926 18090 56 1 10 "Average Difference" HA 73 0.265 0.137 0.228 18090 57 1 10 "Average Difference" C 63 1.191 0.307 1.160 18090 58 1 10 "Average Difference" CA 69 1.569 0.461 1.511 18090 59 1 10 "Average Difference" CB 65 1.027 0.291 0.992 18090 60 1 10 "Average Difference" HN 63 0.517 0.208 0.477 18090 61 1 11 "Average Difference" N 63 2.743 0.412 2.734 18090 62 1 11 "Average Difference" HA 73 0.255 0.149 0.208 18090 63 1 11 "Average Difference" C 63 1.168 0.326 1.131 18090 64 1 11 "Average Difference" CA 69 1.521 0.427 1.471 18090 65 1 11 "Average Difference" CB 65 1.088 0.362 1.034 18090 66 1 11 "Average Difference" HN 63 0.525 0.183 0.496 18090 67 1 12 "Average Difference" N 63 2.756 0.479 2.735 18090 68 1 12 "Average Difference" HA 73 0.268 0.166 0.212 18090 69 1 12 "Average Difference" C 63 1.211 0.330 1.175 18090 70 1 12 "Average Difference" CA 69 1.536 0.446 1.480 18090 71 1 12 "Average Difference" CB 65 1.109 0.390 1.046 18090 72 1 12 "Average Difference" HN 63 0.522 0.179 0.494 18090 73 1 13 "Average Difference" N 63 2.717 0.436 2.703 18090 74 1 13 "Average Difference" HA 73 0.265 0.158 0.214 18090 75 1 13 "Average Difference" C 63 1.187 0.371 1.137 18090 76 1 13 "Average Difference" CA 69 1.528 0.485 1.460 18090 77 1 13 "Average Difference" CB 65 1.117 0.271 1.092 18090 78 1 13 "Average Difference" HN 63 0.517 0.178 0.490 18090 79 1 14 "Average Difference" N 63 2.970 0.278 2.981 18090 80 1 14 "Average Difference" HA 73 0.257 0.145 0.213 18090 81 1 14 "Average Difference" C 63 1.187 0.363 1.139 18090 82 1 14 "Average Difference" CA 69 1.511 0.450 1.453 18090 83 1 14 "Average Difference" CB 65 0.982 0.353 0.924 18090 84 1 14 "Average Difference" HN 63 0.528 0.179 0.500 18090 85 1 15 "Average Difference" N 63 2.584 0.368 2.579 18090 86 1 15 "Average Difference" HA 73 0.258 0.156 0.207 18090 87 1 15 "Average Difference" C 63 1.206 0.358 1.161 18090 88 1 15 "Average Difference" CA 69 1.542 0.418 1.495 18090 89 1 15 "Average Difference" CB 65 1.075 0.370 1.018 18090 90 1 15 "Average Difference" HN 63 0.531 0.177 0.504 18090 91 1 16 "Average Difference" N 63 2.738 0.455 2.721 18090 92 1 16 "Average Difference" HA 73 0.275 0.169 0.219 18090 93 1 16 "Average Difference" C 63 1.205 0.310 1.174 18090 94 1 16 "Average Difference" CA 69 1.510 0.386 1.471 18090 95 1 16 "Average Difference" CB 65 1.178 0.407 1.114 18090 96 1 16 "Average Difference" HN 63 0.516 0.193 0.482 18090 97 1 17 "Average Difference" N 63 2.895 0.521 2.870 18090 98 1 17 "Average Difference" HA 73 0.265 0.151 0.219 18090 99 1 17 "Average Difference" C 63 1.218 0.313 1.187 18090 100 1 17 "Average Difference" CA 69 1.504 0.415 1.456 18090 101 1 17 "Average Difference" CB 65 1.108 0.369 1.053 18090 102 1 17 "Average Difference" HN 63 0.520 0.193 0.486 18090 103 1 18 "Average Difference" N 63 2.683 0.373 2.678 18090 104 1 18 "Average Difference" HA 73 0.273 0.157 0.226 18090 105 1 18 "Average Difference" C 63 1.178 0.317 1.143 18090 106 1 18 "Average Difference" CA 69 1.513 0.396 1.471 18090 107 1 18 "Average Difference" CB 65 1.032 0.321 0.989 18090 108 1 18 "Average Difference" HN 63 0.516 0.192 0.483 18090 109 1 19 "Average Difference" N 63 2.644 0.589 2.598 18090 110 1 19 "Average Difference" HA 73 0.277 0.168 0.222 18090 111 1 19 "Average Difference" C 63 1.153 0.289 1.125 18090 112 1 19 "Average Difference" CA 69 1.486 0.429 1.433 18090 113 1 19 "Average Difference" CB 65 1.067 0.369 1.009 18090 114 1 19 "Average Difference" HN 63 0.529 0.218 0.486 18090 115 1 20 "Average Difference" N 63 2.606 0.501 2.578 18090 116 1 20 "Average Difference" HA 73 0.266 0.159 0.214 18090 117 1 20 "Average Difference" C 63 1.176 0.313 1.143 18090 118 1 20 "Average Difference" CA 