data_18000 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 18000 _Entry.PDB_ID 2LKM 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 18000 _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 ARG N N 201 119.330 119.330 125.384 -6.054 18000 2 1 1 . 1 1 2 2 ARG HA H 201 3.560 3.560 4.518 -0.958 18000 3 1 1 . 1 1 2 2 ARG C C 201 176.850 176.850 174.260 2.590 18000 4 1 1 . 1 1 2 2 ARG CA C 201 55.340 55.340 56.316 -0.976 18000 5 1 1 . 1 1 2 2 ARG CB C 201 27.020 27.020 31.990 -4.970 18000 6 1 1 . 1 1 2 2 ARG H H 201 8.370 8.370 8.237 0.133 18000 7 1 1 . 1 1 3 3 LYS N N 202 118.540 118.540 126.826 -8.286 18000 8 1 1 . 1 1 3 3 LYS HA H 202 4.010 4.010 4.303 -0.293 18000 9 1 1 . 1 1 3 3 LYS C C 202 176.090 176.090 175.748 0.342 18000 10 1 1 . 1 1 3 3 LYS CA C 202 56.960 56.960 55.406 1.554 18000 11 1 1 . 1 1 3 3 LYS CB C 202 30.590 30.590 32.770 -2.180 18000 12 1 1 . 1 1 3 3 LYS H H 202 7.940 7.940 7.858 0.082 18000 13 1 1 . 1 1 4 4 SER N N 203 113.880 113.880 123.203 -9.323 18000 14 1 1 . 1 1 4 4 SER HA H 203 4.320 4.320 4.618 -0.298 18000 15 1 1 . 1 1 4 4 SER C C 203 172.900 172.900 172.621 0.279 18000 16 1 1 . 1 1 4 4 SER CA C 203 57.870 57.870 56.139 1.731 18000 17 1 1 . 1 1 4 4 SER CB C 203 61.700 61.700 62.416 -0.716 18000 18 1 1 . 1 1 4 4 SER H H 203 7.700 7.700 8.294 -0.594 18000 19 1 1 . 1 1 5 5 ARG HA H 204 4.240 4.240 4.360 -0.120 18000 20 1 1 . 1 1 5 5 ARG C C 204 174.810 174.810 174.407 0.403 18000 21 1 1 . 1 1 5 5 ARG CA C 204 54.270 54.270 55.941 -1.671 18000 22 1 1 . 1 1 5 5 ARG CB C 204 28.700 28.700 31.024 -2.324 18000 23 1 1 . 1 1 6 6 GLY N N 205 125.950 125.950 110.408 15.542 18000 24 1 1 . 1 1 6 6 GLY HA H 205 4.400 4.400 4.529 -0.129 18000 25 1 1 . 1 1 6 6 GLY C C 205 171.910 171.910 173.824 -1.914 18000 26 1 1 . 1 1 6 6 GLY CA C 205 43.570 43.570 44.407 -0.837 18000 27 1 1 . 1 1 6 6 GLY CB C 205 28.340 28.340 30.179 -1.839 18000 28 1 1 . 1 1 6 6 GLY H H 205 7.930 7.930 8.404 -0.474 18000 29 1 1 . 1 1 7 7 ASN N N 206 118.380 118.380 124.384 -6.004 18000 30 1 1 . 1 1 7 7 ASN HA H 206 4.760 4.760 4.833 -0.073 18000 31 1 1 . 1 1 7 7 ASN C C 206 173.810 173.810 176.906 -3.096 18000 32 1 1 . 1 1 7 7 ASN CA C 206 51.430 51.430 53.490 -2.060 18000 33 1 1 . 1 1 7 7 ASN CB C 206 37.090 37.090 38.614 -1.524 18000 34 1 1 . 1 1 7 7 ASN H H 206 8.330 8.330 8.936 -0.606 18000 35 1 1 . 1 1 8 8 THR N N 207 119.850 119.850 121.396 -1.546 18000 36 1 1 . 1 1 8 8 THR HA H 207 4.270 4.270 4.105 0.165 18000 37 1 1 . 1 1 8 8 THR C C 207 172.560 172.560 176.396 -3.836 18000 38 1 1 . 1 1 8 8 THR CA C 207 60.420 60.420 65.606 -5.186 18000 39 1 1 . 1 1 8 8 THR CB C 207 67.750 67.750 68.085 -0.335 18000 40 1 1 . 1 1 8 8 THR H H 207 7.830 7.830 7.867 -0.037 18000 41 1 1 . 1 1 9 9 ASP N N 208 121.180 121.180 117.959 3.221 18000 42 1 1 . 1 1 9 9 ASP HA H 208 4.550 4.550 4.585 -0.035 18000 43 1 1 . 1 1 9 9 ASP C C 208 174.170 174.170 176.771 -2.601 18000 44 1 1 . 1 1 9 9 ASP CA C 208 52.670 52.670 58.615 -5.945 18000 45 1 1 . 1 1 9 9 ASP CB C 208 39.120 39.120 37.891 1.229 18000 46 1 1 . 1 1 9 9 ASP H H 208 8.350 8.350 8.890 -0.540 18000 47 1 1 . 1 1 10 10 ASN HA H 209 4.600 4.600 4.431 0.169 18000 48 1 1 . 1 1 10 10 ASN C C 209 173.670 173.670 177.506 -3.836 18000 49 1 1 . 1 1 10 10 ASN CA C 209 52.110 52.110 56.201 -4.091 18000 50 1 1 . 1 1 10 10 ASN CB C 209 36.730 36.730 37.902 -1.172 18000 51 1 1 . 1 1 11 11 LYS N N 210 120.380 120.380 116.906 3.474 18000 52 1 1 . 1 1 11 11 LYS HA H 210 4.270 4.270 4.012 0.258 18000 53 1 1 . 1 1 11 11 LYS C C 210 174.910 174.910 179.016 -4.106 18000 54 1 1 . 1 1 11 11 LYS CA C 210 54.900 54.900 60.234 -5.334 18000 55 1 1 . 1 1 11 11 LYS CB C 210 30.670 30.670 32.021 -1.351 18000 56 1 1 . 1 1 11 11 LYS H H 210 8.210 8.210 8.338 -0.128 18000 57 1 1 . 1 1 12 12 GLU N N 211 120.740 120.740 120.311 0.429 18000 58 1 1 . 1 1 12 12 GLU HA H 211 4.070 4.070 4.019 0.052 18000 59 1 1 . 1 1 12 12 GLU C C 211 174.810 174.810 179.464 -4.654 18000 60 1 1 . 1 1 12 12 GLU CA C 211 55.940 55.940 59.786 -3.846 18000 61 1 1 . 1 1 12 12 GLU CB C 211 27.700 27.700 29.224 -1.524 18000 62 1 1 . 1 1 12 12 GLU H H 211 8.380 8.380 8.506 -0.126 18000 63 1 1 . 1 1 13 13 TYR N N 212 119.430 119.430 118.811 0.619 18000 64 1 1 . 1 1 13 13 TYR HA H 212 4.380 4.380 4.226 0.154 18000 65 1 1 . 1 1 13 13 TYR C C 212 174.830 174.830 178.528 -3.698 18000 66 1 1 . 1 1 13 13 TYR CA C 212 57.420 57.420 60.960 -3.540 18000 67 1 1 . 1 1 13 13 TYR CB C 212 36.530 36.530 38.086 -1.556 18000 68 1 1 . 1 1 13 13 TYR H H 212 7.940 7.940 8.627 -0.687 18000 69 1 1 . 1 1 14 14 ALA N N 213 121.810 121.810 120.366 1.444 18000 70 1 1 . 1 1 14 14 ALA HA H 213 4.260 4.260 4.022 0.238 18000 71 1 1 . 1 1 14 14 ALA C C 213 176.630 176.630 179.607 -2.977 18000 72 1 1 . 1 1 14 14 ALA CA C 213 51.990 51.990 55.299 -3.309 18000 73 1 1 . 1 1 14 14 ALA CB C 213 16.450 16.450 18.788 -2.338 18000 74 1 1 . 1 1 14 14 ALA H H 213 7.920 7.920 8.266 -0.346 18000 75 1 1 . 1 1 15 15 VAL N N 214 121.430 121.430 119.185 2.245 18000 76 1 1 . 1 1 15 15 VAL HA H 214 3.470 3.470 3.568 -0.098 18000 77 1 1 . 1 1 15 15 VAL C C 214 174.980 174.980 177.657 -2.677 18000 78 1 1 . 1 1 15 15 VAL CA C 214 64.190 64.190 66.459 -2.269 18000 79 1 1 . 1 1 15 15 VAL CB C 214 29.820 29.820 31.275 -1.455 18000 80 1 1 . 1 1 15 15 VAL H H 214 8.680 8.680 8.408 0.272 18000 81 1 1 . 1 1 16 16 ASN N N 215 117.460 117.460 118.326 -0.866 18000 82 1 1 . 1 1 16 16 ASN HA H 215 4.300 4.300 4.463 -0.163 18000 83 1 1 . 1 1 16 16 ASN C C 215 176.320 176.320 177.033 -0.713 18000 84 1 1 . 1 1 16 16 ASN CA C 215 54.190 54.190 55.812 -1.622 18000 85 1 1 . 1 1 16 16 ASN CB C 215 35.360 35.360 37.753 -2.393 18000 86 1 1 . 1 1 16 16 ASN H H 215 8.190 8.190 8.309 -0.119 18000 87 1 1 . 1 1 17 17 GLU N N 216 119.430 119.430 117.388 2.042 18000 88 1 1 . 1 1 17 17 GLU HA H 216 4.000 4.000 4.177 -0.177 18000 89 1 1 . 1 1 17 17 GLU C C 216 177.240 177.240 178.930 -1.690 18000 90 1 1 . 1 1 17 17 GLU CA C 216 57.180 57.180 58.723 -1.543 18000 91 1 1 . 1 1 17 17 GLU CB C 216 28.400 28.400 29.276 -0.876 18000 92 1 1 . 1 1 17 17 GLU H H 216 7.730 7.730 8.079 -0.349 18000 93 1 1 . 1 1 18 18 VAL N N 217 120.690 120.690 119.272 1.418 18000 94 1 1 . 1 1 18 18 VAL HA H 217 3.530 3.530 3.900 -0.370 18000 95 1 1 . 1 1 18 18 VAL C C 217 174.990 174.990 178.371 -3.381 18000 96 1 1 . 1 1 18 18 VAL CA C 217 64.310 64.310 64.949 -0.639 18000 97 1 1 . 1 1 18 18 VAL CB C 217 29.640 29.640 31.167 -1.527 18000 98 1 1 . 1 1 18 18 VAL H H 217 7.820 7.820 7.986 -0.166 18000 99 1 1 . 1 1 19 19 VAL N N 218 117.010 117.010 115.028 1.982 18000 100 1 1 . 1 1 19 19 VAL HA H 218 3.500 3.500 3.844 -0.344 18000 101 1 1 . 1 1 19 19 VAL C C 218 175.200 175.200 176.605 -1.405 18000 102 1 1 . 1 1 19 19 VAL CA C 218 64.960 64.960 65.244 -0.284 18000 103 1 1 . 1 1 19 19 VAL CB C 218 29.710 29.710 31.736 -2.026 18000 104 1 1 . 1 1 19 19 VAL H H 218 8.260 8.260 7.895 0.365 18000 105 1 1 . 1 1 20 20 ALA N N 219 120.360 120.360 117.779 2.581 18000 106 1 1 . 1 1 20 20 ALA HA H 219 3.930 3.930 4.378 -0.448 18000 107 1 1 . 1 1 20 20 ALA C C 219 178.310 178.310 177.469 0.841 18000 108 1 1 . 1 1 20 20 ALA CA C 219 53.040 53.040 51.044 1.996 18000 109 1 1 . 1 1 20 20 ALA CB C 219 16.280 16.280 19.016 -2.736 18000 110 1 1 . 1 1 20 20 ALA H H 219 7.490 7.490 7.337 0.153 18000 111 1 1 . 1 1 21 21 GLY N N 220 124.250 124.250 108.971 15.279 18000 112 1 1 . 1 1 21 21 GLY HA H 220 4.250 4.250 4.455 -0.205 18000 113 1 1 . 1 1 21 21 GLY C C 220 172.880 172.880 174.772 -1.892 18000 114 1 1 . 1 1 21 21 GLY CA C 220 44.130 44.130 43.718 0.412 18000 115 1 1 . 1 1 21 21 GLY CB C 220 29.290 29.290 29.180 0.110 18000 116 1 1 . 1 1 21 21 GLY H H 220 7.640 7.640 7.628 0.012 18000 117 1 1 . 1 1 22 22 ILE N N 221 119.940 119.940 125.814 -5.874 18000 118 1 1 . 1 1 22 22 ILE HA H 221 3.290 3.290 4.303 -1.013 18000 119 1 1 . 1 1 22 22 ILE C C 221 175.100 175.100 174.462 0.638 18000 120 1 1 . 1 1 22 22 ILE CA C 221 64.070 64.070 60.410 3.659 18000 121 1 1 . 1 1 22 22 ILE CB C 221 35.260 35.260 38.083 -2.823 18000 122 1 1 . 1 1 22 22 ILE H H 221 8.130 8.130 8.146 -0.016 18000 123 1 1 . 1 1 23 23 LYS HA H 222 3.430 3.430 4.332 -0.902 18000 124 1 1 . 1 1 23 23 LYS C C 222 175.280 175.280 175.536 -0.256 18000 125 1 1 . 1 1 23 23 LYS CA C 222 59.270 59.270 56.671 2.599 18000 126 1 1 . 1 1 23 23 LYS CB C 222 30.670 30.670 31.942 -1.272 18000 127 1 1 . 1 1 24 24 GLU N N 223 116.150 116.150 122.736 -6.586 18000 128 1 1 . 1 1 24 24 GLU HA H 223 4.150 4.150 4.241 -0.091 18000 129 1 1 . 1 1 24 24 GLU C C 223 177.330 177.330 176.318 1.012 18000 130 1 1 . 1 1 24 24 GLU CA C 223 57.180 57.180 56.745 0.435 18000 131 1 1 . 1 1 24 24 GLU CB C 223 27.670 27.670 30.475 -2.805 18000 132 1 1 . 1 1 24 24 GLU H H 223 7.830 7.830 8.589 -0.759 18000 133 1 1 . 1 1 25 25 TYR N N 224 119.760 119.760 119.588 0.172 18000 134 1 1 . 1 1 25 25 TYR HA H 224 4.480 4.480 4.673 -0.193 18000 135 1 1 . 1 1 25 25 TYR C C 224 175.680 175.680 173.955 1.725 18000 136 1 1 . 1 1 25 25 TYR CA C 224 57.520 57.520 57.788 -0.268 18000 137 1 1 . 1 1 25 25 TYR CB C 224 36.940 36.940 40.893 -3.953 18000 138 1 1 . 1 1 25 25 TYR H H 224 8.630 8.630 7.961 0.669 18000 139 1 1 . 1 1 26 26 PHE N N 225 120.090 120.090 124.512 -4.422 18000 140 1 1 . 1 1 26 26 PHE HA H 225 3.410 3.410 4.592 -1.182 18000 141 1 1 . 1 1 26 26 PHE C C 225 173.930 173.930 174.655 -0.725 18000 142 1 1 . 1 1 26 26 PHE CA C 225 61.600 61.600 58.803 2.797 18000 143 1 1 . 1 1 26 26 PHE CB C 225 36.590 36.590 39.555 -2.965 18000 144 1 1 . 1 1 26 26 PHE H H 225 9.220 9.220 8.596 0.624 18000 145 1 1 . 1 1 27 27 ASN N N 226 115.010 115.010 124.231 -9.221 18000 146 1 1 . 1 1 27 27 ASN HA H 226 4.470 4.470 4.707 -0.237 18000 147 1 1 . 1 1 27 27 ASN C C 226 176.630 176.630 173.521 3.109 18000 148 1 1 . 1 1 27 27 ASN CA C 226 54.160 54.160 51.994 2.166 18000 149 1 1 . 1 1 27 27 ASN CB C 226 35.800 35.800 41.061 -5.261 18000 150 1 1 . 1 1 27 27 ASN H H 226 8.210 8.210 7.988 0.222 18000 151 1 1 . 1 1 28 28 VAL N N 227 115.120 115.120 124.535 -9.415 18000 152 1 1 . 1 1 28 28 VAL HA H 227 4.300 4.300 4.356 -0.056 18000 153 1 1 . 1 1 28 28 VAL C C 227 174.960 174.960 174.456 0.504 18000 154 1 1 . 1 1 28 28 VAL CA C 227 61.320 61.320 59.653 1.667 18000 155 1 1 . 1 1 28 28 VAL CB C 227 30.670 30.670 31.713 -1.043 18000 156 1 1 . 1 1 28 28 VAL H H 227 7.430 7.430 8.353 -0.923 18000 157 1 1 . 1 1 29 29 MET HA H 228 4.000 4.000 4.328 -0.328 18000 158 1 1 . 1 1 29 29 MET C C 228 176.270 176.270 176.156 0.114 18000 159 1 1 . 1 1 29 29 MET CA C 228 54.030 54.030 55.135 -1.105 18000 160 1 1 . 1 1 29 29 MET CB C 228 31.510 31.510 33.196 -1.686 18000 161 1 1 . 1 1 30 30 LEU N N 229 122.180 122.180 121.728 0.452 18000 162 1 1 . 1 1 30 30 LEU HA H 229 3.150 3.150 3.940 -0.790 18000 163 1 1 . 1 1 30 30 LEU C C 229 176.070 176.070 177.175 -1.105 18000 164 1 1 . 1 1 30 30 LEU CA C 229 55.860 55.860 57.623 -1.763 18000 165 1 1 . 1 1 30 30 LEU CB C 229 36.340 36.340 41.616 -5.276 18000 166 1 1 . 1 1 30 30 LEU H H 229 7.890 7.890 8.495 -0.605 18000 167 1 1 . 1 1 31 31 GLY N N 230 118.390 118.390 106.418 11.972 18000 168 1 1 . 1 1 31 31 GLY HA H 230 4.090 4.090 4.130 -0.040 18000 169 1 1 . 1 1 31 31 GLY C C 230 173.070 173.070 175.703 -2.633 18000 170 1 1 . 1 1 31 31 GLY CA C 230 43.150 43.150 46.210 -3.060 18000 171 1 1 . 1 1 31 31 GLY CB C 230 26.780 26.780 29.171 -2.391 18000 172 1 1 . 1 1 31 31 GLY H H 230 8.350 8.350 8.271 0.079 18000 173 1 1 . 1 1 32 32 THR N N 231 124.790 124.790 111.986 12.804 18000 174 1 1 . 1 1 32 32 THR HA H 231 4.280 4.280 4.288 -0.008 18000 175 1 1 . 1 1 32 32 THR C C 231 173.260 173.260 176.158 -2.898 18000 176 1 1 . 1 1 32 32 THR CA C 231 60.030 60.030 63.797 -3.767 18000 177 1 1 . 1 1 32 32 THR CB C 231 68.540 68.540 69.749 -1.209 18000 178 1 1 . 1 1 32 32 THR H H 231 7.040 7.040 7.709 -0.669 18000 179 1 1 . 1 1 33 33 GLN N N 232 114.740 114.740 115.779 -1.039 18000 180 1 1 . 1 1 33 33 GLN HA H 232 5.090 5.090 4.308 0.782 18000 181 1 1 . 1 1 33 33 GLN C C 232 175.790 175.790 175.319 0.471 18000 182 1 1 . 1 1 33 33 GLN CA C 232 53.650 53.650 56.016 -2.366 18000 183 1 1 . 1 1 33 33 GLN CB C 232 30.520 30.520 30.634 -0.114 18000 184 1 1 . 1 1 33 33 GLN H H 232 8.110 8.110 7.993 0.117 18000 185 1 1 . 1 1 34 34 LEU N N 233 112.480 112.480 124.604 -12.124 18000 186 1 1 . 1 1 34 34 LEU HA H 233 4.460 4.460 4.060 0.400 18000 187 1 1 . 1 1 34 34 LEU C C 233 172.610 172.610 176.961 -4.351 18000 188 1 1 . 1 1 34 34 LEU CA C 233 52.460 52.460 56.062 -3.602 18000 189 1 1 . 1 1 34 34 LEU CB C 233 39.140 39.140 42.023 -2.883 18000 190 1 1 . 1 1 34 34 LEU H H 233 6.980 6.980 8.081 -1.101 18000 191 1 1 . 1 1 35 35 LEU N N 234 115.860 115.860 125.744 -9.884 18000 192 1 1 . 1 1 35 35 LEU HA H 234 4.510 4.510 4.549 -0.039 18000 193 1 1 . 1 1 35 35 LEU C C 234 178.330 178.330 176.426 1.904 18000 194 1 1 . 1 1 35 35 LEU CA C 234 51.900 51.900 54.007 -2.107 18000 195 1 1 . 1 1 35 35 LEU CB C 234 40.950 40.950 42.065 -1.115 18000 196 1 1 . 1 1 35 35 LEU H H 234 7.560 7.560 8.623 -1.063 18000 197 1 1 . 1 1 36 36 TYR N N 235 125.850 125.850 123.529 2.321 18000 198 1 1 . 1 1 36 36 TYR HA H 235 4.790 4.790 4.624 0.166 18000 199 1 1 . 1 1 36 36 TYR C C 235 176.260 176.260 174.454 1.806 18000 200 1 1 . 1 1 36 36 TYR CA C 235 57.750 57.750 57.513 0.237 18000 201 1 1 . 1 1 36 36 TYR CB C 235 37.100 37.100 40.050 -2.950 18000 202 1 1 . 1 1 36 36 TYR H H 235 9.750 9.750 7.623 2.127 18000 203 1 1 . 