69 1.529 0.408 1.485 18090 119 1 20 "Average Difference" CB 65 1.238 0.458 1.159 18090 120 1 20 "Average Difference" HN 63 0.512 0.197 0.476 18090 121 1 21 "Average Difference" N 63 2.849 0.329 2.852 18090 122 1 21 "Average Difference" HA 73 0.263 0.159 0.211 18090 123 1 21 "Average Difference" C 63 1.166 0.273 1.143 18090 124 1 21 "Average Difference" CA 69 1.533 0.413 1.487 18090 125 1 21 "Average Difference" CB 65 1.149 0.412 1.081 18090 126 1 21 "Average Difference" HN 63 0.529 0.194 0.496 18090 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 18090 _Entity_delta_chem_shifts.ID 2 _Entity_delta_chem_shifts.Details ; This saveframe contains the averaged SPARTA chemical shift over all the models used. ; loop_ _Delta_CS.Atom_chem_shift_ID _Delta_CS.Entity_delta_chem_shifts_ID _Delta_CS.Assembly_atom_ID _Delta_CS.Entity_assembly_ID _Delta_CS.Entity_ID _Delta_CS.Comp_index_ID _Delta_CS.Seq_ID _Delta_CS.Comp_ID _Delta_CS.Atom_ID _Delta_CS.Atom_type _Delta_CS.Auth_seq_ID _Delta_CS.Original_CS_value _Delta_CS.Corrected_CS_value _Delta_CS.Sparta_CS_value _Delta_CS.Delta_CS_value _Delta_CS.Entry_ID 1 1 . 1 1 2 2 PRO HA H 128 4.220 4.220 4.467 -0.247 18090 2 1 . 1 1 2 2 PRO CA C 128 63.320 63.320 63.477 -0.157 18090 3 1 . 1 1 2 2 PRO CB C 128 31.680 31.680 32.113 -0.433 18090 4 1 . 1 1 3 3 ASP N N 129 119.320 119.320 119.172 0.148 18090 5 1 . 1 1 3 3 ASP HA H 129 4.400 4.400 4.530 -0.130 18090 6 1 . 1 1 3 3 ASP C C 129 176.120 176.120 175.166 0.954 18090 7 1 . 1 1 3 3 ASP CA C 129 54.050 54.050 54.407 -0.357 18090 8 1 . 1 1 3 3 ASP CB C 129 40.770 40.770 41.051 -0.281 18090 9 1 . 1 1 3 3 ASP H H 129 8.310 8.310 8.371 -0.061 18090 10 1 . 1 1 4 4 LEU N N 130 122.280 122.280 119.647 2.633 18090 11 1 . 1 1 4 4 LEU HA H 130 4.130 4.130 4.316 -0.186 18090 12 1 . 1 1 4 4 LEU C C 130 177.280 177.280 176.801 0.479 18090 13 1 . 1 1 4 4 LEU CA C 130 55.350 55.350 54.627 0.723 18090 14 1 . 1 1 4 4 LEU CB C 130 41.490 41.490 43.763 -2.273 18090 15 1 . 1 1 4 4 LEU H H 130 8.080 8.080 7.957 0.123 18090 16 1 . 1 1 5 5 GLY N N 131 107.830 107.830 108.190 -0.360 18090 17 1 . 1 1 5 5 GLY C C 131 175.120 175.120 173.282 1.838 18090 18 1 . 1 1 5 5 GLY CA C 131 45.300 45.300 45.320 -0.020 18090 19 1 . 1 1 5 5 GLY H H 131 8.180 8.180 8.342 -0.162 18090 20 1 . 1 1 6 6 LEU N N 132 121.080 121.080 117.704 3.376 18090 21 1 . 1 1 6 6 LEU HA H 132 3.870 3.870 4.432 -0.562 18090 22 1 . 1 1 6 6 LEU C C 132 178.000 178.000 177.713 0.287 18090 23 1 . 1 1 6 6 LEU CA C 132 57.180 57.180 53.836 3.344 18090 24 1 . 1 1 6 6 LEU CB C 132 41.870 41.870 44.308 -2.438 18090 25 1 . 1 1 6 6 LEU H H 132 8.150 8.150 7.512 0.638 18090 26 1 . 1 1 7 7 THR N N 133 111.580 111.580 113.398 -1.818 18090 27 1 . 1 1 7 7 THR HA H 133 3.730 3.730 3.995 -0.265 18090 28 1 . 1 1 7 7 THR C C 133 176.530 176.530 176.129 0.401 18090 29 1 . 1 1 7 7 THR CA C 133 65.940 65.940 66.135 -0.195 18090 30 1 . 1 1 7 7 THR CB C 133 68.130 68.130 68.632 -0.502 18090 31 1 . 1 1 7 7 THR H H 133 7.970 7.970 8.652 -0.682 18090 32 1 . 1 1 8 8 GLN N N 134 119.490 119.490 121.082 -1.592 18090 33 1 . 1 1 8 8 GLN HA H 134 3.990 3.990 3.922 0.068 18090 34 1 . 1 1 8 8 GLN C C 134 178.190 178.190 178.289 -0.099 18090 35 1 . 1 1 8 8 GLN CA C 134 57.930 57.930 58.744 -0.814 18090 36 1 . 1 1 8 8 GLN CB C 134 27.850 27.850 27.964 -0.114 18090 37 1 . 1 1 8 8 GLN H H 134 7.890 7.890 8.386 -0.496 18090 38 1 . 1 1 9 9 LEU N N 135 120.170 120.170 118.542 1.628 18090 39 1 . 1 1 9 9 LEU HA H 135 3.820 3.820 3.933 -0.113 18090 40 1 . 1 1 9 9 LEU C C 135 177.810 177.810 178.618 -0.808 18090 41 1 . 1 1 9 9 LEU CA C 135 57.470 57.470 57.245 0.225 18090 42 1 . 1 1 9 9 LEU CB C 135 41.640 41.640 41.821 -0.181 18090 43 1 . 