1 1 37 37 LYS N N 236 123.880 123.880 125.398 -1.518 18000 204 1 1 . 1 1 37 37 LYS HA H 236 3.930 3.930 4.642 -0.712 18000 205 1 1 . 1 1 37 37 LYS C C 236 178.280 178.280 175.783 2.497 18000 206 1 1 . 1 1 37 37 LYS CA C 236 59.210 59.210 55.547 3.663 18000 207 1 1 . 1 1 37 37 LYS CB C 236 30.430 30.430 33.509 -3.079 18000 208 1 1 . 1 1 37 37 LYS H H 236 9.340 9.340 8.429 0.911 18000 209 1 1 . 1 1 38 38 PHE N N 237 117.150 117.150 122.678 -5.528 18000 210 1 1 . 1 1 38 38 PHE HA H 237 4.460 4.460 4.846 -0.386 18000 211 1 1 . 1 1 38 38 PHE C C 237 173.930 173.930 174.627 -0.697 18000 212 1 1 . 1 1 38 38 PHE CA C 237 58.510 58.510 55.517 2.993 18000 213 1 1 . 1 1 38 38 PHE CB C 237 38.370 38.370 39.429 -1.060 18000 214 1 1 . 1 1 38 38 PHE H H 237 9.120 9.120 8.272 0.848 18000 215 1 1 . 1 1 39 39 GLU HA H 238 4.160 4.160 4.428 -0.268 18000 216 1 1 . 1 1 39 39 GLU C C 238 175.650 175.650 175.349 0.301 18000 217 1 1 . 1 1 39 39 GLU CA C 238 55.070 55.070 56.396 -1.326 18000 218 1 1 . 1 1 39 39 GLU CB C 238 31.540 31.540 29.343 2.197 18000 219 1 1 . 1 1 40 40 ARG N N 239 120.330 120.330 124.274 -3.944 18000 220 1 1 . 1 1 40 40 ARG HA H 239 4.250 4.250 4.273 -0.023 18000 221 1 1 . 1 1 40 40 ARG C C 239 174.490 174.490 175.174 -0.684 18000 222 1 1 . 1 1 40 40 ARG CA C 239 60.410 60.410 56.133 4.277 18000 223 1 1 . 1 1 40 40 ARG H H 239 7.980 7.980 8.071 -0.091 18000 224 1 1 . 1 1 41 41 PRO N N 240 115.390 115.390 114.172 1.218 18000 225 1 1 . 1 1 41 41 PRO HA H 240 4.360 4.360 4.236 0.124 18000 226 1 1 . 1 1 41 41 PRO C C 240 176.330 176.330 176.778 -0.448 18000 227 1 1 . 1 1 41 41 PRO CA C 240 64.400 64.400 64.772 -0.372 18000 228 1 1 . 1 1 41 41 PRO CB C 240 62.240 62.240 62.696 -0.456 18000 229 1 1 . 1 1 41 41 PRO H H 240 8.090 8.090 8.695 -0.605 18000 230 1 2 . 1 1 2 2 ARG N N 201 119.330 119.330 120.487 -1.157 18000 231 1 2 . 1 1 2 2 ARG HA H 201 3.560 3.560 4.733 -1.173 18000 232 1 2 . 1 1 2 2 ARG C C 201 176.850 176.850 174.779 2.071 18000 233 1 2 . 1 1 2 2 ARG CA C 201 55.340 55.340 56.701 -1.361 18000 234 1 2 . 1 1 2 2 ARG CB C 201 27.020 27.020 32.304 -5.284 18000 235 1 2 . 1 1 2 2 ARG H H 201 8.370 8.370 8.133 0.237 18000 236 1 2 . 1 1 3 3 LYS N N 202 118.540 118.540 123.180 -4.640 18000 237 1 2 . 1 1 3 3 LYS HA H 202 4.010 4.010 4.045 -0.035 18000 238 1 2 . 1 1 3 3 LYS C C 202 176.090 176.090 174.762 1.328 18000 239 1 2 . 1 1 3 3 LYS CA C 202 56.960 56.960 56.962 -0.002 18000 240 1 2 . 1 1 3 3 LYS CB C 202 30.590 30.590 32.699 -2.109 18000 241 1 2 . 1 1 3 3 LYS H H 202 7.940 7.940 8.179 -0.239 18000 242 1 2 . 1 1 4 4 SER N N 203 113.880 113.880 121.575 -7.695 18000 243 1 2 . 1 1 4 4 SER HA H 203 4.320 4.320 4.996 -0.676 18000 244 1 2 . 1 1 4 4 SER C C 203 172.900 172.900 172.964 -0.064 18000 245 1 2 . 1 1 4 4 SER CA C 203 57.870 57.870 56.340 1.530 18000 246 1 2 . 1 1 4 4 SER CB C 203 61.700 61.700 63.794 -2.094 18000 247 1 2 . 1 1 4 4 SER H H 203 7.700 7.700 8.287 -0.587 18000 248 1 2 . 1 1 5 5 ARG HA H 204 4.240 4.240 4.285 -0.045 18000 249 1 2 . 1 1 5 5 ARG C C 204 174.810 174.810 174.971 -0.161 18000 250 1 2 . 1 1 5 5 ARG CA C 204 54.270 54.270 55.837 -1.567 18000 251 1 2 . 1 1 5 5 ARG CB C 204 28.700 28.700 30.805 -2.105 18000 252 1 2 . 1 1 6 6 GLY N N 205 125.950 125.950 109.350 16.600 18000 253 1 2 . 1 1 6 6 GLY HA H 205 4.400 4.400 4.339 0.061 18000 254 1 2 . 1 1 6 6 GLY C C 205 171.910 171.910 175.082 -3.172 18000 255 1 2 . 1 1 6 6 GLY CA C 205 43.570 43.570 44.905 -1.335 18000 256 1 2 . 1 1 6 6 GLY CB C 205 28.340 28.340 29.523 -1.183 18000 257 1 2 . 1 1 6 6 GLY H H 205 7.930 7.930 8.357 -0.427 18000 258 1 2 . 1 1 7 7 ASN N N 206 118.380 118.380 123.641 -5.261 18000 259 1 2 . 1 1 7 7 ASN HA H 206 4.760 4.760 4.790 -0.030 18000 260 1 2 . 1 1 7 7 ASN C C 206 173.810 173.810 177.632 -3.822 18000 261 1 2 . 1 1 7 7 ASN CA C 206 51.430 51.430 55.229 -3.799 18000 262 1 2 . 1 1 7 7 ASN CB C 206 37.090 37.090 38.207 -1.117 18000 263 1 2 . 1 1 7 7 ASN H H 206 8.330 8.330 8.908 -0.578 18000 264 1 2 . 1 1 8 8 THR N N 207 119.850 119.850 120.594 -0.744 18000 265 1 2 . 1 1 8 8 THR HA H 207 4.270 4.270 4.304 -0.034 18000 266 1 2 . 1 1 8 8 THR C C 207 172.560 172.560 176.950 -4.390 18000 267 1 2 . 1 1 8 8 THR CA C 207 60.420 60.420 65.057 -4.637 18000 268 1 2 . 1 1 8 8 THR CB C 207 67.750 67.750 67.999 -0.249 18000 269 1 2 . 1 1 8 8 THR H H 207 7.830 7.830 8.591 -0.761 18000 270 1 2 . 1 1 9 9 ASP N N 208 121.180 121.180 118.801 2.379 18000 271 1 2 . 1 1 9 9 ASP HA H 208 4.550 4.550 4.499 0.051 18000 272 1 2 . 1 1 9 9 ASP C C 208 174.170 174.170 176.081 -1.911 18000 273 1 2 . 1 1 9 9 ASP CA C 208 52.670 52.670 58.643 -5.973 18000 274 1 2 . 1 1 9 9 ASP CB C 208 39.120 39.120 38.000 1.120 18000 275 1 2 . 1 1 9 9 ASP H H 208 8.350 8.350 8.798 -0.448 18000 276 1 2 . 1 1 10 10 ASN HA H 209 4.600 4.600 4.618 -0.018 18000 277 1 2 . 1 1 10 10 ASN C C 209 173.670 173.670 177.365 -3.695 18000 278 1 2 . 1 1 10 10 ASN CA C 209 52.110 52.110 55.590 -3.480 18000 279 1 2 . 1 1 10 10 ASN CB C 209 36.730 36.730 38.013 -1.283 18000 280 1 2 . 1 1 11 11 LYS N N 210 120.380 120.380 119.214 1.166 18000 281 1 2 . 1 1 11 11 LYS HA H 210 4.270 4.270 3.974 0.296 18000 282 1 2 . 1 1 11 11 LYS C C 210 174.910 174.910 179.028 -4.118 18000 283 1 2 . 1 1 11 11 LYS CA C 210 54.900 54.900 60.395 -5.495 18000 284 1 2 . 1 1 11 11 LYS CB C 210 30.670 30.670 31.922 -1.252 18000 285 1 2 . 1 1 11 11 LYS H H 210 8.210 8.210 8.171 0.039 18000 286 1 2 . 1 1 12 12 GLU N N 211 120.740 120.740 120.486 0.254 18000 287 1 2 . 1 1 12 12 GLU HA H 211 4.070 4.070 4.065 0.005 18000 288 1 2 . 1 1 12 12 GLU C C 211 174.810 174.810 179.421 -4.611 18000 289 1 2 . 1 1 12 12 GLU CA C 211 55.940 55.940 59.915 -3.975 18000 290 1 2 . 1 1 12 12 GLU CB C 211 27.700 27.700 29.433 -1.733 18000 291 1 2 . 1 1 12 12 GLU H H 211 8.380 8.380 8.506 -0.126 18000 292 1 2 . 1 1 13 13 TYR N N 212 119.430 119.430 119.038 0.392 18000 293 1 2 . 1 1 13 13 TYR HA H 212 4.380 4.380 4.230 0.150 18000 294 1 2 . 1 1 13 13 TYR C C 212 174.830 174.830 178.411 -3.581 18000 295 1 2 . 1 1 13 13 TYR CA C 212 57.420 57.420 60.993 -3.573 18000 296 1 2 . 1 1 13 13 TYR CB C 212 36.530 36.530 38.203 -1.673 18000 297 1 2 . 1 1 13 13 TYR H H 212 7.940 7.940 7.808 0.132 18000 298 1 2 . 1 1 14 14 ALA N N 213 121.810 121.810 120.165 1.645 18000 299 1 2 . 1 1 14 14 ALA HA H 213 4.260 4.260 3.900 0.360 18000 300 1 2 . 1 1 14 14 ALA C C 213 176.630 176.630 179.993 -3.363 18000 301 1 2 . 1 1 14 14 ALA CA C 213 51.990 51.990 55.435 -3.445 18000 302 1 2 . 1 1 14 14 ALA CB C 213 16.450 16.450 18.646 -2.196 18000 303 1 2 . 1 1 14 14 ALA H H 213 7.920 7.920 8.287 -0.367 18000 304 1 2 . 1 1 15 15 VAL N N 214 121.430 121.430 119.128 2.302 18000 305 1 2 . 1 1 15 15 VAL HA H 214 3.470 3.470 3.576 -0.106 18000 306 1 2 . 1 1 15 15 VAL C C 214 174.980 174.980 177.830 -2.850 18000 307 1 2 . 1 1 15 15 VAL CA C 214 64.190 64.190 66.194 -2.003 18000 308 1 2 . 1 1 15 15 VAL CB C 214 29.820 29.820 31.241 -1.421 18000 309 1 2 . 1 1 15 15 VAL H H 214 8.680 8.680 8.499 0.181 18000 310 1 2 . 1 1 16 16 ASN N N 215 117.460 117.460 118.409 -0.949 18000 311 1 2 . 1 1 16 16 ASN HA H 215 4.300 4.300 4.418 -0.118 18000 312 1 2 . 1 1 16 16 ASN C C 215 176.320 176.320 177.251 -0.931 18000 313 1 2 . 1 1 16 16 ASN CA C 215 54.190 54.190 56.023 -1.833 18000 314 1 2 . 1 1 16 16 ASN CB C 215 35.360 35.360 37.583 -2.223 18000 315 1 2 . 1 1 16 16 ASN H H 215 8.190 8.190 8.214 -0.024 18000 316 1 2 . 1 1 17 17 GLU N N 216 119.430 119.430 118.195 1.235 18000 317 1 2 . 1 1 17 17 GLU HA H 216 4.000 4.000 4.405 -0.405 18000 318 1 2 . 1 1 17 17 GLU C C 216 177.240 177.240 178.358 -1.118 18000 319 1 2 . 1 1 17 17 GLU CA C 216 57.180 57.180 58.709 -1.529 18000 320 1 2 . 1 1 17 17 GLU CB C 216 28.400 28.400 29.351 -0.951 18000 321 1 2 . 1 1 17 17 GLU H H 216 7.730 7.730 8.506 -0.776 18000 322 1 2 . 1 1 18 18 VAL N N 217 120.690 120.690 117.776 2.914 18000 323 1 2 . 1 1 18 18 VAL HA H 217 3.530 3.530 3.783 -0.253 18000 324 1 2 . 1 1 18 18 VAL C C 217 174.990 174.990 178.009 -3.019 18000 325 1 2 . 1 1 18 18 VAL CA C 217 64.310 64.310 65.014 -0.704 18000 326 1 2 . 1 1 18 18 VAL CB C 217 29.640 29.640 31.369 -1.728 18000 327 1 2 . 1 1 18 18 VAL H H 217 7.820 7.820 8.071 -0.251 18000 328 1 2 . 1 1 19 19 VAL N N 218 117.010 117.010 117.444 -0.434 18000 329 1 2 . 1 1 19 19 VAL HA H 218 3.500 3.500 3.757 -0.257 18000 330 1 2 . 1 1 19 19 VAL C C 218 175.200 175.200 178.739 -3.539 18000 331 1 2 . 1 1 19 19 VAL CA C 218 64.960 64.960 66.009 -1.049 18000 332 1 2 . 1 1 19 19 VAL CB C 218 29.710 29.710 31.974 -2.264 18000 333 1 2 . 1 1 19 19 VAL H H 218 8.260 8.260 7.973 0.287 18000 334 1 2 . 1 1 20 20 ALA N N 219 120.360 120.360 121.063 -0.703 18000 335 1 2 . 1 1 20 20 ALA HA H 219 3.930 3.930 4.117 -0.187 18000 336 1 2 . 1 1 20 20 ALA C C 219 178.310 178.310 179.208 -0.898 18000 337 1 2 . 1 1 20 20 ALA CA C 219 53.040 53.040 54.171 -1.131 18000 338 1 2 . 1 1 20 20 ALA CB C 219 16.280 16.280 18.367 -2.087 18000 339 1 2 . 1 1 20 20 ALA H H 219 7.490 7.490 7.793 -0.303 18000 340 1 2 . 1 1 21 21 GLY N N 220 124.250 124.250 106.535 17.715 18000 341 1 2 . 1 1 21 21 GLY HA H 220 4.250 4.250 4.258 -0.008 18000 342 1 2 . 1 1 21 21 GLY C C 220 172.880 172.880 174.736 -1.856 18000 343 1 2 . 1 1 21 21 GLY CA C 220 44.130 44.130 44.829 -0.699 18000 344 1 2 . 1 1 21 21 GLY CB C 220 29.290 29.290 30.345 -1.055 18000 345 1 2 . 1 1 21 21 GLY H H 220 7.640 7.640 7.677 -0.037 18000 346 1 2 . 1 1 22 22 ILE N N 221 119.940 119.940 117.545 2.395 18000 347 1 2 . 1 1 22 22 ILE HA H 221 3.290 3.290 3.915 -0.625 18000 348 1 2 . 1 1 22 22 ILE C C 221 175.100 175.100 173.556 1.544 18000 349 1 2 . 1 1 22 22 ILE CA C 221 64.070 64.070 62.383 1.687 18000 350 1 2 . 1 1 22 22 ILE CB C 221 35.260 35.260 36.289 -1.029 18000 351 1 2 . 1 1 22 22 ILE H H 221 8.130 8.130 7.509 0.621 18000 352 1 2 . 1 1 23 23 LYS HA H 222 3.430 3.430 4.315 -0.885 18000 353 1 2 . 1 1 23 23 LYS C C 222 175.280 175.280 175.096 0.184 18000 354 1 2 . 1 1 23 23 LYS CA C 222 59.270 59.270 56.798 2.472 18000 355 1 2 . 1 1 23 23 LYS CB C 222 30.670 30.670 31.599 -0.929 18000 356 1 2 . 1 1 24 24 GLU N N 223 116.150 116.150 121.242 -5.092 18000 357 1 2 . 1 1 24 24 GLU HA H 223 4.150 4.150 4.519 -0.369 18000 358 1 2 . 1 1 24 24 GLU C C 223 177.330 177.330 176.419 0.911 18000 359 1 2 . 1 1 24 24 GLU CA C 223 57.180 57.180 54.912 2.268 18000 360 1 2 . 1 1 24 24 GLU CB C 223 27.670 27.670 31.156 -3.486 18000 361 1 2 . 1 1 24 24 GLU H H 223 7.830 7.830 8.160 -0.330 18000 362 1 2 . 1 1 25 25 TYR N N 224 119.760 119.760 124.361 -4.601 18000 363 1 2 . 1 1 25 25 TYR HA H 224 4.480 4.480 4.423 0.057 18000 364 1 2 . 1 1 25 25 TYR C C 224 175.680 175.680 175.908 -0.228 18000 365 1 2 . 1 1 25 25 TYR CA C 224 57.520 57.520 58.072 -0.552 18000 366 1 2 . 1 1 25 25 TYR CB C 224 36.940 36.940 39.247 -2.307 18000 367 1 2 . 1 1 25 25 TYR H H 224 8.630 8.630 8.562 0.068 18000 368 1 2 . 1 1 26 26 PHE N N 225 120.090 120.090 127.097 -7.007 18000 369 1 2 . 1 1 26 26 PHE HA H 225 3.410 3.410 4.312 -0.902 18000 370 1 2 . 1 1 26 26 PHE C C 225 173.930 173.930 174.839 -0.909 18000 371 1 2 . 1 1 26 26 PHE CA C 225 61.600 61.600 59.046 2.554 18000 372 1 2 . 1 1 26 26 PHE CB C 225 36.590 36.590 38.862 -2.272 18000 373 1 2 . 1 1 26 26 PHE H H 225 9.220 9.220 8.676 0.544 18000 374 1 2 . 1 1 27 27 ASN N N 226 115.010 115.010 123.397 -8.387 18000 375 1 2 . 1 1 27 27 ASN HA H 226 4.470 4.470 4.829 -0.359 18000 376 1 2 . 1 1 27 27 ASN C C 226 176.630 176.630 173.743 2.887 18000 377 1 2 . 1 1 27 27 ASN CA C 226 54.160 54.160 50.936 3.224 18000 378 1 2 . 1 1 27 27 ASN CB C 226 35.800 35.800 41.031 -5.231 18000 379 1 2 . 1 1 27 27 ASN H H 226 8.210 8.210 8.227 -0.017 18000 380 1 2 . 1 1 28 28 VAL N N 227 115.120 115.120 122.750 -7.630 18000 381 1 2 . 1 1 28 28 VAL HA H 227 4.300 4.300 4.375 -0.075 18000 382 1 2 . 1 1 28 28 VAL C C 227 174.960 174.960 174.640 0.320 18000 383 1 2 . 1 1 28 28 VAL CA C 227 61.320 61.320 59.109 2.211 18000 384 1 2 . 1 1 28 28 VAL CB C 227 30.670 30.670 31.729 -1.059 18000 385 1 2 . 1 1 28 28 VAL H H 227 7.430 7.430 8.031 -0.601 18000 386 1 2 . 1 1 29 29 MET HA H 228 4.000 4.000 4.468 -0.468 18000 387 1 2 . 1 1 29 29 MET C C 228 176.270 176.270 175.762 0.508 18000 388 1 2 . 1 1 29 29 MET CA C 228 54.030 54.030 55.471 -1.440 18000 389 1 2 . 1 1 29 29 MET CB C 228 31.510 31.510 33.708 -2.198 18000 390 1 2 . 1 1 30 30 LEU N N 229 122.180 122.180 121.747 0.433 18000 391 1 2 . 1 1 30 30 LEU HA H 229 3.150 3.150 4.069 -0.919 18000 392 1 2 . 1 1 30 30 LEU C C 229 176.070 176.070 177.076 -1.006 18000 393 1 2 . 1 1 30 30 LEU CA C 229 55.860 55.860 57.203 -1.343 18000 394 1 2 . 1 1 30 30 LEU CB C 229 36.340 36.340 41.822 -5.482 18000 395 1 2 . 1 1 30 30 LEU H H 229 7.890 7.890 8.463 -0.573 18000 396 1 2 . 1 1 31 31 GLY N N 230 118.390 118.390 106.209 12.181 18000 397 1 2 . 1 1 31 31 GLY HA H 230 4.090 4.090 4.219 -0.129 18000 398 1 2 . 1 1 31 31 GLY C C 230 173.070 173.070 175.061 -1.991 18000 399 1 2 . 1 1 31 31 GLY CA C 230 43.150 43.150 45.701 -2.551 18000 400 1 2 . 1 1 31 31 GLY CB C 230 26.780 26.780 29.181 -2.401 18000 401 1 2 . 1 1 31 31 GLY H H 230 8.350 8.350 8.358 -0.008 18000 402 1 2 . 1 1 32 32 THR N N 231 124.790 124.790 112.966 11.824 18000 403 1 2 . 1 1 32 32 THR HA H 231 4.280 4.280 4.471 -0.191 18000 404 1 2 . 1 1 32 32 THR C C 231 173.260 173.260 176.364 -3.104 18000 405 1 2 . 1 1 32 32 THR CA C 231 60.030 60.030 63.522 -3.492 18000 406 1 2 . 1 1 32 32 THR CB C 231 68.540 68.540 70.461 -1.921 18000 407 1 2 . 1 1 32 32 THR H H 231 7.040 7.040 7.691 -0.651 18000 408 1 2 . 1 1 33 33 GLN N N 232 114.740 114.740 116.641 -1.901 18000 409 1 2 . 1 1 33 33 GLN HA H 232 5.090 5.090 4.315 0.775 18000 410 1 2 . 1 1 33 33 GLN C C 232 175.790 175.790 175.396 0.394 18000 411 1 2 . 1 1 33 33 GLN CA C 232 53.650 53.650 56.569 -2.920 18000 412 1 2 . 1 1 33 33 GLN CB C 232 30.520 30.520 30.920 -0.400 18000 413 1 2 . 1 1 33 33 GLN H H 232 8.110 8.110 8.139 -0.029 18000 414 1 2 . 1 1 34 34 LEU N N 233 112.480 112.480 125.637 -13.157 18000 415 1 2 . 1 1 34 34 LEU HA H 233 4.460 4.460 4.056 0.404 18000 416 1 2 . 1 1 34 34 LEU C C 233 172.610 172.610 175.759 -3.149 18000 417 1 2 . 1 1 34 34 LEU CA C 233 52.460 52.460 55.669 -3.209 18000 418 1 2 . 1 1 34 34 LEU CB C 233 39.140 39.140 41.119 -1.979 18000 419 1 2 . 1 1 34 34 LEU H H 233 6.980 6.980 8.150 -1.170 18000 420 1 2 . 1 1 35 35 LEU N N 234 115.860 115.860 127.974 -12.114 18000 421 1 2 . 1 1 35 35 LEU HA H 234 4.510 4.510 4.379 0.131 18000 422 1 2 . 1 1 35 35 LEU C C 234 178.330 178.330 177.113 1.217 18000 423 1 2 . 1 1 35 35 LEU CA C 234 51.900 51.900 54.571 -2.671 18000 424 1 2 . 1 1 35 35 LEU CB C 234 40.950 40.950 42.244 -1.294 18000 425 1 2 . 1 1 35 35 LEU H H 234 7.560 7.560 8.137 -0.577 18000 426 1 2 . 1 1 36 36 TYR N N 235 125.850 125.850 124.774 1.076 18000 427 1 2 . 1 1 36 36 TYR HA H 235 4.790 4.790 4.251 0.539 18000 428 1 2 . 1 1 36 36 TYR C C 235 176.260 176.260 175.072 1.188 18000 429 1 2 . 1 1 36 36 TYR CA C 235 57.750 57.750 59.124 -1.374 18000 430 1 2 . 1 1 36 36 TYR CB C 235 37.100 37.100 37.942 -0.842 18000 431 1 2 . 1 1 36 36 TYR H H 235 9.750 9.750 8.430 1.320 18000 432 1 2 . 1 1 37 37 LYS N N 236 123.880 123.880 126.864 -2.984 18000 433 1 2 . 1 1 37 37 LYS HA H 236 3.930 3.930 4.397 -0.467 18000 434 1 2 . 1 1 37 37 LYS C C 236 178.280 178.280 174.795 3.485 18000 435 1 2 . 1 1 37 37 LYS CA C 236 59.210 59.210 55.882 3.328 18000 436 1 2 . 1 1 37 37 LYS CB C 236 30.430 30.430 33.979 -3.549 18000 437 1 2 . 1 1 37 37 LYS H H 236 9.340 9.340 7.978 1.362 18000 438 1 2 . 1 1 38 38 PHE N N 237 117.150 117.150 117.666 -0.516 18000 439 1 2 . 1 1 38 38 PHE HA H 237 4.460 4.460 4.339 0.121 18000 440 1 2 . 1 1 38 38 PHE C C 237 173.930 173.930 173.838 0.092 18000 441 1 2 . 1 1 38 38 PHE CA C 237 58.510 58.510 57.192 1.318 18000 442 1 2 . 1 1 38 38 PHE CB C 237 38.370 38.370 38.120 0.250 18000 443 1 2 . 1 1 38 38 PHE H H 237 9.120 9.120 8.281 0.839 18000 444 1 2 . 1 1 39 39 GLU HA H 238 4.160 4.160 4.210 -0.050 18000 445 1 2 . 1 1 39 39 GLU C C 238 175.650 175.650 176.223 -0.573 18000 446 1 2 . 1 1 39 39 GLU CA C 238 55.070 55.070 56.973 -1.903 18000 447 1 2 . 1 1 39 39 GLU CB C 238 31.540 31.540 30.107 1.433 18000 448 1 2 . 1 1 40 40 ARG N N 239 120.330 120.330 124.131 -3.801 18000 449 1 2 . 1 1 40 40 ARG HA H 239 4.250 4.250 4.369 -0.119 18000 450 1 2 . 1 1 40 40 ARG C C 239 174.490 174.490 174.809 -0.319 18000 451 1 2 . 1 1 40 40 ARG CA C 239 60.410 60.410 55.861 4.549 18000 452 1 2 . 1 1 40 40 ARG H H 239 7.980 7.980 8.320 -0.340 18000 453 1 2 . 1 1 41 41 PRO N N 240 115.390 115.390 116.756 -1.366 18000 454 1 2 . 1 1 41 41 PRO HA H 240 4.360 4.360 4.695 -0.335 18000 455 1 2 . 1 1 41 41 PRO C C 240 176.330 176.330 176.476 -0.146 18000 456 1 2 . 1 1 41 41 PRO CA C 240 64.400 64.400 63.370 1.030 18000 457 1 2 . 1 1 41 41 PRO CB C 240 62.240 62.240 62.860 -0.620 18000 458 1 2 . 1 1 41 41 PRO H H 240 8.090 8.090 8.496 -0.406 18000 459 1 3 . 1 1 2 2 ARG N N 201 119.330 119.330 123.396 -4.066 18000 460 1 3 . 1 1 2 2 ARG HA H 201 3.560 3.560 4.688 -1.128 18000 461 1 3 . 1 1 2 2 ARG C C 201 176.850 176.850 175.127 1.723 18000 462 1 3 . 1 1 2 2 ARG CA C 201 55.340 55.340 55.633 -0.293 18000 463 1 3 . 1 1 2 2 ARG CB C 201 27.020 27.020 32.014 -4.994 18000 464 1 3 . 1 1 2 2 ARG H H 201 8.370 8.370 8.115 0.255 18000 465 1 3 . 1 1 3 3 LYS N N 202 118.540 118.540 128.736 -10.196 18000 466 1 3 . 1 1 3 3 LYS HA H 202 4.010 4.010 4.229 -0.219 18000 467 1 3 . 1 1 3 3 LYS C C 202 176.090 176.090 175.635 0.455 18000 468 1 3 . 1 1 3 3 LYS CA C 202 56.960 56.960 55.513 1.448 18000 469 1 3 . 1 1 3 3 LYS CB C 202 30.590 30.590 32.484 -1.894 18000 470 1 3 . 1 1 3 3 LYS H H 202 7.940 7.940 8.007 -0.067 18000 471 1 3 . 1 1 4 4 SER N N 203 113.880 113.880 123.831 -9.951 18000 472 1 3 . 1 1 4 4 SER HA H 203 4.320 4.320 4.691 -0.371 18000 473 1 3 . 1 1 4 4 SER C C 203 172.900 172.900 172.832 0.068 18000 474 1 3 . 1 1 4 4 SER CA C 203 57.870 57.870 55.514 2.356 18000 475 1 3 . 1 1 4 4 SER CB C 203 61.700 61.700 62.316 -0.616 18000 476 1 3 . 1 1 4 4 SER H H 203 7.700 7.700 8.296 -0.596 18000 477 1 3 . 1 1 5 5 ARG HA H 204 4.240 4.240 4.338 -0.098 18000 478 1 3 . 1 1 5 5 ARG C C 204 174.810 174.810 175.294 -0.484 18000 479 1 3 . 1 1 5 5 ARG CA C 204 54.270 54.270 56.213 -1.943 18000 480 1 3 . 1 1 5 5 ARG CB C 204 28.700 28.700 30.479 -1.779 18000 481 1 3 . 1 1 6 6 GLY N N 205 125.950 125.950 111.459 14.491 18000 482 1 3 . 1 1 6 6 GLY HA H 205 4.400 4.400 4.394 0.006 18000 483 1 3 . 1 1 6 6 GLY C C 205 171.910 171.910 174.712 -2.802 18000 484 1 3 . 1 1 6 6 GLY CA C 205 43.570 43.570 44.170 -0.600 18000 485 1 3 . 1 1 6 6 GLY CB C 205 28.340 28.340 30.046 -1.706 18000 486 1 3 . 1 1 6 6 GLY H H 205 7.930 7.930 8.413 -0.483 18000 487 1 3 . 1 1 7 7 ASN N N 206 118.380 118.380 120.692 -2.312 18000 488 1 3 . 1 1 7 7 ASN HA H 206 4.760 4.760 4.681 0.079 18000 489 1 3 . 1 1 7 7 ASN C C 206 173.810 173.810 177.548 -3.738 18000 490 1 3 . 1 1 7 7 ASN CA C 206 51.430 51.430 54.394 -2.963 18000 491 1 3 . 1 1 7 7 ASN CB C 206 37.090 37.090 37.977 -0.887 18000 492 1 3 . 1 1 7 7 ASN H H 206 8.330 8.330 8.714 -0.384 18000 493 1 3 . 1 1 8 8 THR N N 207 119.850 119.850 121.406 -1.556 18000 494 1 3 . 1 1 8 8 THR HA H 207 4.270 4.270 4.202 0.068 18000 495 1 3 . 1 1 8 8 THR C C 207 172.560 172.560 176.836 -4.276 18000 496 1 3 . 1 1 8 8 THR CA C 207 60.420 60.420 65.398 -4.978 18000 497 1 3 . 1 1 8 8 THR CB C 207 67.750 67.750 68.090 -0.340 18000 498 1 3 . 1 1 8 8 THR H H 207 7.830 7.830 8.544 -0.714 18000 499 1 3 . 1 1 9 9 ASP N N 208 121.180 121.180 117.953 3.227 18000 500 1 3 . 1 1 9 9 ASP HA H 208 4.550 4.550 4.643 -0.093 18000 501 1 3 . 1 1 9 9 ASP C C 208 174.170 174.170 176.823 -2.653 18000 502 1 3 . 1 1 9 9 ASP CA C 208 52.670 52.670 58.671 -6.001 18000 503 1 3 . 1 1 9 9 ASP CB C 208 39.120 39.120 37.959 1.161 18000 504 1 3 . 1 1 9 9 ASP H H 208 8.350 8.350 8.883 -0.533 18000 505 1 3 . 1 1 10 10 ASN HA H 209 4.600 4.600 4.483 0.117 18000 506 1 3 . 1 1 10 10 ASN C C 209 173.670 173.670 177.482 -3.812 18000 507 1 3 . 1 1 10 10 ASN CA C 209 52.110 52.110 56.176 -4.066 18000 508 1 3 . 1 1 10 10 ASN CB C 209 36.730 36.730 37.974 -1.244 18000 509 1 3 . 1 1 11 11 LYS N N 210 120.380 120.380 117.674 2.706 18000 510 1 3 . 1 1 11 11 LYS HA H 210 4.270 4.270 4.019 0.251 18000 511 1 3 . 1 1 11 11 LYS C C 210 174.910 174.910 178.945 -4.035 18000 512 1 3 . 1 1 11 11 LYS CA C 210 54.900 54.900 60.099 -5.199 18000 513 1 3 . 1 1 11 11 LYS CB C 210 30.670 30.670 32.075 -1.405 18000 514 1 3 . 1 1 11 11 LYS H H 210 8.210 8.210 8.592 -0.382 18000 515 1 3 . 1 1 12 12 GLU N N 211 120.740 120.740 120.156 0.584 18000 516 1 3 . 1 1 12 12 GLU HA H 211 4.070 4.070 4.041 0.029 18000 517 1 3 . 1 1 12 12 GLU C C 211 174.810 174.810 179.635 -4.825 18000 518 1 3 . 1 1 12 12 GLU CA C 211 55.940 55.940 59.910 -3.970 18000 519 1 3 . 1 1 12 12 GLU CB C 211 27.700 27.700 29.302 -1.601 18000 520 1 3 . 1 1 12 12 GLU H H 211 8.380 8.380 8.531 -0.151 18000 521 1 3 . 1 1 13 13 TYR N N 212 119.430 119.430 119.249 0.181 18000 522 1 3 . 1 1 13 13 TYR HA H 212 4.380 4.380 4.253 0.127 18000 523 1 3 . 1 1 13 13 TYR C C 212 174.830 174.830 178.370 -3.540 18000 524 1 3 . 1 1 13 13 TYR CA C 212 57.420 57.420 60.989 -3.569 18000 525 1 3 . 1 1 13 13 TYR CB C 212 36.530 36.530 38.190 -1.660 18000 526 1 3 . 1 1 13 13 TYR H H 212 7.940 7.940 8.659 -0.719 18000 527 1 3 . 1 1 14 14 ALA N N 213 121.810 121.810 120.599 1.211 18000 528 1 3 . 1 1 14 14 ALA HA H 213 4.260 4.260 4.031 0.229 18000 529 1 3 . 1 1 14 14 ALA C C 213 176.630 176.630 179.689 -3.059 18000 530 1 3 . 1 1 14 14 ALA CA C 213 51.990 51.990 55.334 -3.344 18000 531 1 3 . 1 1 14 14 ALA CB C 213 16.450 16.450 18.804 -2.354 18000 532 1 3 . 1 1 14 14 ALA H H 213 7.920 7.920 8.223 -0.303 18000 533 1 3 . 1 1 15 15 VAL N N 214 121.430 121.430 119.128 2.302 18000 534 1 3 . 1 1 15 15 VAL HA H 214 3.470 3.470 3.545 -0.075 18000 535 1 3 . 1 1 15 15 VAL C C 214 174.980 174.980 177.704 -2.724 18000 536 1 3 . 1 1 15 15 VAL CA C 214 64.190 64.190 66.538 -2.348 18000 537 1 3 . 1 1 15 15 VAL CB C 214 29.820 29.820 31.316 -1.496 18000 538 1 3 . 1 1 15 15 VAL H H 214 8.680 8.680 8.762 -0.082 18000 539 1 3 . 1 1 16 16 ASN N N 215 117.460 117.460 118.179 -0.719 18000 540 1 3 . 1 1 16 16 ASN HA H 215 4.300 4.300 4.408 -0.108 18000 541 1 3 . 1 1 16 16 ASN C C 215 176.320 176.320 177.372 -1.052 18000 542 1 3 . 1 1 16 16 ASN CA C 215 54.190 54.190 55.956 -1.766 18000 543 1 3 . 1 1 16 16 ASN CB C 215 35.360 35.360 37.612 -2.252 18000 544 1 3 . 1 1 16 16 ASN H H 215 8.190 8.190 8.129 0.061 18000 545 1 3 . 1 1 17 17 GLU N N 216 119.430 119.430 117.516 1.914 18000 546 1 3 . 1 1 17 17 GLU HA H 216 4.000 4.000 4.113 -0.113 18000 547 1 3 . 1 1 17 17 GLU C C 216 177.240 177.240 178.392 -1.152 18000 548 1 3 . 1 1 17 17 GLU CA C 216 57.180 57.180 58.933 -1.753 18000 549 1 3 . 1 1 17 17 GLU CB C 216 28.400 28.400 29.151 -0.751 18000 550 1 3 . 1 1 17 17 GLU H H 216 7.730 7.730 8.331 -0.601 18000 551 1 3 . 1 1 18 18 VAL N N 217 120.690 120.690 117.718 2.972 18000 552 1 3 . 1 1 18 18 VAL HA H 217 3.530 3.530 3.912 -0.382 18000 553 1 3 . 1 1 18 18 VAL C C 217 174.990 174.990 178.661 -3.671 18000 554 1 3 . 1 1 18 18 VAL CA C 217 64.310 64.310 64.838 -0.528 18000 555 1 3 . 1 1 18 18 VAL CB C 217 29.640 29.640 31.211 -1.571 18000 556 1 3 . 1 1 18 18 VAL H H 217 7.820 7.820 7.967 -0.147 18000 557 1 3 . 1 1 19 19 VAL N N 218 117.010 117.010 115.756 1.254 18000 558 1 3 . 1 1 19 19 VAL HA H 218 3.500 3.500 3.868 -0.368 18000 559 1 3 . 1 1 19 19 VAL C C 218 175.200 175.200 176.512 -1.312 18000 560 1 3 . 1 1 19 19 VAL CA C 218 64.960 64.960 64.957 0.003 18000 561 1 3 . 1 1 19 19 VAL CB C 218 29.710 29.710 31.873 -2.163 18000 562 1 3 . 1 1 19 19 VAL H H 218 8.260 8.260 7.641 0.619 18000 563 1 3 . 1 1 20 20 ALA N N 219 120.360 120.360 117.994 2.366 18000 564 1 3 . 1 1 20 20 ALA HA H 219 3.930 3.930 4.209 -0.279 18000 565 1 3 . 1 1 20 20 ALA C C 219 178.310 178.310 177.790 0.520 18000 566 1 3 . 1 1 20 20 ALA CA C 219 53.040 53.040 52.451 0.589 18000 567 1 3 . 1 1 20 20 ALA CB C 219 16.280 16.280 18.785 -2.505 18000 568 1 3 . 1 1 20 20 ALA H H 219 7.490 7.490 7.308 0.182 18000 569 1 3 . 1 1 21 21 GLY N N 220 124.250 124.250 108.858 15.392 18000 570 1 3 . 1 1 21 21 GLY HA H 220 4.250 4.250 4.306 -0.056 18000 571 1 3 . 1 1 21 21 GLY C C 220 172.880 172.880 174.892 -2.012 18000 572 1 3 . 1 1 21 21 GLY CA C 220 44.130 44.130 44.164 -0.034 18000 573 1 3 . 1 1 21 21 GLY CB C 220 29.290 29.290 29.113 0.177 18000 574 1 3 . 1 1 21 21 GLY H H 220 7.640 7.640 7.373 0.267 18000 575 1 3 . 1 1 22 22 ILE N N 221 119.940 119.940 126.326 -6.386 18000 576 1 3 . 1 1 22 22 ILE HA H 221 3.290 3.290 4.270 -0.980 18000 577 1 3 . 1 1 22 22 ILE C C 221 175.100 175.100 174.471 0.629 18000 578 1 3 . 1 1 22 22 ILE CA C 221 64.070 64.070 60.312 3.758 18000 579 1 3 . 1 1 22 22 ILE CB C 221 35.260 35.260 38.419 -3.159 18000 580 1 3 . 1 1 22 22 ILE H H 221 8.130 8.130 8.017 0.113 18000 581 1 3 . 1 1 23 23 LYS HA H 222 3.430 3.430 4.222 -0.792 18000 582 1 3 . 1 1 23 23 LYS C C 222 175.280 175.280 175.183 0.097 18000 583 1 3 . 1 1 23 23 LYS CA C 222 59.270 59.270 57.201 2.069 18000 584 1 3 . 1 1 23 23 LYS CB C 222 30.670 30.670 31.848 -1.178 18000 585 1 3 . 1 1 24 24 GLU N N 223 116.150 116.150 122.757 -6.607 18000 586 1 3 . 1 1 24 24 GLU HA H 223 4.150 4.150 4.499 -0.349 18000 587 1 3 . 1 1 24 24 GLU C C 223 177.330 177.330 176.037 1.293 18000 588 1 3 . 1 1 24 24 GLU CA C 223 57.180 57.180 55.069 2.111 18000 589 1 3 . 1 1 24 24 GLU CB C 223 27.670 27.670 30.776 -3.107 18000 590 1 3 . 1 1 24 24 GLU H H 223 7.830 7.830 8.139 -0.309 18000 591 1 3 . 1 1 25 25 TYR N N 224 119.760 119.760 124.388 -4.628 18000 592 1 3 . 1 1 25 25 TYR HA H 224 4.480 4.480 4.529 -0.049 18000 593 1 3 . 1 1 25 25 TYR C C 224 175.680 175.680 175.081 0.599 18000 594 1 3 . 1 1 25 25 TYR CA C 224 57.520 57.520 57.733 -0.213 18000 595 1 3 . 1 1 25 25 TYR CB C 224 36.940 36.940 38.962 -2.022 18000 596 1 3 . 1 1 25 25 TYR H H 224 8.630 8.630 8.614 0.016 18000 597 1 3 . 1 1 26 26 PHE N N 225 120.090 120.090 127.474 -7.384 18000 598 1 3 . 1 1 26 26 PHE HA H 225 3.410 3.410 4.332 -0.922 18000 599 1 3 . 1 1 26 26 PHE C C 225 173.930 173.930 174.409 -0.479 18000 600 1 3 . 1 1 26 26 PHE CA C 225 61.600 61.600 58.448 3.152 18000 601 1 3 . 1 1 26 26 PHE CB C 225 36.590 36.590 39.277 -2.687 18000 602 1 3 . 1 1 26 26 PHE H H 225 9.220 9.220 8.686 0.534 18000 603 1 3 . 1 1 27 27 ASN N N 226 115.010 115.010 123.999 -8.989 18000 604 1 3 . 1 1 27 27 ASN HA H 226 4.470 4.470 4.553 -0.083 18000 605 1 3 . 1 1 27 27 ASN C C 226 176.630 176.630 173.222 3.408 18000 606 1 3 . 1 1 27 27 ASN CA C 226 54.160 54.160 51.481 2.679 18000 607 1 3 . 1 1 27 27 ASN CB C 226 35.800 35.800 40.850 -5.050 18000 608 1 3 . 1 1 27 27 ASN H H 226 8.210 8.210 8.005 0.205 18000 609 1 3 . 1 1 28 28 VAL N N 227 115.120 115.120 120.958 -5.838 18000 610 1 3 . 