1 1 9 9 LEU H H 135 7.600 7.600 7.284 0.316 18090 44 1 . 1 1 10 10 PHE N N 136 111.950 111.950 113.451 -1.501 18090 45 1 . 1 1 10 10 PHE HA H 136 4.380 4.380 4.446 -0.066 18090 46 1 . 1 1 10 10 PHE C C 136 174.990 174.990 177.287 -2.297 18090 47 1 . 1 1 10 10 PHE CA C 136 58.450 58.450 57.571 0.879 18090 48 1 . 1 1 10 10 PHE CB C 136 38.570 38.570 37.706 0.864 18090 49 1 . 1 1 10 10 PHE H H 136 7.410 7.410 6.628 0.782 18090 50 1 . 1 1 11 11 ALA N N 137 120.230 120.230 122.270 -2.040 18090 51 1 . 1 1 11 11 ALA HA H 137 4.130 4.130 4.125 0.005 18090 52 1 . 1 1 11 11 ALA C C 137 177.090 177.090 178.163 -1.073 18090 53 1 . 1 1 11 11 ALA CA C 137 52.580 52.580 53.535 -0.954 18090 54 1 . 1 1 11 11 ALA CB C 137 18.660 18.660 18.763 -0.103 18090 55 1 . 1 1 11 11 ALA H H 137 7.330 7.330 8.518 -1.188 18090 56 1 . 1 1 12 12 ASP N N 138 119.830 119.830 120.701 -0.871 18090 57 1 . 1 1 12 12 ASP HA H 138 4.510 4.510 4.690 -0.180 18090 58 1 . 1 1 12 12 ASP C C 138 176.370 176.370 174.822 1.548 18090 59 1 . 1 1 12 12 ASP CA C 138 51.960 51.960 52.886 -0.926 18090 60 1 . 1 1 12 12 ASP CB C 138 41.990 41.990 41.568 0.422 18090 61 1 . 1 1 12 12 ASP H H 138 6.980 6.980 7.636 -0.656 18090 62 1 . 1 1 13 13 PRO HA H 139 4.260 4.260 4.392 -0.132 18090 63 1 . 1 1 13 13 PRO CA C 139 64.350 64.350 62.990 1.360 18090 64 1 . 1 1 13 13 PRO CB C 139 31.760 31.760 32.297 -0.537 18090 65 1 . 1 1 14 14 ASN N N 140 116.840 116.840 117.856 -1.016 18090 66 1 . 1 1 14 14 ASN HA H 140 4.840 4.840 4.472 0.368 18090 67 1 . 1 1 14 14 ASN C C 140 173.840 173.840 175.443 -1.603 18090 68 1 . 1 1 14 14 ASN CA C 140 52.380 52.380 54.108 -1.728 18090 69 1 . 1 1 14 14 ASN CB C 140 38.330 38.330 36.928 1.402 18090 70 1 . 1 1 14 14 ASN H H 140 8.670 8.670 8.692 -0.022 18090 71 1 . 1 1 15 15 LEU N N 141 120.290 120.290 120.394 -0.104 18090 72 1 . 1 1 15 15 LEU HA H 141 3.790 3.790 4.545 -0.755 18090 73 1 . 1 1 15 15 LEU C C 141 177.120 177.120 177.509 -0.389 18090 74 1 . 1 1 15 15 LEU CA C 141 59.280 59.280 55.602 3.678 18090 75 1 . 1 1 15 15 LEU CB C 141 42.980 42.980 43.134 -0.154 18090 76 1 . 1 1 15 15 LEU H H 141 7.200 7.200 8.394 -1.194 18090 77 1 . 1 1 16 16 ILE N N 142 115.290 115.290 120.402 -5.112 18090 78 1 . 1 1 16 16 ILE HA H 142 3.480 3.480 3.697 -0.217 18090 79 1 . 1 1 16 16 ILE C C 142 177.990 177.990 177.477 0.513 18090 80 1 . 1 1 16 16 ILE CA C 142 62.690 62.690 65.334 -2.644 18090 81 1 . 1 1 16 16 ILE CB C 142 34.620 34.620 37.680 -3.060 18090 82 1 . 1 1 16 16 ILE H H 142 7.940 7.940 8.351 -0.411 18090 83 1 . 1 1 17 17 GLU N N 143 119.600 119.600 119.070 0.530 18090 84 1 . 1 1 17 17 GLU HA H 143 3.700 3.700 3.994 -0.294 18090 85 1 . 1 1 17 17 GLU C C 143 179.170 179.170 178.771 0.399 18090 86 1 . 1 1 17 17 GLU CA C 143 59.360 59.360 60.104 -0.744 18090 87 1 . 1 1 17 17 GLU CB C 143 28.520 28.520 29.201 -0.681 18090 88 1 . 1 1 17 17 GLU H H 143 7.970 7.970 8.560 -0.590 18090 89 1 . 1 1 18 18 ASN N N 144 117.170 117.170 117.888 -0.718 18090 90 1 . 1 1 18 18 ASN HA H 144 4.270 4.270 4.451 -0.181 18090 91 1 . 1 1 18 18 ASN C C 144 179.120 179.120 177.779 1.341 18090 92 1 . 1 1 18 18 ASN CA C 144 55.490 55.490 55.646 -0.156 18090 93 1 . 1 1 18 18 ASN CB C 144 36.550 36.550 37.806 -1.256 18090 94 1 . 1 1 18 18 ASN H H 144 8.450 8.450 8.348 0.102 18090 95 1 . 1 1 19 19 LEU N N 145 121.060 121.060 119.402 1.658 18090 96 1 . 1 1 19 19 LEU HA H 145 4.020 4.020 4.014 0.006 18090 97 1 . 1 1 19 19 LEU C C 145 180.260 180.260 178.291 1.969 18090 98 1 . 1 1 19 19 LEU CA C 145 56.620 56.620 57.180 -0.560 18090 99 1 . 1 1 19 19 LEU CB C 145 41.780 41.780 41.530 0.250 18090 100 1 . 1 1 19 19 LEU H H 145 7.990 7.990 7.565 0.425 18090 101 1 . 1 1 20 20 LYS N N 146 118.960 118.960 117.707 1.253 18090 102 1 . 1 1 20 20 LYS HA H 146 3.610 3.610 3.980 -0.370 18090 103 1 . 1 1 20 20 LYS C C 146 177.390 177.390 178.293 -0.903 18090 104 1 . 1 1 20 20 LYS CA C 146 59.640 59.640 59.235 0.405 18090 105 1 . 1 1 20 20 LYS CB C 146 32.450 32.450 32.340 0.110 18090 106 1 . 1 1 20 20 LYS H H 146 8.250 8.250 7.859 0.391 18090 107 1 . 1 1 21 21 LYS N N 147 114.720 114.720 116.640 -1.920 18090 108 1 . 1 1 21 21 LYS HA H 147 4.110 4.110 4.225 -0.115 18090 109 1 . 1 1 21 21 LYS C C 147 175.880 175.880 178.256 -2.376 18090 110 1 . 1 1 21 21 LYS CA C 147 56.210 56.210 58.234 -2.024 18090 111 1 . 1 1 21 21 LYS CB C 147 33.000 33.000 32.731 0.269 18090 112 1 . 1 1 21 21 LYS H H 147 7.130 7.130 7.641 -0.511 18090 113 1 . 1 1 22 22 ASN N N 148 122.180 122.180 115.501 6.679 18090 114 1 . 1 1 22 22 ASN HA H 148 4.740 4.740 4.918 -0.178 18090 115 1 . 1 1 22 22 ASN C C 148 174.000 174.000 173.489 0.511 18090 116 1 . 1 1 22 22 ASN CA C 148 50.970 50.970 52.732 -1.762 18090 117 1 . 1 1 22 22 ASN CB C 148 38.670 38.670 38.989 -0.319 18090 118 1 . 1 1 22 22 ASN H H 148 6.930 6.930 7.876 -0.946 18090 119 1 . 1 1 23 23 PRO HA H 149 4.300 4.300 4.723 -0.423 18090 120 1 . 1 1 23 23 PRO CA C 149 64.610 64.610 61.932 2.678 18090 121 1 . 1 1 23 23 PRO CB C 149 32.000 32.000 34.224 -2.224 18090 122 1 . 1 1 24 24 LYS N N 150 116.060 116.060 121.159 -5.099 18090 123 1 . 1 1 24 24 LYS HA H 150 4.070 4.070 3.960 0.110 18090 124 1 . 1 1 24 24 LYS C C 150 178.240 178.240 178.458 -0.218 18090 125 1 . 1 1 24 24 LYS CA C 150 57.950 57.950 59.695 -1.745 18090 126 1 . 1 1 24 24 LYS CB C 150 32.590 32.590 31.891 0.700 18090 127 1 . 1 1 24 24 LYS H H 150 8.520 8.520 8.820 -0.300 18090 128 1 . 1 1 25 25 THR N N 151 105.190 105.190 110.498 -5.308 18090 129 1 . 1 1 25 25 THR HA H 151 4.390 4.390 4.061 0.329 18090 130 1 . 1 1 25 25 THR C C 151 176.090 176.090 176.239 -0.149 18090 131 1 . 1 1 25 25 THR CA C 151 61.400 61.400 64.803 -3.403 18090 132 1 . 1 1 25 25 THR CB C 151 69.440 69.440 67.749 1.691 18090 133 1 . 1 1 25 25 THR H H 151 7.490 7.490 8.172 -0.682 18090 134 1 . 1 1 26 26 SER N N 152 119.700 119.700 116.633 3.067 18090 135 1 . 1 1 26 26 SER HA H 152 3.770 3.770 4.144 -0.374 18090 136 1 . 1 1 26 26 SER C C 152 177.470 177.470 176.028 1.442 18090 137 1 . 1 1 26 26 SER CA C 152 62.450 62.450 61.409 1.041 18090 138 1 . 1 1 26 26 SER CB C 152 62.520 62.520 62.678 -0.158 18090 139 1 . 1 1 26 26 SER H H 152 8.190 8.190 7.947 0.243 18090 140 1 . 1 1 27 27 GLU N N 153 119.870 119.870 122.741 -2.871 18090 141 1 . 1 1 27 27 GLU HA H 153 3.890 3.890 3.963 -0.073 18090 142 1 . 1 1 27 27 GLU C C 153 180.040 180.040 178.714 1.326 18090 143 1 . 1 1 27 27 GLU CA C 153 58.700 58.700 59.380 -0.680 18090 144 1 . 1 1 27 27 GLU CB C 153 28.590 28.590 29.446 -0.856 18090 145 1 . 1 1 27 27 GLU H H 153 8.350 8.350 7.845 0.505 18090 146 1 . 1 1 28 28 MET N N 154 119.430 119.430 117.038 2.392 18090 147 1 . 1 1 28 28 MET HA H 154 4.040 4.040 4.163 -0.123 18090 148 1 . 1 1 28 28 MET C C 154 177.110 177.110 178.121 -1.011 18090 149 1 . 1 1 28 28 MET CA C 154 58.510 58.510 58.671 -0.161 18090 150 1 . 1 1 28 28 MET CB C 154 31.430 31.430 32.736 -1.306 18090 151 1 . 1 1 28 28 MET H H 154 7.850 7.850 7.595 0.255 18090 152 1 . 1 1 29 29 MET N N 155 112.640 112.640 114.337 -1.697 18090 153 1 . 1 1 29 29 MET HA H 155 4.340 4.340 4.259 0.082 18090 154 1 . 1 1 29 29 MET C C 155 175.530 175.530 177.854 -2.324 18090 155 1 . 1 1 29 29 MET CA C 155 53.790 53.790 57.171 -3.381 18090 156 1 . 1 1 29 29 MET CB C 155 30.380 30.380 32.021 -1.641 18090 157 1 . 1 1 29 29 MET H H 155 7.200 7.200 7.367 -0.167 18090 158 1 . 1 1 30 30 LYS N N 156 117.050 117.050 116.848 0.202 18090 159 1 . 