1 1 28 28 VAL HA H 227 4.300 4.300 4.424 -0.124 18000 611 1 3 . 1 1 28 28 VAL C C 227 174.960 174.960 174.742 0.218 18000 612 1 3 . 1 1 28 28 VAL CA C 227 61.320 61.320 59.485 1.835 18000 613 1 3 . 1 1 28 28 VAL CB C 227 30.670 30.670 31.406 -0.736 18000 614 1 3 . 1 1 28 28 VAL H H 227 7.430 7.430 8.240 -0.810 18000 615 1 3 . 1 1 29 29 MET HA H 228 4.000 4.000 4.505 -0.505 18000 616 1 3 . 1 1 29 29 MET C C 228 176.270 176.270 176.739 -0.469 18000 617 1 3 . 1 1 29 29 MET CA C 228 54.030 54.030 55.327 -1.297 18000 618 1 3 . 1 1 29 29 MET CB C 228 31.510 31.510 33.146 -1.636 18000 619 1 3 . 1 1 30 30 LEU N N 229 122.180 122.180 121.644 0.536 18000 620 1 3 . 1 1 30 30 LEU HA H 229 3.150 3.150 3.971 -0.821 18000 621 1 3 . 1 1 30 30 LEU C C 229 176.070 176.070 178.241 -2.171 18000 622 1 3 . 1 1 30 30 LEU CA C 229 55.860 55.860 57.269 -1.409 18000 623 1 3 . 1 1 30 30 LEU CB C 229 36.340 36.340 41.909 -5.569 18000 624 1 3 . 1 1 30 30 LEU H H 229 7.890 7.890 8.492 -0.602 18000 625 1 3 . 1 1 31 31 GLY N N 230 118.390 118.390 106.372 12.018 18000 626 1 3 . 1 1 31 31 GLY HA H 230 4.090 4.090 4.132 -0.042 18000 627 1 3 . 1 1 31 31 GLY C C 230 173.070 173.070 175.110 -2.040 18000 628 1 3 . 1 1 31 31 GLY CA C 230 43.150 43.150 46.955 -3.805 18000 629 1 3 . 1 1 31 31 GLY CB C 230 26.780 26.780 29.007 -2.227 18000 630 1 3 . 1 1 31 31 GLY H H 230 8.350 8.350 8.311 0.039 18000 631 1 3 . 1 1 32 32 THR N N 231 124.790 124.790 113.676 11.114 18000 632 1 3 . 1 1 32 32 THR HA H 231 4.280 4.280 4.455 -0.175 18000 633 1 3 . 1 1 32 32 THR C C 231 173.260 173.260 176.229 -2.969 18000 634 1 3 . 1 1 32 32 THR CA C 231 60.030 60.030 63.443 -3.413 18000 635 1 3 . 1 1 32 32 THR CB C 231 68.540 68.540 69.958 -1.418 18000 636 1 3 . 1 1 32 32 THR H H 231 7.040 7.040 7.723 -0.683 18000 637 1 3 . 1 1 33 33 GLN N N 232 114.740 114.740 116.757 -2.017 18000 638 1 3 . 1 1 33 33 GLN HA H 232 5.090 5.090 4.414 0.676 18000 639 1 3 . 1 1 33 33 GLN C C 232 175.790 175.790 175.392 0.398 18000 640 1 3 . 1 1 33 33 GLN CA C 232 53.650 53.650 54.954 -1.304 18000 641 1 3 . 1 1 33 33 GLN CB C 232 30.520 30.520 30.260 0.260 18000 642 1 3 . 1 1 33 33 GLN H H 232 8.110 8.110 8.399 -0.289 18000 643 1 3 . 1 1 34 34 LEU N N 233 112.480 112.480 119.317 -6.837 18000 644 1 3 . 1 1 34 34 LEU HA H 233 4.460 4.460 4.759 -0.299 18000 645 1 3 . 1 1 34 34 LEU C C 233 172.610 172.610 177.192 -4.582 18000 646 1 3 . 1 1 34 34 LEU CA C 233 52.460 52.460 54.321 -1.861 18000 647 1 3 . 1 1 34 34 LEU CB C 233 39.140 39.140 44.559 -5.419 18000 648 1 3 . 1 1 34 34 LEU H H 233 6.980 6.980 8.420 -1.440 18000 649 1 3 . 1 1 35 35 LEU N N 234 115.860 115.860 122.365 -6.505 18000 650 1 3 . 1 1 35 35 LEU HA H 234 4.510 4.510 4.224 0.286 18000 651 1 3 . 1 1 35 35 LEU C C 234 178.330 178.330 177.788 0.542 18000 652 1 3 . 1 1 35 35 LEU CA C 234 51.900 51.900 57.544 -5.644 18000 653 1 3 . 1 1 35 35 LEU CB C 234 40.950 40.950 42.475 -1.526 18000 654 1 3 . 1 1 35 35 LEU H H 234 7.560 7.560 7.812 -0.252 18000 655 1 3 . 1 1 36 36 TYR N N 235 125.850 125.850 123.488 2.362 18000 656 1 3 . 1 1 36 36 TYR HA H 235 4.790 4.790 4.500 0.290 18000 657 1 3 . 1 1 36 36 TYR C C 235 176.260 176.260 174.769 1.491 18000 658 1 3 . 1 1 36 36 TYR CA C 235 57.750 57.750 57.725 0.025 18000 659 1 3 . 1 1 36 36 TYR CB C 235 37.100 37.100 37.544 -0.444 18000 660 1 3 . 1 1 36 36 TYR H H 235 9.750 9.750 7.606 2.144 18000 661 1 3 . 1 1 37 37 LYS N N 236 123.880 123.880 126.293 -2.413 18000 662 1 3 . 1 1 37 37 LYS HA H 236 3.930 3.930 4.538 -0.608 18000 663 1 3 . 1 1 37 37 LYS C C 236 178.280 178.280 176.038 2.242 18000 664 1 3 . 1 1 37 37 LYS CA C 236 59.210 59.210 55.681 3.529 18000 665 1 3 . 1 1 37 37 LYS CB C 236 30.430 30.430 33.331 -2.901 18000 666 1 3 . 1 1 37 37 LYS H H 236 9.340 9.340 7.884 1.456 18000 667 1 3 . 1 1 38 38 PHE N N 237 117.150 117.150 122.694 -5.544 18000 668 1 3 . 1 1 38 38 PHE HA H 237 4.460 4.460 4.721 -0.261 18000 669 1 3 . 1 1 38 38 PHE C C 237 173.930 173.930 175.509 -1.579 18000 670 1 3 . 1 1 38 38 PHE CA C 237 58.510 58.510 56.608 1.902 18000 671 1 3 . 1 1 38 38 PHE CB C 237 38.370 38.370 38.804 -0.434 18000 672 1 3 . 1 1 38 38 PHE H H 237 9.120 9.120 8.624 0.496 18000 673 1 3 . 1 1 39 39 GLU HA H 238 4.160 4.160 4.312 -0.152 18000 674 1 3 . 1 1 39 39 GLU C C 238 175.650 175.650 176.231 -0.581 18000 675 1 3 . 1 1 39 39 GLU CA C 238 55.070 55.070 57.113 -2.043 18000 676 1 3 . 1 1 39 39 GLU CB C 238 31.540 31.540 30.314 1.226 18000 677 1 3 . 1 1 40 40 ARG N N 239 120.330 120.330 119.596 0.734 18000 678 1 3 . 1 1 40 40 ARG HA H 239 4.250 4.250 4.323 -0.073 18000 679 1 3 . 1 1 40 40 ARG C C 239 174.490 174.490 175.787 -1.297 18000 680 1 3 . 1 1 40 40 ARG CA C 239 60.410 60.410 56.947 3.463 18000 681 1 3 . 1 1 40 40 ARG H H 239 7.980 7.980 8.090 -0.110 18000 682 1 3 . 1 1 41 41 PRO N N 240 115.390 115.390 114.460 0.930 18000 683 1 3 . 1 1 41 41 PRO HA H 240 4.360 4.360 4.226 0.134 18000 684 1 3 . 1 1 41 41 PRO C C 240 176.330 176.330 176.967 -0.637 18000 685 1 3 . 1 1 41 41 PRO CA C 240 64.400 64.400 64.802 -0.402 18000 686 1 3 . 1 1 41 41 PRO CB C 240 62.240 62.240 62.010 0.230 18000 687 1 3 . 1 1 41 41 PRO H H 240 8.090 8.090 8.503 -0.413 18000 688 1 4 . 1 1 2 2 ARG N N 201 119.330 119.330 119.870 -0.540 18000 689 1 4 . 1 1 2 2 ARG HA H 201 3.560 3.560 4.746 -1.186 18000 690 1 4 . 1 1 2 2 ARG C C 201 176.850 176.850 175.124 1.726 18000 691 1 4 . 1 1 2 2 ARG CA C 201 55.340 55.340 55.435 -0.095 18000 692 1 4 . 1 1 2 2 ARG CB C 201 27.020 27.020 31.830 -4.810 18000 693 1 4 . 1 1 2 2 ARG H H 201 8.370 8.370 8.088 0.282 18000 694 1 4 . 1 1 3 3 LYS N N 202 118.540 118.540 126.918 -8.378 18000 695 1 4 . 1 1 3 3 LYS HA H 202 4.010 4.010 4.230 -0.220 18000 696 1 4 . 1 1 3 3 LYS C C 202 176.090 176.090 175.939 0.151 18000 697 1 4 . 1 1 3 3 LYS CA C 202 56.960 56.960 56.248 0.712 18000 698 1 4 . 1 1 3 3 LYS CB C 202 30.590 30.590 31.297 -0.707 18000 699 1 4 . 1 1 3 3 LYS H H 202 7.940 7.940 8.494 -0.554 18000 700 1 4 . 1 1 4 4 SER N N 203 113.880 113.880 117.553 -3.673 18000 701 1 4 . 1 1 4 4 SER HA H 203 4.320 4.320 4.415 -0.095 18000 702 1 4 . 1 1 4 4 SER C C 203 172.900 172.900 172.387 0.513 18000 703 1 4 . 1 1 4 4 SER CA C 203 57.870 57.870 58.365 -0.495 18000 704 1 4 . 1 1 4 4 SER CB C 203 61.700 61.700 62.248 -0.548 18000 705 1 4 . 1 1 4 4 SER H H 203 7.700 7.700 7.850 -0.150 18000 706 1 4 . 1 1 5 5 ARG HA H 204 4.240 4.240 4.244 -0.004 18000 707 1 4 . 1 1 5 5 ARG C C 204 174.810 174.810 175.106 -0.296 18000 708 1 4 . 1 1 5 5 ARG CA C 204 54.270 54.270 55.798 -1.528 18000 709 1 4 . 1 1 5 5 ARG CB C 204 28.700 28.700 31.020 -2.320 18000 710 1 4 . 1 1 6 6 GLY N N 205 125.950 125.950 108.556 17.394 18000 711 1 4 . 1 1 6 6 GLY HA H 205 4.400 4.400 4.485 -0.085 18000 712 1 4 . 1 1 6 6 GLY C C 205 171.910 171.910 175.625 -3.715 18000 713 1 4 . 1 1 6 6 GLY CA C 205 43.570 43.570 44.683 -1.113 18000 714 1 4 . 1 1 6 6 GLY CB C 205 28.340 28.340 29.088 -0.748 18000 715 1 4 . 1 1 6 6 GLY H H 205 7.930 7.930 8.463 -0.533 18000 716 1 4 . 1 1 7 7 ASN N N 206 118.380 118.380 125.050 -6.670 18000 717 1 4 . 1 1 7 7 ASN HA H 206 4.760 4.760 4.712 0.048 18000 718 1 4 . 1 1 7 7 ASN C C 206 173.810 173.810 177.108 -3.298 18000 719 1 4 . 1 1 7 7 ASN CA C 206 51.430 51.430 54.254 -2.824 18000 720 1 4 . 1 1 7 7 ASN CB C 206 37.090 37.090 38.610 -1.520 18000 721 1 4 . 1 1 7 7 ASN H H 206 8.330 8.330 9.012 -0.682 18000 722 1 4 . 1 1 8 8 THR N N 207 119.850 119.850 120.809 -0.959 18000 723 1 4 . 1 1 8 8 THR HA H 207 4.270 4.270 4.213 0.057 18000 724 1 4 . 1 1 8 8 THR C C 207 172.560 172.560 176.582 -4.022 18000 725 1 4 . 1 1 8 8 THR CA C 207 60.420 60.420 65.160 -4.740 18000 726 1 4 . 1 1 8 8 THR CB C 207 67.750 67.750 67.903 -0.153 18000 727 1 4 . 1 1 8 8 THR H H 207 7.830 7.830 8.653 -0.823 18000 728 1 4 . 1 1 9 9 ASP N N 208 121.180 121.180 118.117 3.063 18000 729 1 4 . 1 1 9 9 ASP HA H 208 4.550 4.550 4.642 -0.092 18000 730 1 4 . 1 1 9 9 ASP C C 208 174.170 174.170 176.243 -2.073 18000 731 1 4 . 1 1 9 9 ASP CA C 208 52.670 52.670 58.190 -5.520 18000 732 1 4 . 1 1 9 9 ASP CB C 208 39.120 39.120 37.937 1.183 18000 733 1 4 . 1 1 9 9 ASP H H 208 8.350 8.350 8.180 0.170 18000 734 1 4 . 1 1 10 10 ASN HA H 209 4.600 4.600 4.449 0.151 18000 735 1 4 . 1 1 10 10 ASN C C 209 173.670 173.670 177.409 -3.739 18000 736 1 4 . 1 1 10 10 ASN CA C 209 52.110 52.110 56.129 -4.019 18000 737 1 4 . 1 1 10 10 ASN CB C 209 36.730 36.730 37.887 -1.157 18000 738 1 4 . 1 1 11 11 LYS N N 210 120.380 120.380 116.988 3.392 18000 739 1 4 . 1 1 11 11 LYS HA H 210 4.270 4.270 3.957 0.313 18000 740 1 4 . 1 1 11 11 LYS C C 210 174.910 174.910 178.903 -3.993 18000 741 1 4 . 1 1 11 11 LYS CA C 210 54.900 54.900 60.089 -5.189 18000 742 1 4 . 1 1 11 11 LYS CB C 210 30.670 30.670 31.851 -1.181 18000 743 1 4 . 1 1 11 11 LYS H H 210 8.210 8.210 7.875 0.335 18000 744 1 4 . 1 1 12 12 GLU N N 211 120.740 120.740 120.822 -0.082 18000 745 1 4 . 1 1 12 12 GLU HA H 211 4.070 4.070 4.021 0.049 18000 746 1 4 . 1 1 12 12 GLU C C 211 174.810 174.810 179.118 -4.308 18000 747 1 4 . 1 1 12 12 GLU CA C 211 55.940 55.940 59.748 -3.808 18000 748 1 4 . 1 1 12 12 GLU CB C 211 27.700 27.700 29.141 -1.441 18000 749 1 4 . 1 1 12 12 GLU H H 211 8.380 8.380 8.586 -0.206 18000 750 1 4 . 1 1 13 13 TYR N N 212 119.430 119.430 118.534 0.896 18000 751 1 4 . 1 1 13 13 TYR HA H 212 4.380 4.380 4.226 0.154 18000 752 1 4 . 1 1 13 13 TYR C C 212 174.830 174.830 178.357 -3.527 18000 753 1 4 . 1 1 13 13 TYR CA C 212 57.420 57.420 61.088 -3.668 18000 754 1 4 . 1 1 13 13 TYR CB C 212 36.530 36.530 38.229 -1.699 18000 755 1 4 . 1 1 13 13 TYR H H 212 7.940 7.940 8.440 -0.500 18000 756 1 4 . 1 1 14 14 ALA N N 213 121.810 121.810 120.117 1.693 18000 757 1 4 . 1 1 14 14 ALA HA H 213 4.260 4.260 3.874 0.386 18000 758 1 4 . 1 1 14 14 ALA C C 213 176.630 176.630 179.956 -3.326 18000 759 1 4 . 1 1 14 14 ALA CA C 213 51.990 51.990 55.449 -3.459 18000 760 1 4 . 1 1 14 14 ALA CB C 213 16.450 16.450 18.628 -2.178 18000 761 1 4 . 1 1 14 14 ALA H H 213 7.920 7.920 8.255 -0.335 18000 762 1 4 . 1 1 15 15 VAL N N 214 121.430 121.430 119.084 2.346 18000 763 1 4 . 1 1 15 15 VAL HA H 214 3.470 3.470 3.548 -0.078 18000 764 1 4 . 1 1 15 15 VAL C C 214 174.980 174.980 177.829 -2.849 18000 765 1 4 . 1 1 15 15 VAL CA C 214 64.190 64.190 66.327 -2.137 18000 766 1 4 . 1 1 15 15 VAL CB C 214 29.820 29.820 31.264 -1.444 18000 767 1 4 . 1 1 15 15 VAL H H 214 8.680 8.680 8.653 0.027 18000 768 1 4 . 1 1 16 16 ASN N N 215 117.460 117.460 118.081 -0.621 18000 769 1 4 . 1 1 16 16 ASN HA H 215 4.300 4.300 4.405 -0.105 18000 770 1 4 . 1 1 16 16 ASN C C 215 176.320 176.320 177.157 -0.837 18000 771 1 4 . 1 1 16 16 ASN CA C 215 54.190 54.190 55.945 -1.755 18000 772 1 4 . 1 1 16 16 ASN CB C 215 35.360 35.360 37.694 -2.334 18000 773 1 4 . 1 1 16 16 ASN H H 215 8.190 8.190 8.060 0.130 18000 774 1 4 . 1 1 17 17 GLU N N 216 119.430 119.430 117.371 2.059 18000 775 1 4 . 1 1 17 17 GLU HA H 216 4.000 4.000 4.197 -0.197 18000 776 1 4 . 1 1 17 17 GLU C C 216 177.240 177.240 178.959 -1.719 18000 777 1 4 . 1 1 17 17 GLU CA C 216 57.180 57.180 58.615 -1.435 18000 778 1 4 . 1 1 17 17 GLU CB C 216 28.400 28.400 29.332 -0.933 18000 779 1 4 . 1 1 17 17 GLU H H 216 7.730 7.730 8.030 -0.300 18000 780 1 4 . 1 1 18 18 VAL N N 217 120.690 120.690 119.336 1.354 18000 781 1 4 . 1 1 18 18 VAL HA H 217 3.530 3.530 3.901 -0.371 18000 782 1 4 . 1 1 18 18 VAL C C 217 174.990 174.990 178.403 -3.413 18000 783 1 4 . 1 1 18 18 VAL CA C 217 64.310 64.310 64.956 -0.646 18000 784 1 4 . 1 1 18 18 VAL CB C 217 29.640 29.640 31.206 -1.565 18000 785 1 4 . 1 1 18 18 VAL H H 217 7.820 7.820 8.338 -0.518 18000 786 1 4 . 1 1 19 19 VAL N N 218 117.010 117.010 115.202 1.808 18000 787 1 4 . 1 1 19 19 VAL HA H 218 3.500 3.500 3.839 -0.339 18000 788 1 4 . 1 1 19 19 VAL C C 218 175.200 175.200 176.645 -1.445 18000 789 1 4 . 1 1 19 19 VAL CA C 218 64.960 64.960 65.248 -0.288 18000 790 1 4 . 1 1 19 19 VAL CB C 218 29.710 29.710 31.647 -1.937 18000 791 1 4 . 1 1 19 19 VAL H H 218 8.260 8.260 7.849 0.411 18000 792 1 4 . 1 1 20 20 ALA N N 219 120.360 120.360 117.949 2.411 18000 793 1 4 . 1 1 20 20 ALA HA H 219 3.930 3.930 4.281 -0.351 18000 794 1 4 . 1 1 20 20 ALA C C 219 178.310 178.310 177.908 0.402 18000 795 1 4 . 1 1 20 20 ALA CA C 219 53.040 53.040 51.703 1.337 18000 796 1 4 . 1 1 20 20 ALA CB C 219 16.280 16.280 19.034 -2.754 18000 797 1 4 . 1 1 20 20 ALA H H 219 7.490 7.490 7.331 0.159 18000 798 1 4 . 1 1 21 21 GLY N N 220 124.250 124.250 109.235 15.015 18000 799 1 4 . 1 1 21 21 GLY HA H 220 4.250 4.250 4.352 -0.102 18000 800 1 4 . 1 1 21 21 GLY C C 220 172.880 172.880 174.767 -1.887 18000 801 1 4 . 1 1 21 21 GLY CA C 220 44.130 44.130 44.146 -0.016 18000 802 1 4 . 1 1 21 21 GLY CB C 220 29.290 29.290 29.030 0.260 18000 803 1 4 . 1 1 21 21 GLY H H 220 7.640 7.640 7.505 0.135 18000 804 1 4 . 1 1 22 22 ILE N N 221 119.940 119.940 125.777 -5.837 18000 805 1 4 . 1 1 22 22 ILE HA H 221 3.290 3.290 4.215 -0.925 18000 806 1 4 . 1 1 22 22 ILE C C 221 175.100 175.100 174.987 0.113 18000 807 1 4 . 1 1 22 22 ILE CA C 221 64.070 64.070 60.716 3.354 18000 808 1 4 . 1 1 22 22 ILE CB C 221 35.260 35.260 37.880 -2.620 18000 809 1 4 . 1 1 22 22 ILE H H 221 8.130 8.130 8.040 0.090 18000 810 1 4 . 1 1 23 23 LYS HA H 222 3.430 3.430 4.456 -1.026 18000 811 1 4 . 1 1 23 23 LYS C C 222 175.280 175.280 175.324 -0.044 18000 812 1 4 . 1 1 23 23 LYS CA C 222 59.270 59.270 56.309 2.961 18000 813 1 4 . 