1 1 30 30 LYS HA H 156 3.960 3.960 4.266 -0.306 18090 160 1 . 1 1 30 30 LYS C C 156 176.120 176.120 177.118 -0.998 18090 161 1 . 1 1 30 30 LYS CA C 156 57.090 57.090 57.406 -0.316 18090 162 1 . 1 1 30 30 LYS CB C 156 31.960 31.960 32.973 -1.013 18090 163 1 . 1 1 30 30 LYS H H 156 7.130 7.130 7.655 -0.525 18090 164 1 . 1 1 31 31 ASP N N 157 119.810 119.810 118.414 1.396 18090 165 1 . 1 1 31 31 ASP HA H 157 4.860 4.860 4.948 -0.088 18090 166 1 . 1 1 31 31 ASP C C 157 174.890 174.890 174.460 0.430 18090 167 1 . 1 1 31 31 ASP CA C 157 50.520 50.520 54.393 -3.873 18090 168 1 . 1 1 31 31 ASP CB C 157 41.010 41.010 40.650 0.360 18090 169 1 . 1 1 31 31 ASP H H 157 7.340 7.340 7.752 -0.412 18090 170 1 . 1 1 32 32 PRO HA H 158 4.130 4.130 4.465 -0.335 18090 171 1 . 1 1 32 32 PRO CA C 158 64.270 64.270 62.910 1.360 18090 172 1 . 1 1 32 32 PRO CB C 158 31.770 31.770 32.395 -0.625 18090 173 1 . 1 1 33 33 GLN N N 159 117.760 117.760 120.381 -2.621 18090 174 1 . 1 1 33 33 GLN HA H 159 4.000 4.000 4.042 -0.042 18090 175 1 . 1 1 33 33 GLN C C 159 178.740 178.740 177.937 0.803 18090 176 1 . 1 1 33 33 GLN CA C 159 58.220 58.220 58.029 0.191 18090 177 1 . 1 1 33 33 GLN CB C 159 27.870 27.870 28.087 -0.217 18090 178 1 . 1 1 33 33 GLN H H 159 8.150 8.150 8.772 -0.622 18090 179 1 . 1 1 34 34 LEU N N 160 123.300 123.300 120.091 3.209 18090 180 1 . 1 1 34 34 LEU HA H 160 3.970 3.970 4.016 -0.046 18090 181 1 . 1 1 34 34 LEU C C 160 177.980 177.980 178.157 -0.177 18090 182 1 . 1 1 34 34 LEU CA C 160 57.050 57.050 57.281 -0.231 18090 183 1 . 1 1 34 34 LEU CB C 160 40.760 40.760 41.650 -0.890 18090 184 1 . 1 1 34 34 LEU H H 160 7.110 7.110 7.983 -0.873 18090 185 1 . 1 1 35 35 VAL N N 161 118.390 118.390 119.413 -1.023 18090 186 1 . 1 1 35 35 VAL HA H 161 3.110 3.110 3.519 -0.409 18090 187 1 . 1 1 35 35 VAL C C 161 176.840 176.840 177.765 -0.925 18090 188 1 . 1 1 35 35 VAL CA C 161 67.700 67.700 66.808 0.892 18090 189 1 . 1 1 35 35 VAL CB C 161 31.260 31.260 31.017 0.243 18090 190 1 . 1 1 35 35 VAL H H 161 7.430 7.430 7.416 0.014 18090 191 1 . 1 1 36 36 ALA N N 162 117.600 117.600 121.432 -3.832 18090 192 1 . 1 1 36 36 ALA HA H 162 3.810 3.810 3.943 -0.133 18090 193 1 . 1 1 36 36 ALA C C 162 180.620 180.620 179.658 0.962 18090 194 1 . 1 1 36 36 ALA CA C 162 54.720 54.720 55.349 -0.629 18090 195 1 . 1 1 36 36 ALA CB C 162 17.490 17.490 18.136 -0.646 18090 196 1 . 1 1 36 36 ALA H H 162 7.500 7.500 7.789 -0.289 18090 197 1 . 1 1 37 37 LYS N N 163 119.880 119.880 118.508 1.372 18090 198 1 . 1 1 37 37 LYS HA H 163 3.570 3.570 3.985 -0.415 18090 199 1 . 1 1 37 37 LYS C C 163 177.800 177.800 179.128 -1.328 18090 200 1 . 1 1 37 37 LYS CA C 163 58.880 58.880 58.928 -0.048 18090 201 1 . 1 1 37 37 LYS CB C 163 31.610 31.610 32.028 -0.418 18090 202 1 . 1 1 37 37 LYS H H 163 7.350 7.350 7.412 -0.062 18090 203 1 . 1 1 38 38 LEU N N 164 118.020 118.020 119.969 -1.949 18090 204 1 . 1 1 38 38 LEU HA H 164 3.670 3.670 4.046 -0.376 18090 205 1 . 1 1 38 38 LEU C C 164 179.380 179.380 179.176 0.204 18090 206 1 . 1 1 38 38 LEU CA C 164 57.340 57.340 57.789 -0.449 18090 207 1 . 1 1 38 38 LEU CB C 164 41.660 41.660 41.709 -0.049 18090 208 1 . 1 1 38 38 LEU H H 164 7.660 7.660 8.165 -0.505 18090 209 1 . 1 1 39 39 ILE N N 165 118.070 118.070 118.531 -0.461 18090 210 1 . 1 1 39 39 ILE HA H 165 3.510 3.510 3.636 -0.126 18090 211 1 . 1 1 39 39 ILE C C 165 179.570 179.570 178.227 1.343 18090 212 1 . 1 1 39 39 ILE CA C 165 64.450 64.450 65.530 -1.080 18090 213 1 . 1 1 39 39 ILE CB C 165 37.310 37.310 37.472 -0.162 18090 214 1 . 1 1 39 39 ILE H H 165 8.030 8.030 7.992 0.038 18090 215 1 . 1 1 40 40 GLY N N 166 107.970 107.970 107.904 0.066 18090 216 1 . 1 1 40 40 GLY C C 166 176.470 176.470 175.679 0.791 18090 217 1 . 1 1 40 40 GLY CA C 166 46.410 46.410 46.977 -0.567 18090 218 1 . 1 1 40 40 GLY H H 166 7.590 7.590 7.644 -0.054 18090 219 1 . 1 1 41 41 TYR N N 167 121.270 121.270 122.340 -1.070 18090 220 1 . 1 1 41 41 TYR HA H 167 4.190 4.190 4.209 -0.019 18090 221 1 . 1 1 41 41 TYR C C 167 176.470 176.470 176.215 0.255 18090 222 1 . 1 1 41 41 TYR CA C 167 57.130 57.130 60.442 -3.312 18090 223 1 . 1 1 41 41 TYR CB C 167 35.950 35.950 38.242 -2.292 18090 224 1 . 1 1 41 41 TYR H H 167 7.350 7.350 7.859 -0.509 18090 225 1 . 1 1 42 42 LYS N N 168 116.520 116.520 116.066 0.454 18090 226 1 . 1 1 42 42 LYS HA H 168 3.820 3.820 4.051 -0.231 18090 227 1 . 1 1 42 42 LYS C C 168 177.810 177.810 177.902 -0.092 18090 228 1 . 1 1 42 42 LYS CA C 168 59.390 59.390 58.400 0.990 18090 229 1 . 1 1 42 42 LYS CB C 168 31.580 31.580 32.727 -1.147 18090 230 1 . 1 1 42 42 LYS H H 168 7.460 7.460 8.251 -0.791 18090 231 1 . 1 1 43 43 GLN N N 169 113.750 113.750 116.033 -2.283 18090 232 1 . 1 1 43 43 GLN HA H 169 4.220 4.220 4.160 0.060 18090 233 1 . 1 1 43 43 GLN C C 169 175.840 175.840 177.340 -1.500 18090 234 1 . 1 1 43 43 GLN CA C 169 56.230 56.230 58.149 -1.919 18090 235 1 . 1 1 43 43 GLN CB C 169 29.290 29.290 29.371 -0.081 18090 236 1 . 1 1 43 43 GLN H H 169 7.220 7.220 7.641 -0.421 18090 237 1 . 1 1 44 44 ASN N N 170 114.130 114.130 116.154 -2.024 18090 238 1 . 1 1 44 44 ASN HA H 170 5.050 5.050 4.962 0.088 18090 239 1 . 1 1 44 44 ASN C C 170 172.200 172.200 173.597 -1.397 18090 240 1 . 1 1 44 44 ASN CA C 170 50.780 50.780 53.544 -2.764 18090 241 1 . 1 1 44 44 ASN CB C 170 38.380 38.380 39.736 -1.356 18090 242 1 . 1 1 44 44 ASN H H 170 7.580 7.580 7.648 -0.068 18090 243 1 . 1 1 45 45 PRO HA H 171 4.130 4.130 4.682 -0.552 18090 244 1 . 1 1 45 45 PRO CA C 171 64.800 64.800 62.131 2.669 18090 245 1 . 1 1 45 45 PRO CB C 171 31.360 31.360 31.881 -0.521 18090 246 1 . 1 1 46 46 GLN N N 172 115.570 115.570 123.841 -8.271 18090 247 1 . 1 1 46 46 GLN HA H 172 3.770 3.770 3.802 -0.032 18090 248 1 . 1 1 46 46 GLN C C 172 177.360 177.360 177.617 -0.257 18090 249 1 . 1 1 46 46 GLN CA C 172 57.950 57.950 58.165 -0.215 18090 250 1 . 1 1 46 46 GLN CB C 172 27.050 27.050 27.782 -0.732 18090 251 1 . 1 1 46 46 GLN H H 172 8.160 8.160 8.634 -0.474 18090 252 1 . 1 1 47 47 ALA N N 173 121.420 121.420 121.698 -0.278 18090 253 1 . 1 1 47 47 ALA HA H 173 4.050 4.050 4.165 -0.115 18090 254 1 . 1 1 47 47 ALA C C 173 178.090 178.090 179.496 -1.406 18090 255 1 . 1 1 47 47 ALA CA C 173 53.490 53.490 54.156 -0.666 18090 256 1 . 1 1 47 47 ALA CB C 173 18.450 18.450 17.643 0.807 18090 257 1 . 1 1 47 47 ALA H H 173 7.470 7.470 8.199 -0.729 18090 258 1 . 1 1 48 48 ILE N N 174 118.050 118.050 118.693 -0.643 18090 259 1 . 1 1 48 48 ILE HA H 174 3.180 3.180 3.881 -0.701 18090 260 1 . 1 1 48 48 ILE C C 174 176.250 176.250 177.878 -1.628 18090 261 1 . 1 1 48 48 ILE CA C 174 64.030 64.030 64.064 -0.034 18090 262 1 . 1 1 48 48 ILE CB C 174 37.280 37.280 37.086 0.194 18090 263 1 . 1 1 48 48 ILE H H 174 7.150 7.150 7.340 -0.190 18090 264 1 . 1 1 49 49 GLY N N 175 105.390 105.390 106.673 -1.283 18090 265 1 . 1 1 49 49 GLY C C 175 174.220 174.220 176.073 -1.853 18090 266 1 . 1 1 49 49 GLY CA C 175 46.700 46.700 47.063 -0.363 18090 267 1 . 1 1 49 49 GLY H H 175 7.550 7.550 7.800 -0.250 18090 268 1 . 1 1 50 50 GLN N N 176 116.230 116.230 118.549 -2.319 18090 269 1 . 1 1 50 50 GLN HA H 176 4.210 4.210 4.619 -0.409 18090 270 1 . 1 1 50 50 GLN C C 176 178.120 178.120 178.227 -0.107 18090 271 1 . 1 1 50 50 GLN CA C 176 57.320 57.320 57.975 -0.656 18090 272 1 . 1 1 50 50 GLN CB C 176 28.630 28.630 29.104 -0.474 18090 273 1 . 1 1 50 50 GLN H H 176 7.390 7.390 7.990 -0.600 18090 274 1 . 