1 1 23 23 LYS CB C 222 30.670 30.670 30.817 -0.147 18000 814 1 4 . 1 1 24 24 GLU N N 223 116.150 116.150 120.345 -4.195 18000 815 1 4 . 1 1 24 24 GLU HA H 223 4.150 4.150 4.464 -0.314 18000 816 1 4 . 1 1 24 24 GLU C C 223 177.330 177.330 175.916 1.414 18000 817 1 4 . 1 1 24 24 GLU CA C 223 57.180 57.180 54.713 2.467 18000 818 1 4 . 1 1 24 24 GLU CB C 223 27.670 27.670 30.990 -3.320 18000 819 1 4 . 1 1 24 24 GLU H H 223 7.830 7.830 8.122 -0.292 18000 820 1 4 . 1 1 25 25 TYR N N 224 119.760 119.760 121.534 -1.774 18000 821 1 4 . 1 1 25 25 TYR HA H 224 4.480 4.480 4.527 -0.047 18000 822 1 4 . 1 1 25 25 TYR C C 224 175.680 175.680 175.483 0.197 18000 823 1 4 . 1 1 25 25 TYR CA C 224 57.520 57.520 58.078 -0.558 18000 824 1 4 . 1 1 25 25 TYR CB C 224 36.940 36.940 39.157 -2.217 18000 825 1 4 . 1 1 25 25 TYR H H 224 8.630 8.630 8.386 0.244 18000 826 1 4 . 1 1 26 26 PHE N N 225 120.090 120.090 128.621 -8.531 18000 827 1 4 . 1 1 26 26 PHE HA H 225 3.410 3.410 4.403 -0.993 18000 828 1 4 . 1 1 26 26 PHE C C 225 173.930 173.930 174.973 -1.043 18000 829 1 4 . 1 1 26 26 PHE CA C 225 61.600 61.600 58.836 2.764 18000 830 1 4 . 1 1 26 26 PHE CB C 225 36.590 36.590 39.047 -2.457 18000 831 1 4 . 1 1 26 26 PHE H H 225 9.220 9.220 8.801 0.419 18000 832 1 4 . 1 1 27 27 ASN N N 226 115.010 115.010 124.492 -9.482 18000 833 1 4 . 1 1 27 27 ASN HA H 226 4.470 4.470 4.868 -0.398 18000 834 1 4 . 1 1 27 27 ASN C C 226 176.630 176.630 173.561 3.069 18000 835 1 4 . 1 1 27 27 ASN CA C 226 54.160 54.160 51.595 2.565 18000 836 1 4 . 1 1 27 27 ASN CB C 226 35.800 35.800 41.205 -5.405 18000 837 1 4 . 1 1 27 27 ASN H H 226 8.210 8.210 8.384 -0.174 18000 838 1 4 . 1 1 28 28 VAL N N 227 115.120 115.120 117.503 -2.383 18000 839 1 4 . 1 1 28 28 VAL HA H 227 4.300 4.300 4.533 -0.233 18000 840 1 4 . 1 1 28 28 VAL C C 227 174.960 174.960 173.935 1.025 18000 841 1 4 . 1 1 28 28 VAL CA C 227 61.320 61.320 58.412 2.908 18000 842 1 4 . 1 1 28 28 VAL CB C 227 30.670 30.670 30.963 -0.293 18000 843 1 4 . 1 1 28 28 VAL H H 227 7.430 7.430 7.960 -0.530 18000 844 1 4 . 1 1 29 29 MET HA H 228 4.000 4.000 4.468 -0.468 18000 845 1 4 . 1 1 29 29 MET C C 228 176.270 176.270 176.074 0.196 18000 846 1 4 . 1 1 29 29 MET CA C 228 54.030 54.030 55.238 -1.208 18000 847 1 4 . 1 1 29 29 MET CB C 228 31.510 31.510 33.606 -2.096 18000 848 1 4 . 1 1 30 30 LEU N N 229 122.180 122.180 123.455 -1.275 18000 849 1 4 . 1 1 30 30 LEU HA H 229 3.150 3.150 4.086 -0.936 18000 850 1 4 . 1 1 30 30 LEU C C 229 176.070 176.070 178.219 -2.149 18000 851 1 4 . 1 1 30 30 LEU CA C 229 55.860 55.860 57.222 -1.363 18000 852 1 4 . 1 1 30 30 LEU CB C 229 36.340 36.340 41.843 -5.503 18000 853 1 4 . 1 1 30 30 LEU H H 229 7.890 7.890 8.551 -0.661 18000 854 1 4 . 1 1 31 31 GLY N N 230 118.390 118.390 106.768 11.622 18000 855 1 4 . 1 1 31 31 GLY HA H 230 4.090 4.090 4.193 -0.103 18000 856 1 4 . 1 1 31 31 GLY C C 230 173.070 173.070 175.418 -2.348 18000 857 1 4 . 1 1 31 31 GLY CA C 230 43.150 43.150 46.972 -3.822 18000 858 1 4 . 1 1 31 31 GLY CB C 230 26.780 26.780 29.138 -2.358 18000 859 1 4 . 1 1 31 31 GLY H H 230 8.350 8.350 8.821 -0.471 18000 860 1 4 . 1 1 32 32 THR N N 231 124.790 124.790 112.564 12.226 18000 861 1 4 . 1 1 32 32 THR HA H 231 4.280 4.280 4.556 -0.276 18000 862 1 4 . 1 1 32 32 THR C C 231 173.260 173.260 175.652 -2.392 18000 863 1 4 . 1 1 32 32 THR CA C 231 60.030 60.030 62.904 -2.874 18000 864 1 4 . 1 1 32 32 THR CB C 231 68.540 68.540 70.561 -2.021 18000 865 1 4 . 1 1 32 32 THR H H 231 7.040 7.040 7.976 -0.936 18000 866 1 4 . 1 1 33 33 GLN N N 232 114.740 114.740 118.324 -3.584 18000 867 1 4 . 1 1 33 33 GLN HA H 232 5.090 5.090 4.384 0.706 18000 868 1 4 . 1 1 33 33 GLN C C 232 175.790 175.790 174.380 1.410 18000 869 1 4 . 1 1 33 33 GLN CA C 232 53.650 53.650 55.810 -2.160 18000 870 1 4 . 1 1 33 33 GLN CB C 232 30.520 30.520 29.560 0.960 18000 871 1 4 . 1 1 33 33 GLN H H 232 8.110 8.110 7.896 0.214 18000 872 1 4 . 1 1 34 34 LEU N N 233 112.480 112.480 130.362 -17.882 18000 873 1 4 . 1 1 34 34 LEU HA H 233 4.460 4.460 4.273 0.187 18000 874 1 4 . 1 1 34 34 LEU C C 233 172.610 172.610 178.227 -5.617 18000 875 1 4 . 1 1 34 34 LEU CA C 233 52.460 52.460 54.808 -2.348 18000 876 1 4 . 1 1 34 34 LEU CB C 233 39.140 39.140 40.704 -1.564 18000 877 1 4 . 1 1 34 34 LEU H H 233 6.980 6.980 8.840 -1.860 18000 878 1 4 . 1 1 35 35 LEU N N 234 115.860 115.860 123.973 -8.113 18000 879 1 4 . 1 1 35 35 LEU HA H 234 4.510 4.510 4.181 0.329 18000 880 1 4 . 1 1 35 35 LEU C C 234 178.330 178.330 177.303 1.027 18000 881 1 4 . 1 1 35 35 LEU CA C 234 51.900 51.900 56.995 -5.095 18000 882 1 4 . 1 1 35 35 LEU CB C 234 40.950 40.950 42.229 -1.279 18000 883 1 4 . 1 1 35 35 LEU H H 234 7.560 7.560 8.165 -0.605 18000 884 1 4 . 1 1 36 36 TYR N N 235 125.850 125.850 124.397 1.453 18000 885 1 4 . 1 1 36 36 TYR HA H 235 4.790 4.790 4.623 0.167 18000 886 1 4 . 1 1 36 36 TYR C C 235 176.260 176.260 174.319 1.941 18000 887 1 4 . 1 1 36 36 TYR CA C 235 57.750 57.750 58.606 -0.856 18000 888 1 4 . 1 1 36 36 TYR CB C 235 37.100 37.100 36.757 0.343 18000 889 1 4 . 1 1 36 36 TYR H H 235 9.750 9.750 8.192 1.558 18000 890 1 4 . 1 1 37 37 LYS N N 236 123.880 123.880 124.170 -0.290 18000 891 1 4 . 1 1 37 37 LYS HA H 236 3.930 3.930 4.700 -0.770 18000 892 1 4 . 1 1 37 37 LYS C C 236 178.280 178.280 174.364 3.916 18000 893 1 4 . 1 1 37 37 LYS CA C 236 59.210 59.210 56.564 2.646 18000 894 1 4 . 1 1 37 37 LYS CB C 236 30.430 30.430 34.049 -3.619 18000 895 1 4 . 1 1 37 37 LYS H H 236 9.340 9.340 7.618 1.722 18000 896 1 4 . 1 1 38 38 PHE N N 237 117.150 117.150 120.506 -3.356 18000 897 1 4 . 1 1 38 38 PHE HA H 237 4.460 4.460 5.086 -0.626 18000 898 1 4 . 1 1 38 38 PHE C C 237 173.930 173.930 173.986 -0.056 18000 899 1 4 . 1 1 38 38 PHE CA C 237 58.510 58.510 56.027 2.483 18000 900 1 4 . 1 1 38 38 PHE CB C 237 38.370 38.370 39.455 -1.085 18000 901 1 4 . 1 1 38 38 PHE H H 237 9.120 9.120 8.028 1.092 18000 902 1 4 . 1 1 39 39 GLU HA H 238 4.160 4.160 4.375 -0.215 18000 903 1 4 . 1 1 39 39 GLU C C 238 175.650 175.650 175.819 -0.169 18000 904 1 4 . 1 1 39 39 GLU CA C 238 55.070 55.070 56.359 -1.289 18000 905 1 4 . 1 1 39 39 GLU CB C 238 31.540 31.540 30.261 1.279 18000 906 1 4 . 1 1 40 40 ARG N N 239 120.330 120.330 119.338 0.992 18000 907 1 4 . 1 1 40 40 ARG HA H 239 4.250 4.250 4.250 -0.000 18000 908 1 4 . 1 1 40 40 ARG C C 239 174.490 174.490 174.758 -0.268 18000 909 1 4 . 1 1 40 40 ARG CA C 239 60.410 60.410 55.380 5.030 18000 910 1 4 . 1 1 40 40 ARG H H 239 7.980 7.980 8.004 -0.024 18000 911 1 4 . 1 1 41 41 PRO N N 240 115.390 115.390 115.693 -0.303 18000 912 1 4 . 1 1 41 41 PRO HA H 240 4.360 4.360 4.664 -0.304 18000 913 1 4 . 1 1 41 41 PRO C C 240 176.330 176.330 176.483 -0.153 18000 914 1 4 . 1 1 41 41 PRO CA C 240 64.400 64.400 62.737 1.663 18000 915 1 4 . 1 1 41 41 PRO CB C 240 62.240 62.240 64.344 -2.103 18000 916 1 4 . 1 1 41 41 PRO H H 240 8.090 8.090 8.268 -0.178 18000 917 1 5 . 1 1 2 2 ARG N N 201 119.330 119.330 121.699 -2.369 18000 918 1 5 . 1 1 2 2 ARG HA H 201 3.560 3.560 4.654 -1.094 18000 919 1 5 . 1 1 2 2 ARG C C 201 176.850 176.850 174.717 2.133 18000 920 1 5 . 1 1 2 2 ARG CA C 201 55.340 55.340 55.643 -0.303 18000 921 1 5 . 1 1 2 2 ARG CB C 201 27.020 27.020 31.710 -4.691 18000 922 1 5 . 1 1 2 2 ARG H H 201 8.370 8.370 8.258 0.112 18000 923 1 5 . 1 1 3 3 LYS N N 202 118.540 118.540 126.869 -8.329 18000 924 1 5 . 1 1 3 3 LYS HA H 202 4.010 4.010 4.389 -0.379 18000 925 1 5 . 1 1 3 3 LYS C C 202 176.090 176.090 174.815 1.275 18000 926 1 5 . 1 1 3 3 LYS CA C 202 56.960 56.960 55.632 1.328 18000 927 1 5 . 1 1 3 3 LYS CB C 202 30.590 30.590 33.806 -3.216 18000 928 1 5 . 1 1 3 3 LYS H H 202 7.940 7.940 8.009 -0.069 18000 929 1 5 . 1 1 4 4 SER N N 203 113.880 113.880 124.393 -10.513 18000 930 1 5 . 1 1 4 4 SER HA H 203 4.320 4.320 4.659 -0.339 18000 931 1 5 . 1 1 4 4 SER C C 203 172.900 172.900 172.750 0.150 18000 932 1 5 . 1 1 4 4 SER CA C 203 57.870 57.870 55.201 2.669 18000 933 1 5 . 1 1 4 4 SER CB C 203 61.700 61.700 61.977 -0.277 18000 934 1 5 . 1 1 4 4 SER H H 203 7.700 7.700 8.271 -0.571 18000 935 1 5 . 1 1 5 5 ARG HA H 204 4.240 4.240 4.320 -0.080 18000 936 1 5 . 1 1 5 5 ARG C C 204 174.810 174.810 174.980 -0.170 18000 937 1 5 . 1 1 5 5 ARG CA C 204 54.270 54.270 55.620 -1.350 18000 938 1 5 . 1 1 5 5 ARG CB C 204 28.700 28.700 30.654 -1.954 18000 939 1 5 . 1 1 6 6 GLY N N 205 125.950 125.950 108.204 17.746 18000 940 1 5 . 1 1 6 6 GLY HA H 205 4.400 4.400 4.398 0.002 18000 941 1 5 . 1 1 6 6 GLY C C 205 171.910 171.910 174.996 -3.086 18000 942 1 5 . 1 1 6 6 GLY CA C 205 43.570 43.570 44.657 -1.087 18000 943 1 5 . 1 1 6 6 GLY CB C 205 28.340 28.340 29.149 -0.809 18000 944 1 5 . 1 1 6 6 GLY H H 205 7.930 7.930 8.289 -0.359 18000 945 1 5 . 1 1 7 7 ASN N N 206 118.380 118.380 120.364 -1.984 18000 946 1 5 . 1 1 7 7 ASN HA H 206 4.760 4.760 4.923 -0.163 18000 947 1 5 . 1 1 7 7 ASN C C 206 173.810 173.810 177.455 -3.645 18000 948 1 5 . 1 1 7 7 ASN CA C 206 51.430 51.430 54.519 -3.089 18000 949 1 5 . 1 1 7 7 ASN CB C 206 37.090 37.090 38.028 -0.938 18000 950 1 5 . 1 1 7 7 ASN H H 206 8.330 8.330 8.907 -0.577 18000 951 1 5 . 1 1 8 8 THR N N 207 119.850 119.850 120.107 -0.257 18000 952 1 5 . 1 1 8 8 THR HA H 207 4.270 4.270 4.049 0.221 18000 953 1 5 . 1 1 8 8 THR C C 207 172.560 172.560 176.756 -4.196 18000 954 1 5 . 1 1 8 8 THR CA C 207 60.420 60.420 65.243 -4.823 18000 955 1 5 . 1 1 8 8 THR CB C 207 67.750 67.750 68.138 -0.387 18000 956 1 5 . 1 1 8 8 THR H H 207 7.830 7.830 8.547 -0.717 18000 957 1 5 . 1 1 9 9 ASP N N 208 121.180 121.180 117.570 3.610 18000 958 1 5 . 1 1 9 9 ASP HA H 208 4.550 4.550 4.645 -0.095 18000 959 1 5 . 1 1 9 9 ASP C C 208 174.170 174.170 176.328 -2.158 18000 960 1 5 . 1 1 9 9 ASP CA C 208 52.670 52.670 58.150 -5.480 18000 961 1 5 . 1 1 9 9 ASP CB C 208 39.120 39.120 37.900 1.220 18000 962 1 5 . 1 1 9 9 ASP H H 208 8.350 8.350 8.541 -0.191 18000 963 1 5 . 1 1 10 10 ASN HA H 209 4.600 4.600 4.500 0.100 18000 964 1 5 . 1 1 10 10 ASN C C 209 173.670 173.670 177.632 -3.962 18000 965 1 5 . 1 1 10 10 ASN CA C 209 52.110 52.110 56.153 -4.043 18000 966 1 5 . 1 1 10 10 ASN CB C 209 36.730 36.730 38.045 -1.315 18000 967 1 5 . 1 1 11 11 LYS N N 210 120.380 120.380 117.099 3.281 18000 968 1 5 . 1 1 11 11 LYS HA H 210 4.270 4.270 4.069 0.201 18000 969 1 5 . 1 1 11 11 LYS C C 210 174.910 174.910 178.806 -3.896 18000 970 1 5 . 1 1 11 11 LYS CA C 210 54.900 54.900 60.681 -5.781 18000 971 1 5 . 1 1 11 11 LYS CB C 210 30.670 30.670 32.361 -1.692 18000 972 1 5 . 1 1 11 11 LYS H H 210 8.210 8.210 8.640 -0.430 18000 973 1 5 . 1 1 12 12 GLU N N 211 120.740 120.740 121.250 -0.510 18000 974 1 5 . 1 1 12 12 GLU HA H 211 4.070 4.070 4.079 -0.009 18000 975 1 5 . 1 1 12 12 GLU C C 211 174.810 174.810 179.375 -4.565 18000 976 1 5 . 1 1 12 12 GLU CA C 211 55.940 55.940 60.012 -4.072 18000 977 1 5 . 1 1 12 12 GLU CB C 211 27.700 27.700 29.608 -1.908 18000 978 1 5 . 1 1 12 12 GLU H H 211 8.380 8.380 8.228 0.152 18000 979 1 5 . 1 1 13 13 TYR N N 212 119.430 119.430 119.163 0.267 18000 980 1 5 . 1 1 13 13 TYR HA H 212 4.380 4.380 4.212 0.168 18000 981 1 5 . 1 1 13 13 TYR C C 212 174.830 174.830 178.488 -3.658 18000 982 1 5 . 1 1 13 13 TYR CA C 212 57.420 57.420 60.995 -3.575 18000 983 1 5 . 1 1 13 13 TYR CB C 212 36.530 36.530 38.189 -1.659 18000 984 1 5 . 1 1 13 13 TYR H H 212 7.940 7.940 8.767 -0.827 18000 985 1 5 . 1 1 14 14 ALA N N 213 121.810 121.810 120.509 1.301 18000 986 1 5 . 1 1 14 14 ALA HA H 213 4.260 4.260 3.995 0.265 18000 987 1 5 . 1 1 14 14 ALA C C 213 176.630 176.630 179.565 -2.935 18000 988 1 5 . 1 1 14 14 ALA CA C 213 51.990 51.990 55.194 -3.204 18000 989 1 5 . 1 1 14 14 ALA CB C 213 16.450 16.450 18.696 -2.246 18000 990 1 5 . 1 1 14 14 ALA H H 213 7.920 7.920 7.946 -0.026 18000 991 1 5 . 1 1 15 15 VAL N N 214 121.430 121.430 118.958 2.472 18000 992 1 5 . 1 1 15 15 VAL HA H 214 3.470 3.470 3.540 -0.070 18000 993 1 5 . 1 1 15 15 VAL C C 214 174.980 174.980 177.658 -2.678 18000 994 1 5 . 1 1 15 15 VAL CA C 214 64.190 64.190 66.415 -2.225 18000 995 1 5 . 1 1 15 15 VAL CB C 214 29.820 29.820 31.222 -1.402 18000 996 1 5 . 1 1 15 15 VAL H H 214 8.680 8.680 8.620 0.060 18000 997 1 5 . 1 1 16 16 ASN N N 215 117.460 117.460 118.313 -0.853 18000 998 1 5 . 1 1 16 16 ASN HA H 215 4.300 4.300 4.414 -0.114 18000 999 1 5 . 1 1 16 16 ASN C C 215 176.320 176.320 177.247 -0.927 18000 1000 1 5 . 1 1 16 16 ASN CA C 215 54.190 54.190 55.926 -1.736 18000 1001 1 5 . 1 1 16 16 ASN CB C 215 35.360 35.360 37.637 -2.277 18000 1002 1 5 . 1 1 16 16 ASN H H 215 8.190 8.190 8.133 0.057 18000 1003 1 5 . 1 1 17 17 GLU N N 216 119.430 119.430 117.411 2.019 18000 1004 1 5 . 1 1 17 17 GLU HA H 216 4.000 4.000 4.143 -0.143 18000 1005 1 5 . 1 1 17 17 GLU C C 216 177.240 177.240 178.927 -1.687 18000 1006 1 5 . 1 1 17 17 GLU CA C 216 57.180 57.180 58.782 -1.602 18000 1007 1 5 . 1 1 17 17 GLU CB C 216 28.400 28.400 29.099 -0.699 18000 1008 1 5 . 1 1 17 17 GLU H H 216 7.730 7.730 7.978 -0.248 18000 1009 1 5 . 1 1 18 18 VAL N N 217 120.690 120.690 119.127 1.563 18000 1010 1 5 . 1 1 18 18 VAL HA H 217 3.530 3.530 3.885 -0.355 18000 1011 1 5 . 1 1 18 18 VAL C C 217 174.990 174.990 178.358 -3.368 18000 1012 1 5 . 1 1 18 18 VAL CA C 217 64.310 64.310 64.978 -0.668 18000 1013 1 5 . 1 1 18 18 VAL CB C 217 29.640 29.640 31.175 -1.535 18000 1014 1 5 . 1 1 18 18 VAL H H 217 7.820 7.820 7.878 -0.058 18000 1015 1 5 . 1 1 19 19 VAL N N 218 117.010 117.010 116.810 0.200 18000 1016 1 5 . 1 1 19 19 VAL HA H 218 3.500 3.500 3.897 -0.397 18000 1017 1 5 . 1 1 19 19 VAL C C 218 175.200 175.200 176.682 -1.482 18000 1018 1 5 . 1 1 19 19 VAL CA C 218 64.960 64.960 65.088 -0.128 18000 1019 1 5 . 1 1 19 19 VAL CB C 218 29.710 29.710 31.775 -2.065 18000 1020 1 5 . 1 1 19 19 VAL H H 218 8.260 8.260 7.788 0.472 18000 1021 1 5 . 1 1 20 20 ALA N N 219 120.360 120.360 118.579 1.781 18000 1022 1 5 . 1 1 20 20 ALA HA H 219 3.930 3.930 4.381 -0.451 18000 1023 1 5 . 1 1 20 20 ALA C C 219 178.310 178.310 176.946 1.364 18000 1024 1 5 . 1 1 20 20 ALA CA C 219 53.040 53.040 51.327 1.713 18000 1025 1 5 . 1 1 20 20 ALA CB C 219 16.280 16.280 18.970 -2.690 18000 1026 1 5 . 1 1 20 20 ALA H H 219 7.490 7.490 7.385 0.105 18000 1027 1 5 . 1 1 21 21 GLY N N 220 124.250 124.250 109.097 15.153 18000 1028 1 5 . 1 1 21 21 GLY HA H 220 4.250 4.250 4.544 -0.294 18000 1029 1 5 . 1 1 21 21 GLY C C 220 172.880 172.880 174.231 -1.351 18000 1030 1 5 . 1 1 21 21 GLY CA C 220 44.130 44.130 44.378 -0.248 18000 1031 1 5 . 1 1 21 21 GLY CB C 220 29.290 29.290 30.387 -1.097 18000 1032 1 5 . 1 1 21 21 GLY H H 220 7.640 7.640 7.572 0.068 18000 1033 1 5 . 1 1 22 22 ILE N N 221 119.940 119.940 123.289 -3.349 18000 1034 1 5 . 1 1 22 22 ILE HA H 221 3.290 3.290 4.532 -1.242 18000 1035 1 5 . 1 1 22 22 ILE C C 221 175.100 175.100 175.113 -0.013 18000 1036 1 5 . 1 1 22 22 ILE CA C 221 64.070 64.070 60.813 3.256 18000 1037 1 5 . 1 1 22 22 ILE CB C 221 35.260 35.260 37.914 -2.654 18000 1038 1 5 . 1 1 22 22 ILE H H 221 8.130 8.130 8.531 -0.401 18000 1039 1 5 . 1 1 23 23 LYS HA H 222 3.430 3.430 4.254 -0.824 18000 1040 1 5 . 1 1 23 23 LYS C C 222 175.280 175.280 176.237 -0.957 18000 1041 1 5 . 1 1 23 23 LYS CA C 222 59.270 59.270 57.712 1.558 18000 1042 1 5 . 1 1 23 23 LYS CB C 222 30.670 30.670 32.318 -1.648 18000 1043 1 5 . 1 1 24 24 GLU N N 223 116.150 116.150 110.827 5.323 18000 1044 1 5 . 1 1 24 24 GLU HA H 223 4.150 4.150 3.990 0.160 18000 1045 1 5 . 1 1 24 24 GLU C C 223 177.330 177.330 175.234 2.096 18000 1046 1 5 . 1 1 24 24 GLU CA C 223 57.180 57.180 57.625 -0.445 18000 1047 1 5 . 1 1 24 24 GLU CB C 223 27.670 27.670 29.057 -1.387 18000 1048 1 5 . 1 1 24 24 GLU H H 223 7.830 7.830 8.167 -0.337 18000 1049 1 5 . 1 1 25 25 TYR N N 224 119.760 119.760 120.016 -0.256 18000 1050 1 5 . 1 1 25 25 TYR HA H 224 4.480 4.480 4.833 -0.353 18000 1051 1 5 . 1 1 25 25 TYR C C 224 175.680 175.680 174.414 1.266 18000 1052 1 5 . 1 1 25 25 TYR CA C 224 57.520 57.520 57.287 0.233 18000 1053 1 5 . 1 1 25 25 TYR CB C 224 36.940 36.940 40.331 -3.391 18000 1054 1 5 . 1 1 25 25 TYR H H 224 8.630 8.630 7.712 0.918 18000 1055 1 5 . 1 1 26 26 PHE N N 225 120.090 120.090 126.349 -6.259 18000 1056 1 5 . 1 1 26 26 PHE HA H 225 3.410 3.410 4.434 -1.024 18000 1057 1 5 . 1 1 26 26 PHE C C 225 173.930 173.930 174.627 -0.697 18000 1058 1 5 . 1 1 26 26 PHE CA C 225 61.600 61.600 59.001 2.599 18000 1059 1 5 . 1 1 26 26 PHE CB C 225 36.590 36.590 39.677 -3.087 18000 1060 1 5 . 1 1 26 26 PHE H H 225 9.220 9.220 8.657 0.563 18000 1061 1 5 . 1 1 27 27 ASN N N 226 115.010 115.010 123.788 -8.778 18000 1062 1 5 . 1 1 27 27 ASN HA H 226 4.470 4.470 4.707 -0.237 18000 1063 1 5 . 1 1 27 27 ASN C C 226 176.630 176.630 173.133 3.497 18000 1064 1 5 . 1 1 27 27 ASN CA C 226 54.160 54.160 51.241 2.919 18000 1065 1 5 . 1 1 27 27 ASN CB C 226 35.800 35.800 41.446 -5.646 18000 1066 1 5 . 1 1 27 27 ASN H H 226 8.210 8.210 8.196 0.014 18000 1067 1 5 . 1 1 28 28 VAL N N 227 115.120 115.120 121.916 -6.796 18000 1068 1 5 . 1 1 28 28 VAL HA H 227 4.300 4.300 4.282 0.018 18000 1069 1 5 . 1 1 28 28 VAL C C 227 174.960 174.960 174.812 0.148 18000 1070 1 5 . 1 1 28 28 VAL CA C 227 61.320 61.320 59.411 1.909 18000 1071 1 5 . 1 1 28 28 VAL CB C 227 30.670 30.670 31.423 -0.753 18000 1072 1 5 . 1 1 28 28 VAL H H 227 7.430 7.430 8.281 -0.851 18000 1073 1 5 . 1 1 29 29 MET HA H 228 4.000 4.000 4.407 -0.407 18000 1074 1 5 . 1 1 29 29 MET C C 228 176.270 176.270 176.229 0.041 18000 1075 1 5 . 1 1 29 29 MET CA C 228 54.030 54.030 55.499 -1.469 18000 1076 1 5 . 1 1 29 29 MET CB C 228 31.510 31.510 33.576 -2.066 18000 1077 1 5 . 1 1 30 30 LEU N N 229 122.180 122.180 122.565 -0.385 18000 1078 1 5 . 1 1 30 30 LEU HA H 229 3.150 3.150 3.986 -0.836 18000 1079 1 5 . 1 1 30 30 LEU C C 229 176.070 176.070 178.787 -2.717 18000 1080 1 5 . 1 1 30 30 LEU CA C 229 55.860 55.860 57.806 -1.946 18000 1081 1 5 . 1 1 30 30 LEU CB C 229 36.340 36.340 41.375 -5.035 18000 1082 1 5 . 1 1 30 30 LEU H H 229 7.890 7.890 8.593 -0.703 18000 1083 1 5 . 1 1 31 31 GLY N N 230 118.390 118.390 106.885 11.505 18000 1084 1 5 . 1 1 31 31 GLY HA H 230 4.090 4.090 4.202 -0.112 18000 1085 1 5 . 1 1 31 31 GLY C C 230 173.070 173.070 175.551 -2.481 18000 1086 1 5 . 1 1 31 31 GLY CA C 230 43.150 43.150 46.904 -3.754 18000 1087 1 5 . 1 1 31 31 GLY CB C 230 26.780 26.780 28.730 -1.950 18000 1088 1 5 . 1 1 31 31 GLY H H 230 8.350 8.350 8.863 -0.513 18000 1089 1 5 . 1 1 32 32 THR N N 231 124.790 124.790 112.424 12.366 18000 1090 1 5 . 1 1 32 32 THR HA H 231 4.280 4.280 4.453 -0.173 18000 1091 1 5 . 1 1 32 32 THR C C 231 173.260 173.260 176.340 -3.080 18000 1092 1 5 . 1 1 32 32 THR CA C 231 60.030 60.030 63.523 -3.493 18000 1093 1 5 . 1 1 32 32 THR CB C 231 68.540 68.540 70.534 -1.994 18000 1094 1 5 . 1 1 32 32 THR H H 231 7.040 7.040 7.592 -0.552 18000 1095 1 5 . 1 1 33 33 GLN N N 232 114.740 114.740 116.285 -1.545 18000 1096 1 5 . 1 1 33 33 GLN HA H 232 5.090 5.090 4.309 0.781 18000 1097 1 5 . 1 1 33 33 GLN C C 232 175.790 175.790 175.562 0.228 18000 1098 1 5 . 1 1 33 33 GLN CA C 232 53.650 53.650 55.838 -2.188 18000 1099 1 5 . 1 1 33 33 GLN CB C 232 30.520 30.520 30.399 0.121 18000 1100 1 5 . 1 1 33 33 GLN H H 232 8.110 8.110 7.777 0.333 18000 1101 1 5 . 1 1 34 34 LEU N N 233 112.480 112.480 122.335 -9.855 18000 1102 1 5 . 1 1 34 34 LEU HA H 233 4.460 4.460 4.018 0.442 18000 1103 1 5 . 1 1 34 34 LEU C C 233 172.610 172.610 177.611 -5.001 18000 1104 1 5 . 1 1 34 34 LEU CA C 233 52.460 52.460 55.913 -3.453 18000 1105 1 5 . 1 1 34 34 LEU CB C 233 39.140 39.140 41.204 -2.064 18000 1106 1 5 . 1 1 34 34 LEU H H 233 6.980 6.980 7.966 -0.986 18000 1107 1 5 . 1 1 35 35 LEU N N 234 115.860 115.860 123.257 -7.397 18000 1108 1 5 . 1 1 35 35 LEU HA H 234 4.510 4.510 4.109 0.401 18000 1109 1 5 . 1 1 35 35 LEU C C 234 178.330 178.330 177.316 1.014 18000 1110 1 5 . 1 1 35 35 LEU CA C 234 51.900 51.900 56.919 -5.019 18000 1111 1 5 . 1 1 35 35 LEU CB C 234 40.950 40.950 42.597 -1.647 18000 1112 1 5 . 1 1 35 35 LEU H H 234 7.560 7.560 8.427 -0.867 18000 1113 1 5 . 1 1 36 36 TYR N N 235 125.850 125.850 120.530 5.320 18000 1114 1 5 . 1 1 36 36 TYR HA H 235 4.790 4.790 4.599 0.191 18000 1115 1 5 . 1 1 36 36 TYR C C 235 176.260 176.260 173.724 2.536 18000 1116 1 5 . 1 1 36 36 TYR CA C 235 57.750 57.750 57.972 -0.222 18000 1117 1 5 . 1 1 36 36 TYR CB C 235 37.100 37.100 38.735 -1.635 18000 1118 1 5 . 1 1 36 36 TYR H H 235 9.750 9.750 7.691 2.059 18000 1119 1 5 . 1 1 37 37 LYS N N 236 123.880 123.880 125.843 -1.963 18000 1120 1 5 . 1 1 37 37 LYS HA H 236 3.930 3.930 4.653 -0.723 18000 1121 1 5 . 1 1 37 37 LYS C C 236 178.280 178.280 175.400 2.880 18000 1122 1 5 . 1 1 37 37 LYS CA C 236 59.210 59.210 55.617 3.594 18000 1123 1 5 . 1 1 37 37 LYS CB C 236 30.430 30.430 33.948 -3.518 18000 1124 1 5 . 1 1 37 37 LYS H H 236 9.340 9.340 8.375 0.965 18000 1125 1 5 . 1 1 38 38 PHE N N 237 117.150 117.150 123.670 -6.520 18000 1126 1 5 . 1 1 38 38 PHE HA H 237 4.460 4.460 4.755 -0.295 18000 1127 1 5 . 1 1 38 38 PHE C C 237 173.930 173.930 175.746 -1.816 18000 1128 1 5 . 1 1 38 38 PHE CA C 237 58.510 58.510 56.387 2.123 18000 1129 1 5 . 1 1 38 38 PHE CB C 237 38.370 38.370 38.776 -0.406 18000 1130 1 5 . 1 1 38 38 PHE H H 237 9.120 9.120 8.445 0.675 18000 1131 1 5 . 1 1 39 39 GLU HA H 238 4.160 4.160 4.255 -0.095 18000 1132 1 5 . 1 1 39 39 GLU C C 238 175.650 175.650 176.291 -0.641 18000 1133 1 5 . 1 1 39 39 GLU CA C 238 55.070 55.070 56.708 -1.638 18000 1134 1 5 . 1 1 39 39 GLU CB C 238 31.540 31.540 30.307 1.233 18000 1135 1 5 . 1 1 40 40 ARG N N 239 120.330 120.330 119.690 0.640 18000 1136 1 5 . 1 1 40 40 ARG HA H 239 4.250 4.250 4.236 0.014 18000 1137 1 5 . 1 1 40 40 ARG C C 239 174.490 174.490 174.973 -0.483 18000 1138 1 5 . 1 1 40 40 ARG CA C 239 60.410 60.410 55.437 4.973 18000 1139 1 5 . 1 1 40 40 ARG H H 239 7.980 7.980 8.040 -0.060 18000 1140 1 5 . 1 1 41 41 PRO N N 240 115.390 115.390 117.308 -1.918 18000 1141 1 5 . 1 1 41 41 PRO HA H 240 4.360 4.360 4.799 -0.439 18000 1142 1 5 . 1 1 41 41 PRO C C 240 176.330 176.330 176.066 0.264 18000 1143 1 5 . 1 1 41 41 PRO CA C 240 64.400 64.400 63.401 0.999 18000 1144 1 5 . 1 1 41 41 PRO CB C 240 62.240 62.240 63.303 -1.062 18000 1145 1 5 . 1 1 41 41 PRO H H 240 8.090 8.090 8.531 -0.441 18000 1146 1 6 . 1 1 2 2 ARG N N 201 119.330 119.330 119.276 0.054 18000 1147 1 6 . 1 1 2 2 ARG HA H 201 3.560 3.560 4.525 -0.965 18000 1148 1 6 . 1 1 2 2 ARG C C 201 176.850 176.850 175.395 1.455 18000 1149 1 6 . 1 1 2 2 ARG CA C 201 55.340 55.340 55.554 -0.214 18000 1150 1 6 . 1 1 2 2 ARG CB C 201 27.020 27.020 30.478 -3.458 18000 1151 1 6 . 1 1 2 2 ARG H H 201 8.370 8.370 8.422 -0.052 18000 1152 1 6 . 1 1 3 3 LYS N N 202 118.540 118.540 124.197 -5.657 18000 1153 1 6 . 1 1 3 3 LYS HA H 202 4.010 4.010 4.169 -0.159 18000 1154 1 6 . 1 1 3 3 LYS C C 202 176.090 176.090 176.887 -0.797 18000 1155 1 6 . 1 1 3 3 LYS CA C 202 56.960 56.960 57.085 -0.125 18000 1156 1 6 . 1 1 3 3 LYS CB C 202 30.590 30.590 32.843 -2.253 18000 1157 1 6 . 1 1 3 3 LYS H H 202 7.940 7.940 8.366 -0.426 18000 1158 1 6 . 1 1 4 4 SER N N 203 113.880 113.880 122.961 -9.081 18000 1159 1 6 . 1 1 4 4 SER HA H 203 4.320 4.320 4.684 -0.364 18000 1160 1 6 . 1 1 4 4 SER C C 203 172.900 172.900 172.965 -0.065 18000 1161 1 6 . 1 1 4 4 SER CA C 203 57.870 57.870 56.367 1.503 18000 1162 1 6 . 1 1 4 4 SER CB C 203 61.700 61.700 62.852 -1.152 18000 1163 1 6 . 1 1 4 4 SER H H 203 7.700 7.700 8.418 -0.718 18000 1164 1 6 . 1 1 5 5 ARG HA H 204 4.240 4.240 4.389 -0.149 18000 1165 1 6 . 1 1 5 5 ARG C C 204 174.810 174.810 174.870 -0.060 18000 1166 1 6 . 1 1 5 5 ARG CA C 204 54.270 54.270 55.757 -1.487 18000 1167 1 6 . 1 1 5 5 ARG CB C 204 28.700 28.700 30.694 -1.994 18000 1168 1 6 . 1 1 6 6 GLY N N 205 125.950 125.950 108.977 16.973 18000 1169 1 6 . 1 1 6 6 GLY HA H 205 4.400 4.400 4.314 0.086 18000 1170 1 6 . 1 1 6 6 GLY C C 205 171.910 171.910 174.352 -2.442 18000 1171 1 6 . 1 1 6 6 GLY CA C 205 43.570 43.570 44.928 -1.358 18000 1172 1 6 . 1 1 6 6 GLY CB C 205 28.340 28.340 29.179 -0.839 18000 1173 1 6 . 1 1 6 6 GLY H H 205 7.930 7.930 8.304 -0.374 18000 1174 1 6 . 1 1 7 7 ASN N N 206 118.380 118.380 120.912 -2.532 18000 1175 1 6 . 1 1 7 7 ASN HA H 206 4.760 4.760 4.647 0.113 18000 1176 1 6 . 1 1 7 7 ASN C C 206 173.810 173.810 177.814 -4.004 18000 1177 1 6 . 1 1 7 7 ASN CA C 206 51.430 51.430 54.733 -3.303 18000 1178 1 6 . 1 1 7 7 ASN CB C 206 37.090 37.090 37.870 -0.780 18000 1179 1 6 . 1 1 7 7 ASN H H 206 8.330 8.330 8.811 -0.481 18000 1180 1 6 . 1 1 8 8 THR N N 207 119.850 119.850 120.609 -0.759 18000 1181 1 6 . 1 1 8 8 THR HA H 207 4.270 4.270 4.278 -0.008 18000 1182 1 6 . 1 1 8 8 THR C C 207 172.560 172.560 176.764 -4.204 18000 1183 1 6 . 1 1 8 8 THR CA C 207 60.420 60.420 65.496 -5.076 18000 1184 1 6 . 1 1 8 8 THR CB C 207 67.750 67.750 68.079 -0.329 18000 1185 1 6 . 1 1 8 8 THR H H 207 7.830 7.830 8.773 -0.943 18000 1186 1 6 . 1 1 9 9 ASP N N 208 121.180 121.180 118.720 2.460 18000 1187 1 6 . 1 1 9 9 ASP HA H 208 4.550 4.550 4.548 0.002 18000 1188 1 6 . 1 1 9 9 ASP C C 208 174.170 174.170 176.185 -2.015 18000 1189 1 6 . 1 1 9 9 ASP CA C 208 52.670 52.670 58.290 -5.620 18000 1190 1 6 . 1 1 9 9 ASP CB C 208 39.120 39.120 38.076 1.044 18000 1191 1 6 . 1 1 9 9 ASP H H 208 8.350 8.350 8.839 -0.489 18000 1192 1 6 . 1 1 10 10 ASN HA H 209 4.600 4.600 4.512 0.088 18000 1193 1 6 . 1 1 10 10 ASN C C 209 173.670 173.670 177.316 -3.646 18000 1194 1 6 . 1 1 10 10 ASN CA C 209 52.110 52.110 55.992 -3.882 18000 1195 1 6 . 1 1 10 10 ASN CB C 209 36.730 36.730 37.955 -1.225 18000 1196 1 6 . 1 1 11 11 LYS N N 210 120.380 120.380 117.728 2.652 18000 1197 1 6 . 1 1 11 11 LYS HA H 210 4.270 4.270 3.975 0.295 18000 1198 1 6 . 1 1 11 11 LYS C C 210 174.910 174.910 178.856 -3.946 18000 1199 1 6 . 1 1 11 11 LYS CA C 210 54.900 54.900 60.135 -5.235 18000 1200 1 6 . 1 1 11 11 LYS CB C 210 30.670 30.670 31.915 -1.244 18000 1201 1 6 . 1 1 11 11 LYS H H 210 8.210 8.210 8.058 0.152 18000 1202 1 6 . 1 1 12 12 GLU N N 211 120.740 120.740 119.901 0.839 18000 1203 1 6 . 1 1 12 12 GLU HA H 211 4.070 4.070 4.003 0.067 18000 1204 1 6 . 1 1 12 12 GLU C C 211 174.810 174.810 179.434 -4.624 18000 1205 1 6 . 1 1 12 12 GLU CA C 211 55.940 55.940 59.897 -3.957 18000 1206 1 6 . 1 1 12 12 GLU CB C 211 27.700 27.700 29.107 -1.407 18000 1207 1 6 . 1 1 12 12 GLU H H 211 8.380 8.380 8.460 -0.080 18000 1208 1 6 . 1 1 13 13 TYR N N 212 119.430 119.430 118.724 0.706 18000 1209 1 6 . 1 1 13 13 TYR HA H 212 4.380 4.380 4.260 0.120 18000 1210 1 6 . 1 1 13 13 TYR C C 212 174.830 174.830 178.429 -3.599 18000 1211 1 6 . 1 1 13 13 TYR CA C 212 57.420 57.420 60.821 -3.401 18000 1212 1 6 . 1 1 13 13 TYR CB C 212 36.530 36.530 38.118 -1.589 18000 1213 1 6 . 1 1 13 13 TYR H H 212 7.940 7.940 7.608 0.332 18000 1214 1 6 . 1 1 14 14 ALA N N 213 121.810 121.810 120.753 1.057 18000 1215 1 6 . 1 1 14 14 ALA HA H 213 4.260 4.260 4.001 0.259 18000 1216 1 6 . 