1 1 51 51 ASP N N 177 120.000 120.000 121.075 -1.075 18090 275 1 . 1 1 51 51 ASP HA H 177 4.420 4.420 4.657 -0.237 18090 276 1 . 1 1 51 51 ASP C C 177 177.950 177.950 178.342 -0.392 18090 277 1 . 1 1 51 51 ASP CA C 177 55.840 55.840 56.003 -0.163 18090 278 1 . 1 1 51 51 ASP CB C 177 40.310 40.310 40.895 -0.585 18090 279 1 . 1 1 51 51 ASP H H 177 7.870 7.870 7.917 -0.047 18090 280 1 . 1 1 52 52 LEU N N 178 120.010 120.010 120.374 -0.364 18090 281 1 . 1 1 52 52 LEU HA H 178 3.650 3.650 3.986 -0.336 18090 282 1 . 1 1 52 52 LEU C C 178 175.810 175.810 178.361 -2.551 18090 283 1 . 1 1 52 52 LEU CA C 178 57.620 57.620 57.807 -0.187 18090 284 1 . 1 1 52 52 LEU CB C 178 41.880 41.880 41.688 0.192 18090 285 1 . 1 1 52 52 LEU H H 178 7.860 7.860 7.648 0.212 18090 286 1 . 1 1 53 53 PHE N N 179 110.580 110.580 113.383 -2.803 18090 287 1 . 1 1 53 53 PHE HA H 179 4.230 4.230 4.321 -0.091 18090 288 1 . 1 1 53 53 PHE C C 179 176.370 176.370 177.886 -1.516 18090 289 1 . 1 1 53 53 PHE CA C 179 58.730 58.730 60.405 -1.675 18090 290 1 . 1 1 53 53 PHE CB C 179 38.720 38.720 38.879 -0.159 18090 291 1 . 1 1 53 53 PHE H H 179 7.210 7.210 7.955 -0.745 18090 292 1 . 1 1 54 54 THR N N 180 108.190 108.190 108.857 -0.667 18090 293 1 . 1 1 54 54 THR HA H 180 4.300 4.300 4.297 0.003 18090 294 1 . 1 1 54 54 THR C C 180 174.400 174.400 175.089 -0.689 18090 295 1 . 1 1 54 54 THR CA C 180 62.020 62.020 62.739 -0.719 18090 296 1 . 1 1 54 54 THR CB C 180 69.730 69.730 69.868 -0.138 18090 297 1 . 1 1 54 54 THR H H 180 7.550 7.550 7.511 0.039 18090 298 1 . 1 1 55 55 ASP N N 181 120.060 120.060 122.985 -2.925 18090 299 1 . 1 1 55 55 ASP HA H 181 5.020 5.020 5.091 -0.071 18090 300 1 . 1 1 55 55 ASP C C 181 174.120 174.120 175.194 -1.074 18090 301 1 . 1 1 55 55 ASP CA C 181 50.560 50.560 50.724 -0.164 18090 302 1 . 1 1 55 55 ASP CB C 181 41.190 41.190 42.995 -1.805 18090 303 1 . 1 1 55 55 ASP H H 181 7.480 7.480 8.010 -0.530 18090 304 1 . 1 1 56 56 PRO HA H 182 4.320 4.320 4.324 -0.004 18090 305 1 . 1 1 56 56 PRO CA C 182 64.280 64.280 64.843 -0.563 18090 306 1 . 1 1 56 56 PRO CB C 182 31.980 31.980 32.541 -0.561 18090 307 1 . 1 1 57 57 ARG N N 183 117.660 117.660 118.167 -0.507 18090 308 1 . 1 1 57 57 ARG HA H 183 3.960 3.960 4.094 -0.134 18090 309 1 . 1 1 57 57 ARG C C 183 179.030 179.030 178.597 0.433 18090 310 1 . 1 1 57 57 ARG CA C 183 59.000 59.000 58.821 0.179 18090 311 1 . 1 1 57 57 ARG CB C 183 29.750 29.750 29.418 0.332 18090 312 1 . 1 1 57 57 ARG H H 183 7.920 7.920 8.073 -0.153 18090 313 1 . 1 1 58 58 LEU N N 184 115.670 115.670 119.446 -3.776 18090 314 1 . 1 1 58 58 LEU HA H 184 3.850 3.850 3.960 -0.110 18090 315 1 . 1 1 58 58 LEU C C 184 178.770 178.770 179.087 -0.317 18090 316 1 . 1 1 58 58 LEU CA C 184 57.110 57.110 57.729 -0.619 18090 317 1 . 1 1 58 58 LEU CB C 184 41.310 41.310 41.604 -0.294 18090 318 1 . 1 1 58 58 LEU H H 184 7.750 7.750 8.150 -0.400 18090 319 1 . 1 1 59 59 MET N N 185 118.570 118.570 116.328 2.242 18090 320 1 . 1 1 59 59 MET HA H 185 4.060 4.060 4.128 -0.068 18090 321 1 . 1 1 59 59 MET C C 185 177.540 177.540 178.195 -0.655 18090 322 1 . 1 1 59 59 MET CA C 185 58.090 58.090 59.341 -1.251 18090 323 1 . 1 1 59 59 MET CB C 185 31.270 31.270 32.212 -0.942 18090 324 1 . 1 1 59 59 MET H H 185 7.590 7.590 7.690 -0.100 18090 325 1 . 1 1 60 60 THR N N 186 116.390 116.390 117.488 -1.098 18090 326 1 . 1 1 60 60 THR HA H 186 3.680 3.680 3.994 -0.314 18090 327 1 . 1 1 60 60 THR C C 186 177.440 177.440 176.530 0.910 18090 328 1 . 1 1 60 60 THR CA C 186 66.940 66.940 66.841 0.099 18090 329 1 . 1 1 60 60 THR CB C 186 68.030 68.030 68.249 -0.219 18090 330 1 . 1 1 60 60 THR H H 186 7.180 7.180 7.773 -0.593 18090 331 1 . 