1 1 14 14 ALA C C 213 176.630 176.630 179.682 -3.052 18000 1217 1 6 . 1 1 14 14 ALA CA C 213 51.990 51.990 55.443 -3.453 18000 1218 1 6 . 1 1 14 14 ALA CB C 213 16.450 16.450 18.737 -2.287 18000 1219 1 6 . 1 1 14 14 ALA H H 213 7.920 7.920 8.387 -0.467 18000 1220 1 6 . 1 1 15 15 VAL N N 214 121.430 121.430 118.984 2.446 18000 1221 1 6 . 1 1 15 15 VAL HA H 214 3.470 3.470 3.566 -0.096 18000 1222 1 6 . 1 1 15 15 VAL C C 214 174.980 174.980 177.721 -2.741 18000 1223 1 6 . 1 1 15 15 VAL CA C 214 64.190 64.190 66.452 -2.262 18000 1224 1 6 . 1 1 15 15 VAL CB C 214 29.820 29.820 31.345 -1.525 18000 1225 1 6 . 1 1 15 15 VAL H H 214 8.680 8.680 8.546 0.134 18000 1226 1 6 . 1 1 16 16 ASN N N 215 117.460 117.460 118.349 -0.889 18000 1227 1 6 . 1 1 16 16 ASN HA H 215 4.300 4.300 4.451 -0.151 18000 1228 1 6 . 1 1 16 16 ASN C C 215 176.320 176.320 176.721 -0.401 18000 1229 1 6 . 1 1 16 16 ASN CA C 215 54.190 54.190 55.784 -1.594 18000 1230 1 6 . 1 1 16 16 ASN CB C 215 35.360 35.360 37.928 -2.568 18000 1231 1 6 . 1 1 16 16 ASN H H 215 8.190 8.190 8.116 0.074 18000 1232 1 6 . 1 1 17 17 GLU N N 216 119.430 119.430 116.943 2.487 18000 1233 1 6 . 1 1 17 17 GLU HA H 216 4.000 4.000 4.212 -0.212 18000 1234 1 6 . 1 1 17 17 GLU C C 216 177.240 177.240 178.879 -1.639 18000 1235 1 6 . 1 1 17 17 GLU CA C 216 57.180 57.180 58.607 -1.427 18000 1236 1 6 . 1 1 17 17 GLU CB C 216 28.400 28.400 29.637 -1.237 18000 1237 1 6 . 1 1 17 17 GLU H H 216 7.730 7.730 8.423 -0.693 18000 1238 1 6 . 1 1 18 18 VAL N N 217 120.690 120.690 118.848 1.842 18000 1239 1 6 . 1 1 18 18 VAL HA H 217 3.530 3.530 3.939 -0.409 18000 1240 1 6 . 1 1 18 18 VAL C C 217 174.990 174.990 178.303 -3.313 18000 1241 1 6 . 1 1 18 18 VAL CA C 217 64.310 64.310 64.894 -0.584 18000 1242 1 6 . 1 1 18 18 VAL CB C 217 29.640 29.640 31.141 -1.501 18000 1243 1 6 . 1 1 18 18 VAL H H 217 7.820 7.820 7.922 -0.102 18000 1244 1 6 . 1 1 19 19 VAL N N 218 117.010 117.010 115.338 1.672 18000 1245 1 6 . 1 1 19 19 VAL HA H 218 3.500 3.500 3.888 -0.388 18000 1246 1 6 . 1 1 19 19 VAL C C 218 175.200 175.200 176.530 -1.330 18000 1247 1 6 . 1 1 19 19 VAL CA C 218 64.960 64.960 64.696 0.264 18000 1248 1 6 . 1 1 19 19 VAL CB C 218 29.710 29.710 31.474 -1.764 18000 1249 1 6 . 1 1 19 19 VAL H H 218 8.260 8.260 7.643 0.617 18000 1250 1 6 . 1 1 20 20 ALA N N 219 120.360 120.360 118.463 1.897 18000 1251 1 6 . 1 1 20 20 ALA HA H 219 3.930 3.930 4.313 -0.383 18000 1252 1 6 . 1 1 20 20 ALA C C 219 178.310 178.310 177.899 0.411 18000 1253 1 6 . 1 1 20 20 ALA CA C 219 53.040 53.040 51.407 1.633 18000 1254 1 6 . 1 1 20 20 ALA CB C 219 16.280 16.280 18.922 -2.642 18000 1255 1 6 . 1 1 20 20 ALA H H 219 7.490 7.490 7.341 0.149 18000 1256 1 6 . 1 1 21 21 GLY N N 220 124.250 124.250 109.352 14.898 18000 1257 1 6 . 1 1 21 21 GLY HA H 220 4.250 4.250 4.219 0.031 18000 1258 1 6 . 1 1 21 21 GLY C C 220 172.880 172.880 174.709 -1.829 18000 1259 1 6 . 1 1 21 21 GLY CA C 220 44.130 44.130 44.622 -0.492 18000 1260 1 6 . 1 1 21 21 GLY CB C 220 29.290 29.290 29.001 0.289 18000 1261 1 6 . 1 1 21 21 GLY H H 220 7.640 7.640 7.469 0.171 18000 1262 1 6 . 1 1 22 22 ILE N N 221 119.940 119.940 126.390 -6.450 18000 1263 1 6 . 1 1 22 22 ILE HA H 221 3.290 3.290 4.218 -0.928 18000 1264 1 6 . 1 1 22 22 ILE C C 221 175.100 175.100 175.002 0.098 18000 1265 1 6 . 1 1 22 22 ILE CA C 221 64.070 64.070 59.217 4.854 18000 1266 1 6 . 1 1 22 22 ILE CB C 221 35.260 35.260 37.406 -2.146 18000 1267 1 6 . 1 1 22 22 ILE H H 221 8.130 8.130 8.004 0.126 18000 1268 1 6 . 1 1 23 23 LYS HA H 222 3.430 3.430 4.475 -1.045 18000 1269 1 6 . 1 1 23 23 LYS C C 222 175.280 175.280 175.226 0.054 18000 1270 1 6 . 1 1 23 23 LYS CA C 222 59.270 59.270 56.458 2.812 18000 1271 1 6 . 1 1 23 23 LYS CB C 222 30.670 30.670 31.550 -0.880 18000 1272 1 6 . 1 1 24 24 GLU N N 223 116.150 116.150 121.045 -4.895 18000 1273 1 6 . 1 1 24 24 GLU HA H 223 4.150 4.150 4.374 -0.224 18000 1274 1 6 . 1 1 24 24 GLU C C 223 177.330 177.330 176.235 1.095 18000 1275 1 6 . 1 1 24 24 GLU CA C 223 57.180 57.180 56.405 0.775 18000 1276 1 6 . 1 1 24 24 GLU CB C 223 27.670 27.670 30.771 -3.101 18000 1277 1 6 . 1 1 24 24 GLU H H 223 7.830 7.830 8.397 -0.567 18000 1278 1 6 . 1 1 25 25 TYR N N 224 119.760 119.760 119.378 0.382 18000 1279 1 6 . 1 1 25 25 TYR HA H 224 4.480 4.480 4.740 -0.260 18000 1280 1 6 . 1 1 25 25 TYR C C 224 175.680 175.680 174.353 1.327 18000 1281 1 6 . 1 1 25 25 TYR CA C 224 57.520 57.520 57.656 -0.136 18000 1282 1 6 . 1 1 25 25 TYR CB C 224 36.940 36.940 40.895 -3.955 18000 1283 1 6 . 1 1 25 25 TYR H H 224 8.630 8.630 7.964 0.666 18000 1284 1 6 . 1 1 26 26 PHE N N 225 120.090 120.090 124.065 -3.975 18000 1285 1 6 . 1 1 26 26 PHE HA H 225 3.410 3.410 4.572 -1.162 18000 1286 1 6 . 1 1 26 26 PHE C C 225 173.930 173.930 174.466 -0.536 18000 1287 1 6 . 1 1 26 26 PHE CA C 225 61.600 61.600 59.025 2.575 18000 1288 1 6 . 1 1 26 26 PHE CB C 225 36.590 36.590 39.398 -2.808 18000 1289 1 6 . 1 1 26 26 PHE H H 225 9.220 9.220 8.792 0.428 18000 1290 1 6 . 1 1 27 27 ASN N N 226 115.010 115.010 123.268 -8.258 18000 1291 1 6 . 1 1 27 27 ASN HA H 226 4.470 4.470 4.729 -0.259 18000 1292 1 6 . 1 1 27 27 ASN C C 226 176.630 176.630 173.578 3.052 18000 1293 1 6 . 1 1 27 27 ASN CA C 226 54.160 54.160 51.561 2.599 18000 1294 1 6 . 1 1 27 27 ASN CB C 226 35.800 35.800 41.909 -6.109 18000 1295 1 6 . 1 1 27 27 ASN H H 226 8.210 8.210 8.292 -0.082 18000 1296 1 6 . 1 1 28 28 VAL N N 227 115.120 115.120 122.114 -6.994 18000 1297 1 6 . 1 1 28 28 VAL HA H 227 4.300 4.300 4.317 -0.017 18000 1298 1 6 . 1 1 28 28 VAL C C 227 174.960 174.960 174.273 0.687 18000 1299 1 6 . 1 1 28 28 VAL CA C 227 61.320 61.320 59.362 1.958 18000 1300 1 6 . 1 1 28 28 VAL CB C 227 30.670 30.670 31.541 -0.871 18000 1301 1 6 . 1 1 28 28 VAL H H 227 7.430 7.430 8.145 -0.715 18000 1302 1 6 . 1 1 29 29 MET HA H 228 4.000 4.000 4.358 -0.358 18000 1303 1 6 . 1 1 29 29 MET C C 228 176.270 176.270 176.168 0.102 18000 1304 1 6 . 1 1 29 29 MET CA C 228 54.030 54.030 55.216 -1.186 18000 1305 1 6 . 1 1 29 29 MET CB C 228 31.510 31.510 33.273 -1.763 18000 1306 1 6 . 1 1 30 30 LEU N N 229 122.180 122.180 124.317 -2.137 18000 1307 1 6 . 1 1 30 30 LEU HA H 229 3.150 3.150 3.962 -0.812 18000 1308 1 6 . 1 1 30 30 LEU C C 229 176.070 176.070 178.678 -2.608 18000 1309 1 6 . 1 1 30 30 LEU CA C 229 55.860 55.860 57.691 -1.831 18000 1310 1 6 . 1 1 30 30 LEU CB C 229 36.340 36.340 41.794 -5.454 18000 1311 1 6 . 1 1 30 30 LEU H H 229 7.890 7.890 8.686 -0.796 18000 1312 1 6 . 1 1 31 31 GLY N N 230 118.390 118.390 105.854 12.536 18000 1313 1 6 . 1 1 31 31 GLY HA H 230 4.090 4.090 4.155 -0.065 18000 1314 1 6 . 1 1 31 31 GLY C C 230 173.070 173.070 175.188 -2.118 18000 1315 1 6 . 1 1 31 31 GLY CA C 230 43.150 43.150 47.015 -3.865 18000 1316 1 6 . 1 1 31 31 GLY CB C 230 26.780 26.780 28.621 -1.841 18000 1317 1 6 . 1 1 31 31 GLY H H 230 8.350 8.350 8.786 -0.436 18000 1318 1 6 . 1 1 32 32 THR N N 231 124.790 124.790 113.056 11.734 18000 1319 1 6 . 1 1 32 32 THR HA H 231 4.280 4.280 4.475 -0.195 18000 1320 1 6 . 1 1 32 32 THR C C 231 173.260 173.260 175.448 -2.188 18000 1321 1 6 . 1 1 32 32 THR CA C 231 60.030 60.030 63.058 -3.028 18000 1322 1 6 . 1 1 32 32 THR CB C 231 68.540 68.540 69.891 -1.351 18000 1323 1 6 . 1 1 32 32 THR H H 231 7.040 7.040 8.327 -1.287 18000 1324 1 6 . 1 1 33 33 GLN N N 232 114.740 114.740 117.856 -3.116 18000 1325 1 6 . 1 1 33 33 GLN HA H 232 5.090 5.090 4.373 0.717 18000 1326 1 6 . 1 1 33 33 GLN C C 232 175.790 175.790 175.789 0.001 18000 1327 1 6 . 1 1 33 33 GLN CA C 232 53.650 53.650 56.329 -2.679 18000 1328 1 6 . 1 1 33 33 GLN CB C 232 30.520 30.520 29.838 0.682 18000 1329 1 6 . 1 1 33 33 GLN H H 232 8.110 8.110 7.756 0.354 18000 1330 1 6 . 1 1 34 34 LEU N N 233 112.480 112.480 119.834 -7.354 18000 1331 1 6 . 1 1 34 34 LEU HA H 233 4.460 4.460 4.361 0.099 18000 1332 1 6 . 1 1 34 34 LEU C C 233 172.610 172.610 175.552 -2.942 18000 1333 1 6 . 1 1 34 34 LEU CA C 233 52.460 52.460 54.611 -2.151 18000 1334 1 6 . 1 1 34 34 LEU CB C 233 39.140 39.140 43.793 -4.653 18000 1335 1 6 . 1 1 34 34 LEU H H 233 6.980 6.980 8.182 -1.202 18000 1336 1 6 . 1 1 35 35 LEU N N 234 115.860 115.860 126.117 -10.257 18000 1337 1 6 . 1 1 35 35 LEU HA H 234 4.510 4.510 4.212 0.298 18000 1338 1 6 . 1 1 35 35 LEU C C 234 178.330 178.330 175.798 2.532 18000 1339 1 6 . 1 1 35 35 LEU CA C 234 51.900 51.900 56.501 -4.601 18000 1340 1 6 . 1 1 35 35 LEU CB C 234 40.950 40.950 42.576 -1.626 18000 1341 1 6 . 1 1 35 35 LEU H H 234 7.560 7.560 7.783 -0.223 18000 1342 1 6 . 1 1 36 36 TYR N N 235 125.850 125.850 124.821 1.029 18000 1343 1 6 . 1 1 36 36 TYR HA H 235 4.790 4.790 4.649 0.141 18000 1344 1 6 . 1 1 36 36 TYR C C 235 176.260 176.260 175.132 1.128 18000 1345 1 6 . 1 1 36 36 TYR CA C 235 57.750 57.750 56.550 1.200 18000 1346 1 6 . 1 1 36 36 TYR CB C 235 37.100 37.100 40.434 -3.334 18000 1347 1 6 . 1 1 36 36 TYR H H 235 9.750 9.750 8.012 1.738 18000 1348 1 6 . 1 1 37 37 LYS N N 236 123.880 123.880 126.294 -2.414 18000 1349 1 6 . 1 1 37 37 LYS HA H 236 3.930 3.930 4.168 -0.238 18000 1350 1 6 . 1 1 37 37 LYS C C 236 178.280 178.280 174.995 3.285 18000 1351 1 6 . 1 1 37 37 LYS CA C 236 59.210 59.210 56.723 2.487 18000 1352 1 6 . 1 1 37 37 LYS CB C 236 30.430 30.430 32.279 -1.849 18000 1353 1 6 . 1 1 37 37 LYS H H 236 9.340 9.340 8.436 0.904 18000 1354 1 6 . 1 1 38 38 PHE N N 237 117.150 117.150 120.620 -3.470 18000 1355 1 6 . 1 1 38 38 PHE HA H 237 4.460 4.460 4.868 -0.408 18000 1356 1 6 . 1 1 38 38 PHE C C 237 173.930 173.930 174.875 -0.945 18000 1357 1 6 . 1 1 38 38 PHE CA C 237 58.510 58.510 55.279 3.231 18000 1358 1 6 . 1 1 38 38 PHE CB C 237 38.370 38.370 39.676 -1.306 18000 1359 1 6 . 1 1 38 38 PHE H H 237 9.120 9.120 8.412 0.708 18000 1360 1 6 . 1 1 39 39 GLU HA H 238 4.160 4.160 4.224 -0.064 18000 1361 1 6 . 1 1 39 39 GLU C C 238 175.650 175.650 176.709 -1.059 18000 1362 1 6 . 1 1 39 39 GLU CA C 238 55.070 55.070 56.961 -1.891 18000 1363 1 6 . 1 1 39 39 GLU CB C 238 31.540 31.540 29.969 1.571 18000 1364 1 6 . 1 1 40 40 ARG N N 239 120.330 120.330 124.125 -3.795 18000 1365 1 6 . 1 1 40 40 ARG HA H 239 4.250 4.250 4.153 0.097 18000 1366 1 6 . 1 1 40 40 ARG C C 239 174.490 174.490 176.043 -1.553 18000 1367 1 6 . 1 1 40 40 ARG CA C 239 60.410 60.410 55.815 4.595 18000 1368 1 6 . 1 1 40 40 ARG H H 239 7.980 7.980 8.522 -0.542 18000 1369 1 6 . 1 1 41 41 PRO N N 240 115.390 115.390 119.317 -3.927 18000 1370 1 6 . 1 1 41 41 PRO HA H 240 4.360 4.360 4.442 -0.082 18000 1371 1 6 . 1 1 41 41 PRO C C 240 176.330 176.330 177.328 -0.998 18000 1372 1 6 . 1 1 41 41 PRO CA C 240 64.400 64.400 64.423 -0.023 18000 1373 1 6 . 1 1 41 41 PRO CB C 240 62.240 62.240 63.605 -1.365 18000 1374 1 6 . 1 1 41 41 PRO H H 240 8.090 8.090 8.180 -0.090 18000 1375 1 7 . 1 1 2 2 ARG N N 201 119.330 119.330 123.613 -4.283 18000 1376 1 7 . 1 1 2 2 ARG HA H 201 3.560 3.560 4.502 -0.942 18000 1377 1 7 . 1 1 2 2 ARG C C 201 176.850 176.850 174.343 2.507 18000 1378 1 7 . 1 1 2 2 ARG CA C 201 55.340 55.340 55.490 -0.150 18000 1379 1 7 . 1 1 2 2 ARG CB C 201 27.020 27.020 31.216 -4.196 18000 1380 1 7 . 1 1 2 2 ARG H H 201 8.370 8.370 8.276 0.094 18000 1381 1 7 . 1 1 3 3 LYS N N 202 118.540 118.540 127.834 -9.294 18000 1382 1 7 . 1 1 3 3 LYS HA H 202 4.010 4.010 4.282 -0.272 18000 1383 1 7 . 1 1 3 3 LYS C C 202 176.090 176.090 175.523 0.567 18000 1384 1 7 . 1 1 3 3 LYS CA C 202 56.960 56.960 56.599 0.361 18000 1385 1 7 . 1 1 3 3 LYS CB C 202 30.590 30.590 32.569 -1.979 18000 1386 1 7 . 1 1 3 3 LYS H H 202 7.940 7.940 8.196 -0.256 18000 1387 1 7 . 1 1 4 4 SER N N 203 113.880 113.880 124.122 -10.242 18000 1388 1 7 . 1 1 4 4 SER HA H 203 4.320 4.320 4.720 -0.400 18000 1389 1 7 . 1 1 4 4 SER C C 203 172.900 172.900 172.775 0.125 18000 1390 1 7 . 1 1 4 4 SER CA C 203 57.870 57.870 55.531 2.339 18000 1391 1 7 . 1 1 4 4 SER CB C 203 61.700 61.700 62.956 -1.256 18000 1392 1 7 . 1 1 4 4 SER H H 203 7.700 7.700 8.374 -0.674 18000 1393 1 7 . 1 1 5 5 ARG HA H 204 4.240 4.240 4.216 0.024 18000 1394 1 7 . 1 1 5 5 ARG C C 204 174.810 174.810 174.923 -0.113 18000 1395 1 7 . 1 1 5 5 ARG CA C 204 54.270 54.270 55.670 -1.400 18000 1396 1 7 . 1 1 5 5 ARG CB C 204 28.700 28.700 30.661 -1.961 18000 1397 1 7 . 1 1 6 6 GLY N N 205 125.950 125.950 109.452 16.498 18000 1398 1 7 . 1 1 6 6 GLY HA H 205 4.400 4.400 4.385 0.015 18000 1399 1 7 . 1 1 6 6 GLY C C 205 171.910 171.910 173.747 -1.837 18000 1400 1 7 . 1 1 6 6 GLY CA C 205 43.570 43.570 44.477 -0.907 18000 1401 1 7 . 1 1 6 6 GLY CB C 205 28.340 28.340 29.721 -1.381 18000 1402 1 7 . 1 1 6 6 GLY H H 205 7.930 7.930 8.341 -0.411 18000 1403 1 7 . 1 1 7 7 ASN N N 206 118.380 118.380 120.481 -2.101 18000 1404 1 7 . 1 1 7 7 ASN HA H 206 4.760 4.760 4.790 -0.030 18000 1405 1 7 . 1 1 7 7 ASN C C 206 173.810 173.810 177.593 -3.783 18000 1406 1 7 . 1 1 7 7 ASN CA C 206 51.430 51.430 53.831 -2.401 18000 1407 1 7 . 1 1 7 7 ASN CB C 206 37.090 37.090 38.041 -0.951 18000 1408 1 7 . 1 1 7 7 ASN H H 206 8.330 8.330 8.824 -0.494 18000 1409 1 7 . 1 1 8 8 THR N N 207 119.850 119.850 121.364 -1.514 18000 1410 1 7 . 1 1 8 8 THR HA H 207 4.270 4.270 4.161 0.109 18000 1411 1 7 . 1 1 8 8 THR C C 207 172.560 172.560 176.799 -4.239 18000 1412 1 7 . 1 1 8 8 THR CA C 207 60.420 60.420 65.403 -4.983 18000 1413 1 7 . 1 1 8 8 THR CB C 207 67.750 67.750 68.149 -0.399 18000 1414 1 7 . 1 1 8 8 THR H H 207 7.830 7.830 8.542 -0.712 18000 1415 1 7 . 1 1 9 9 ASP N N 208 121.180 121.180 117.831 3.349 18000 1416 1 7 . 