1 1 61 61 ILE N N 187 123.840 123.840 122.224 1.616 18090 332 1 . 1 1 61 61 ILE HA H 187 3.290 3.290 3.755 -0.465 18090 333 1 . 1 1 61 61 ILE C C 187 176.660 176.660 178.161 -1.501 18090 334 1 . 1 1 61 61 ILE CA C 187 65.850 65.850 65.456 0.394 18090 335 1 . 1 1 61 61 ILE CB C 187 37.640 37.640 37.807 -0.167 18090 336 1 . 1 1 61 61 ILE H H 187 8.010 8.010 7.857 0.153 18090 337 1 . 1 1 62 62 MET N N 188 118.210 118.210 118.315 -0.105 18090 338 1 . 1 1 62 62 MET HA H 188 3.910 3.910 4.016 -0.106 18090 339 1 . 1 1 62 62 MET C C 188 177.540 177.540 178.442 -0.902 18090 340 1 . 1 1 62 62 MET CA C 188 58.530 58.530 58.629 -0.099 18090 341 1 . 1 1 62 62 MET CB C 188 31.200 31.200 31.467 -0.267 18090 342 1 . 1 1 62 62 MET H H 188 8.560 8.560 7.446 1.114 18090 343 1 . 1 1 63 63 ALA N N 189 119.850 119.850 122.185 -2.335 18090 344 1 . 1 1 63 63 ALA HA H 189 3.730 3.730 3.911 -0.181 18090 345 1 . 1 1 63 63 ALA C C 189 179.550 179.550 179.369 0.181 18090 346 1 . 1 1 63 63 ALA CA C 189 55.470 55.470 55.541 -0.071 18090 347 1 . 1 1 63 63 ALA CB C 189 17.640 17.640 18.188 -0.548 18090 348 1 . 1 1 63 63 ALA H H 189 8.210 8.210 8.184 0.026 18090 349 1 . 1 1 64 64 THR N N 190 114.570 114.570 113.809 0.761 18090 350 1 . 1 1 64 64 THR HA H 190 3.790 3.790 4.015 -0.225 18090 351 1 . 1 1 64 64 THR C C 190 177.640 177.640 176.842 0.798 18090 352 1 . 1 1 64 64 THR CA C 190 66.690 66.690 65.746 0.944 18090 353 1 . 1 1 64 64 THR CB C 190 68.310 68.310 68.430 -0.120 18090 354 1 . 1 1 64 64 THR H H 190 7.740 7.740 7.639 0.101 18090 355 1 . 1 1 65 65 LEU N N 191 122.410 122.410 122.256 0.154 18090 356 1 . 1 1 65 65 LEU HA H 191 3.930 3.930 3.962 -0.032 18090 357 1 . 1 1 65 65 LEU C C 191 178.470 178.470 179.671 -1.201 18090 358 1 . 1 1 65 65 LEU CA C 191 57.120 57.120 58.052 -0.932 18090 359 1 . 1 1 65 65 LEU CB C 191 41.830 41.830 41.763 0.067 18090 360 1 . 1 1 65 65 LEU H H 191 8.180 8.180 7.645 0.535 18090 361 1 . 1 1 66 66 MET N N 192 115.320 115.320 117.046 -1.726 18090 362 1 . 1 1 66 66 MET HA H 192 4.090 4.090 4.306 -0.216 18090 363 1 . 1 1 66 66 MET C C 192 176.090 176.090 178.286 -2.196 18090 364 1 . 1 1 66 66 MET CA C 192 56.390 56.390 57.347 -0.957 18090 365 1 . 1 1 66 66 MET CB C 192 33.770 33.770 31.898 1.872 18090 366 1 . 1 1 66 66 MET H H 192 7.880 7.880 8.505 -0.625 18090 367 1 . 1 1 67 67 GLY N N 193 107.490 107.490 105.172 2.318 18090 368 1 . 1 1 67 67 GLY C C 193 174.390 174.390 174.776 -0.386 18090 369 1 . 1 1 67 67 GLY CA C 193 45.880 45.880 45.028 0.852 18090 370 1 . 1 1 67 67 GLY H H 193 7.580 7.580 8.150 -0.570 18090 371 1 . 1 1 68 68 VAL N N 194 118.520 118.520 116.697 1.823 18090 372 1 . 1 1 68 68 VAL HA H 194 3.940 3.940 3.618 0.322 18090 373 1 . 1 1 68 68 VAL C C 194 174.760 174.760 175.314 -0.554 18090 374 1 . 1 1 68 68 VAL CA C 194 61.510 61.510 63.551 -2.041 18090 375 1 . 1 1 68 68 VAL CB C 194 32.670 32.670 30.140 2.530 18090 376 1 . 1 1 68 68 VAL H H 194 7.840 7.840 7.431 0.409 18090 377 1 . 1 1 69 69 ASP N N 195 124.550 124.550 118.089 6.461 18090 378 1 . 1 1 69 69 ASP HA H 195 4.430 4.430 4.457 -0.027 18090 379 1 . 1 1 69 69 ASP C C 195 175.140 175.140 176.226 -1.086 18090 380 1 . 1 1 69 69 ASP CA C 195 53.760 53.760 55.643 -1.883 18090 381 1 . 1 1 69 69 ASP CB C 195 40.920 40.920 40.569 0.351 18090 382 1 . 1 1 69 69 ASP H H 195 8.400 8.400 8.010 0.390 18090 383 1 . 1 1 70 70 LEU N N 196 123.930 123.930 118.841 5.089 18090 384 1 . 1 1 70 70 LEU HA H 196 4.200 4.200 4.230 -0.030 18090 385 1 . 1 1 70 70 LEU C C 196 175.950 175.950 176.740 -0.790 18090 386 1 . 1 1 70 70 LEU CA C 196 54.380 54.380 55.755 -1.375 18090 387 1 . 1 1 70 70 LEU CB C 196 41.610 41.610 42.854 -1.244 18090 388 1 . 1 1 70 70 LEU H H 196 8.160 8.160 7.694 0.466 18090 stop_ save_