1 1 9 9 ASP HA H 208 4.550 4.550 4.616 -0.066 18000 1417 1 7 . 1 1 9 9 ASP C C 208 174.170 174.170 176.881 -2.711 18000 1418 1 7 . 1 1 9 9 ASP CA C 208 52.670 52.670 58.466 -5.796 18000 1419 1 7 . 1 1 9 9 ASP CB C 208 39.120 39.120 37.814 1.306 18000 1420 1 7 . 1 1 9 9 ASP H H 208 8.350 8.350 8.755 -0.405 18000 1421 1 7 . 1 1 10 10 ASN HA H 209 4.600 4.600 4.460 0.140 18000 1422 1 7 . 1 1 10 10 ASN C C 209 173.670 173.670 177.605 -3.935 18000 1423 1 7 . 1 1 10 10 ASN CA C 209 52.110 52.110 56.206 -4.096 18000 1424 1 7 . 1 1 10 10 ASN CB C 209 36.730 36.730 37.965 -1.236 18000 1425 1 7 . 1 1 11 11 LYS N N 210 120.380 120.380 117.244 3.136 18000 1426 1 7 . 1 1 11 11 LYS HA H 210 4.270 4.270 4.048 0.222 18000 1427 1 7 . 1 1 11 11 LYS C C 210 174.910 174.910 178.821 -3.911 18000 1428 1 7 . 1 1 11 11 LYS CA C 210 54.900 54.900 60.245 -5.345 18000 1429 1 7 . 1 1 11 11 LYS CB C 210 30.670 30.670 32.274 -1.604 18000 1430 1 7 . 1 1 11 11 LYS H H 210 8.210 8.210 8.479 -0.269 18000 1431 1 7 . 1 1 12 12 GLU N N 211 120.740 120.740 120.796 -0.056 18000 1432 1 7 . 1 1 12 12 GLU HA H 211 4.070 4.070 4.028 0.042 18000 1433 1 7 . 1 1 12 12 GLU C C 211 174.810 174.810 179.401 -4.591 18000 1434 1 7 . 1 1 12 12 GLU CA C 211 55.940 55.940 59.889 -3.950 18000 1435 1 7 . 1 1 12 12 GLU CB C 211 27.700 27.700 29.595 -1.895 18000 1436 1 7 . 1 1 12 12 GLU H H 211 8.380 8.380 8.312 0.068 18000 1437 1 7 . 1 1 13 13 TYR N N 212 119.430 119.430 119.003 0.427 18000 1438 1 7 . 1 1 13 13 TYR HA H 212 4.380 4.380 4.239 0.141 18000 1439 1 7 . 1 1 13 13 TYR C C 212 174.830 174.830 178.329 -3.499 18000 1440 1 7 . 1 1 13 13 TYR CA C 212 57.420 57.420 61.008 -3.588 18000 1441 1 7 . 1 1 13 13 TYR CB C 212 36.530 36.530 38.094 -1.564 18000 1442 1 7 . 1 1 13 13 TYR H H 212 7.940 7.940 8.844 -0.904 18000 1443 1 7 . 1 1 14 14 ALA N N 213 121.810 121.810 120.712 1.098 18000 1444 1 7 . 1 1 14 14 ALA HA H 213 4.260 4.260 4.048 0.212 18000 1445 1 7 . 1 1 14 14 ALA C C 213 176.630 176.630 179.464 -2.834 18000 1446 1 7 . 1 1 14 14 ALA CA C 213 51.990 51.990 55.128 -3.138 18000 1447 1 7 . 1 1 14 14 ALA CB C 213 16.450 16.450 18.652 -2.202 18000 1448 1 7 . 1 1 14 14 ALA H H 213 7.920 7.920 7.988 -0.068 18000 1449 1 7 . 1 1 15 15 VAL N N 214 121.430 121.430 119.596 1.834 18000 1450 1 7 . 1 1 15 15 VAL HA H 214 3.470 3.470 3.545 -0.075 18000 1451 1 7 . 1 1 15 15 VAL C C 214 174.980 174.980 177.698 -2.718 18000 1452 1 7 . 1 1 15 15 VAL CA C 214 64.190 64.190 66.515 -2.325 18000 1453 1 7 . 1 1 15 15 VAL CB C 214 29.820 29.820 31.256 -1.436 18000 1454 1 7 . 1 1 15 15 VAL H H 214 8.680 8.680 8.468 0.212 18000 1455 1 7 . 1 1 16 16 ASN N N 215 117.460 117.460 118.017 -0.557 18000 1456 1 7 . 1 1 16 16 ASN HA H 215 4.300 4.300 4.452 -0.152 18000 1457 1 7 . 1 1 16 16 ASN C C 215 176.320 176.320 177.009 -0.689 18000 1458 1 7 . 1 1 16 16 ASN CA C 215 54.190 54.190 55.666 -1.476 18000 1459 1 7 . 1 1 16 16 ASN CB C 215 35.360 35.360 37.937 -2.577 18000 1460 1 7 . 1 1 16 16 ASN H H 215 8.190 8.190 8.198 -0.008 18000 1461 1 7 . 1 1 17 17 GLU N N 216 119.430 119.430 118.255 1.175 18000 1462 1 7 . 1 1 17 17 GLU HA H 216 4.000 4.000 4.178 -0.178 18000 1463 1 7 . 1 1 17 17 GLU C C 216 177.240 177.240 178.689 -1.449 18000 1464 1 7 . 1 1 17 17 GLU CA C 216 57.180 57.180 58.494 -1.314 18000 1465 1 7 . 1 1 17 17 GLU CB C 216 28.400 28.400 29.719 -1.319 18000 1466 1 7 . 1 1 17 17 GLU H H 216 7.730 7.730 8.090 -0.360 18000 1467 1 7 . 1 1 18 18 VAL N N 217 120.690 120.690 118.675 2.015 18000 1468 1 7 . 1 1 18 18 VAL HA H 217 3.530 3.530 3.904 -0.374 18000 1469 1 7 . 1 1 18 18 VAL C C 217 174.990 174.990 178.178 -3.188 18000 1470 1 7 . 1 1 18 18 VAL CA C 217 64.310 64.310 64.950 -0.640 18000 1471 1 7 . 1 1 18 18 VAL CB C 217 29.640 29.640 31.148 -1.508 18000 1472 1 7 . 1 1 18 18 VAL H H 217 7.820 7.820 8.117 -0.297 18000 1473 1 7 . 1 1 19 19 VAL N N 218 117.010 117.010 116.936 0.074 18000 1474 1 7 . 1 1 19 19 VAL HA H 218 3.500 3.500 3.959 -0.459 18000 1475 1 7 . 1 1 19 19 VAL C C 218 175.200 175.200 176.603 -1.403 18000 1476 1 7 . 1 1 19 19 VAL CA C 218 64.960 64.960 64.426 0.534 18000 1477 1 7 . 1 1 19 19 VAL CB C 218 29.710 29.710 31.698 -1.988 18000 1478 1 7 . 1 1 19 19 VAL H H 218 8.260 8.260 7.664 0.596 18000 1479 1 7 . 1 1 20 20 ALA N N 219 120.360 120.360 121.069 -0.709 18000 1480 1 7 . 1 1 20 20 ALA HA H 219 3.930 3.930 4.493 -0.563 18000 1481 1 7 . 1 1 20 20 ALA C C 219 178.310 178.310 176.704 1.606 18000 1482 1 7 . 1 1 20 20 ALA CA C 219 53.040 53.040 50.691 2.349 18000 1483 1 7 . 1 1 20 20 ALA CB C 219 16.280 16.280 18.334 -2.054 18000 1484 1 7 . 1 1 20 20 ALA H H 219 7.490 7.490 7.668 -0.178 18000 1485 1 7 . 1 1 21 21 GLY N N 220 124.250 124.250 109.712 14.538 18000 1486 1 7 . 1 1 21 21 GLY HA H 220 4.250 4.250 4.150 0.100 18000 1487 1 7 . 1 1 21 21 GLY C C 220 172.880 172.880 174.593 -1.713 18000 1488 1 7 . 1 1 21 21 GLY CA C 220 44.130 44.130 45.820 -1.690 18000 1489 1 7 . 1 1 21 21 GLY CB C 220 29.290 29.290 29.146 0.144 18000 1490 1 7 . 1 1 21 21 GLY H H 220 7.640 7.640 7.451 0.189 18000 1491 1 7 . 1 1 22 22 ILE N N 221 119.940 119.940 126.418 -6.478 18000 1492 1 7 . 1 1 22 22 ILE HA H 221 3.290 3.290 4.311 -1.021 18000 1493 1 7 . 1 1 22 22 ILE C C 221 175.100 175.100 174.116 0.984 18000 1494 1 7 . 1 1 22 22 ILE CA C 221 64.070 64.070 58.996 5.074 18000 1495 1 7 . 1 1 22 22 ILE CB C 221 35.260 35.260 38.518 -3.258 18000 1496 1 7 . 1 1 22 22 ILE H H 221 8.130 8.130 7.902 0.228 18000 1497 1 7 . 1 1 23 23 LYS HA H 222 3.430 3.430 4.579 -1.149 18000 1498 1 7 . 1 1 23 23 LYS C C 222 175.280 175.280 175.507 -0.227 18000 1499 1 7 . 1 1 23 23 LYS CA C 222 59.270 59.270 55.983 3.287 18000 1500 1 7 . 1 1 23 23 LYS CB C 222 30.670 30.670 33.678 -3.008 18000 1501 1 7 . 1 1 24 24 GLU N N 223 116.150 116.150 120.804 -4.654 18000 1502 1 7 . 1 1 24 24 GLU HA H 223 4.150 4.150 4.405 -0.255 18000 1503 1 7 . 1 1 24 24 GLU C C 223 177.330 177.330 176.218 1.112 18000 1504 1 7 . 1 1 24 24 GLU CA C 223 57.180 57.180 56.592 0.588 18000 1505 1 7 . 1 1 24 24 GLU CB C 223 27.670 27.670 30.318 -2.648 18000 1506 1 7 . 1 1 24 24 GLU H H 223 7.830 7.830 8.526 -0.696 18000 1507 1 7 . 1 1 25 25 TYR N N 224 119.760 119.760 119.298 0.462 18000 1508 1 7 . 1 1 25 25 TYR HA H 224 4.480 4.480 4.689 -0.209 18000 1509 1 7 . 1 1 25 25 TYR C C 224 175.680 175.680 173.958 1.722 18000 1510 1 7 . 1 1 25 25 TYR CA C 224 57.520 57.520 57.427 0.093 18000 1511 1 7 . 1 1 25 25 TYR CB C 224 36.940 36.940 40.997 -4.057 18000 1512 1 7 . 1 1 25 25 TYR H H 224 8.630 8.630 7.758 0.872 18000 1513 1 7 . 1 1 26 26 PHE N N 225 120.090 120.090 124.159 -4.069 18000 1514 1 7 . 1 1 26 26 PHE HA H 225 3.410 3.410 4.430 -1.020 18000 1515 1 7 . 1 1 26 26 PHE C C 225 173.930 173.930 174.647 -0.717 18000 1516 1 7 . 1 1 26 26 PHE CA C 225 61.600 61.600 58.965 2.635 18000 1517 1 7 . 1 1 26 26 PHE CB C 225 36.590 36.590 39.130 -2.540 18000 1518 1 7 . 1 1 26 26 PHE H H 225 9.220 9.220 8.707 0.513 18000 1519 1 7 . 1 1 27 27 ASN N N 226 115.010 115.010 123.998 -8.988 18000 1520 1 7 . 1 1 27 27 ASN HA H 226 4.470 4.470 4.702 -0.232 18000 1521 1 7 . 1 1 27 27 ASN C C 226 176.630 176.630 173.615 3.015 18000 1522 1 7 . 1 1 27 27 ASN CA C 226 54.160 54.160 51.493 2.667 18000 1523 1 7 . 1 1 27 27 ASN CB C 226 35.800 35.800 41.724 -5.923 18000 1524 1 7 . 1 1 27 27 ASN H H 226 8.210 8.210 8.472 -0.262 18000 1525 1 7 . 1 1 28 28 VAL N N 227 115.120 115.120 122.253 -7.133 18000 1526 1 7 . 1 1 28 28 VAL HA H 227 4.300 4.300 4.355 -0.055 18000 1527 1 7 . 1 1 28 28 VAL C C 227 174.960 174.960 174.226 0.734 18000 1528 1 7 . 1 1 28 28 VAL CA C 227 61.320 61.320 59.088 2.232 18000 1529 1 7 . 1 1 28 28 VAL CB C 227 30.670 30.670 31.616 -0.945 18000 1530 1 7 . 1 1 28 28 VAL H H 227 7.430 7.430 8.088 -0.658 18000 1531 1 7 . 1 1 29 29 MET HA H 228 4.000 4.000 4.342 -0.342 18000 1532 1 7 . 1 1 29 29 MET C C 228 176.270 176.270 176.301 -0.031 18000 1533 1 7 . 1 1 29 29 MET CA C 228 54.030 54.030 55.403 -1.373 18000 1534 1 7 . 1 1 29 29 MET CB C 228 31.510 31.510 33.359 -1.849 18000 1535 1 7 . 1 1 30 30 LEU N N 229 122.180 122.180 121.325 0.855 18000 1536 1 7 . 1 1 30 30 LEU HA H 229 3.150 3.150 3.966 -0.816 18000 1537 1 7 . 1 1 30 30 LEU C C 229 176.070 176.070 177.423 -1.353 18000 1538 1 7 . 1 1 30 30 LEU CA C 229 55.860 55.860 57.737 -1.877 18000 1539 1 7 . 1 1 30 30 LEU CB C 229 36.340 36.340 42.065 -5.725 18000 1540 1 7 . 1 1 30 30 LEU H H 229 7.890 7.890 8.464 -0.574 18000 1541 1 7 . 1 1 31 31 GLY N N 230 118.390 118.390 106.319 12.071 18000 1542 1 7 . 1 1 31 31 GLY HA H 230 4.090 4.090 4.154 -0.063 18000 1543 1 7 . 1 1 31 31 GLY C C 230 173.070 173.070 174.916 -1.846 18000 1544 1 7 . 1 1 31 31 GLY CA C 230 43.150 43.150 46.730 -3.580 18000 1545 1 7 . 1 1 31 31 GLY CB C 230 26.780 26.780 28.900 -2.120 18000 1546 1 7 . 1 1 31 31 GLY H H 230 8.350 8.350 8.609 -0.259 18000 1547 1 7 . 1 1 32 32 THR N N 231 124.790 124.790 113.418 11.372 18000 1548 1 7 . 1 1 32 32 THR HA H 231 4.280 4.280 4.370 -0.090 18000 1549 1 7 . 1 1 32 32 THR C C 231 173.260 173.260 176.204 -2.944 18000 1550 1 7 . 1 1 32 32 THR CA C 231 60.030 60.030 64.215 -4.185 18000 1551 1 7 . 1 1 32 32 THR CB C 231 68.540 68.540 70.009 -1.469 18000 1552 1 7 . 1 1 32 32 THR H H 231 7.040 7.040 7.498 -0.458 18000 1553 1 7 . 1 1 33 33 GLN N N 232 114.740 114.740 116.777 -2.037 18000 1554 1 7 . 1 1 33 33 GLN HA H 232 5.090 5.090 4.281 0.809 18000 1555 1 7 . 1 1 33 33 GLN C C 232 175.790 175.790 176.269 -0.479 18000 1556 1 7 . 1 1 33 33 GLN CA C 232 53.650 53.650 56.437 -2.787 18000 1557 1 7 . 1 1 33 33 GLN CB C 232 30.520 30.520 30.631 -0.111 18000 1558 1 7 . 1 1 33 33 GLN H H 232 8.110 8.110 8.425 -0.315 18000 1559 1 7 . 1 1 34 34 LEU N N 233 112.480 112.480 121.081 -8.601 18000 1560 1 7 . 1 1 34 34 LEU HA H 233 4.460 4.460 4.051 0.409 18000 1561 1 7 . 1 1 34 34 LEU C C 233 172.610 172.610 175.619 -3.009 18000 1562 1 7 . 1 1 34 34 LEU CA C 233 52.460 52.460 56.794 -4.333 18000 1563 1 7 . 1 1 34 34 LEU CB C 233 39.140 39.140 41.054 -1.914 18000 1564 1 7 . 1 1 34 34 LEU H H 233 6.980 6.980 8.444 -1.464 18000 1565 1 7 . 1 1 35 35 LEU N N 234 115.860 115.860 117.744 -1.884 18000 1566 1 7 . 1 1 35 35 LEU HA H 234 4.510 4.510 4.029 0.481 18000 1567 1 7 . 1 1 35 35 LEU C C 234 178.330 178.330 177.467 0.863 18000 1568 1 7 . 1 1 35 35 LEU CA C 234 51.900 51.900 56.521 -4.621 18000 1569 1 7 . 1 1 35 35 LEU CB C 234 40.950 40.950 41.142 -0.193 18000 1570 1 7 . 1 1 35 35 LEU H H 234 7.560 7.560 7.255 0.305 18000 1571 1 7 . 1 1 36 36 TYR N N 235 125.850 125.850 118.881 6.969 18000 1572 1 7 . 1 1 36 36 TYR HA H 235 4.790 4.790 4.320 0.470 18000 1573 1 7 . 1 1 36 36 TYR C C 235 176.260 176.260 176.094 0.166 18000 1574 1 7 . 1 1 36 36 TYR CA C 235 57.750 57.750 59.098 -1.348 18000 1575 1 7 . 1 1 36 36 TYR CB C 235 37.100 37.100 38.583 -1.483 18000 1576 1 7 . 1 1 36 36 TYR H H 235 9.750 9.750 8.194 1.556 18000 1577 1 7 . 1 1 37 37 LYS N N 236 123.880 123.880 119.701 4.179 18000 1578 1 7 . 1 1 37 37 LYS HA H 236 3.930 3.930 3.959 -0.029 18000 1579 1 7 . 1 1 37 37 LYS C C 236 178.280 178.280 175.427 2.853 18000 1580 1 7 . 1 1 37 37 LYS CA C 236 59.210 59.210 56.743 2.467 18000 1581 1 7 . 1 1 37 37 LYS CB C 236 30.430 30.430 30.870 -0.440 18000 1582 1 7 . 1 1 37 37 LYS H H 236 9.340 9.340 7.685 1.655 18000 1583 1 7 . 1 1 38 38 PHE N N 237 117.150 117.150 113.295 3.855 18000 1584 1 7 . 1 1 38 38 PHE HA H 237 4.460 4.460 4.267 0.193 18000 1585 1 7 . 1 1 38 38 PHE C C 237 173.930 173.930 173.565 0.365 18000 1586 1 7 . 1 1 38 38 PHE CA C 237 58.510 58.510 57.396 1.114 18000 1587 1 7 . 1 1 38 38 PHE CB C 237 38.370 38.370 38.300 0.070 18000 1588 1 7 . 1 1 38 38 PHE H H 237 9.120 9.120 7.491 1.629 18000 1589 1 7 . 1 1 39 39 GLU HA H 238 4.160 4.160 4.439 -0.279 18000 1590 1 7 . 1 1 39 39 GLU C C 238 175.650 175.650 175.478 0.172 18000 1591 1 7 . 1 1 39 39 GLU CA C 238 55.070 55.070 56.539 -1.469 18000 1592 1 7 . 1 1 39 39 GLU CB C 238 31.540 31.540 28.790 2.750 18000 1593 1 7 . 1 1 40 40 ARG N N 239 120.330 120.330 122.195 -1.865 18000 1594 1 7 . 1 1 40 40 ARG HA H 239 4.250 4.250 4.535 -0.285 18000 1595 1 7 . 1 1 40 40 ARG C C 239 174.490 174.490 174.741 -0.251 18000 1596 1 7 . 1 1 40 40 ARG CA C 239 60.410 60.410 56.274 4.136 18000 1597 1 7 . 1 1 40 40 ARG H H 239 7.980 7.980 7.820 0.160 18000 1598 1 7 . 1 1 41 41 PRO N N 240 115.390 115.390 115.232 0.158 18000 1599 1 7 . 1 1 41 41 PRO HA H 240 4.360 4.360 4.188 0.172 18000 1600 1 7 . 1 1 41 41 PRO C C 240 176.330 176.330 177.120 -0.790 18000 1601 1 7 . 1 1 41 41 PRO CA C 240 64.400 64.400 63.560 0.840 18000 1602 1 7 . 1 1 41 41 PRO CB C 240 62.240 62.240 62.903 -0.663 18000 1603 1 7 . 1 1 41 41 PRO H H 240 8.090 8.090 8.502 -0.412 18000 1604 1 8 . 1 1 2 2 ARG N N 201 119.330 119.330 124.317 -4.987 18000 1605 1 8 . 1 1 2 2 ARG HA H 201 3.560 3.560 4.288 -0.728 18000 1606 1 8 . 1 1 2 2 ARG C C 201 176.850 176.850 175.360 1.490 18000 1607 1 8 . 1 1 2 2 ARG CA C 201 55.340 55.340 56.058 -0.718 18000 1608 1 8 . 1 1 2 2 ARG CB C 201 27.020 27.020 30.844 -3.824 18000 1609 1 8 . 1 1 2 2 ARG H H 201 8.370 8.370 7.882 0.488 18000 1610 1 8 . 1 1 3 3 LYS N N 202 118.540 118.540 129.801 -11.261 18000 1611 1 8 . 1 1 3 3 LYS HA H 202 4.010 4.010 4.123 -0.113 18000 1612 1 8 . 1 1 3 3 LYS C C 202 176.090 176.090 175.986 0.104 18000 1613 1 8 . 1 1 3 3 LYS CA C 202 56.960 56.960 55.759 1.201 18000 1614 1 8 . 1 1 3 3 LYS CB C 202 30.590 30.590 32.078 -1.488 18000 1615 1 8 . 1 1 3 3 LYS H H 202 7.940 7.940 8.199 -0.259 18000 1616 1 8 . 1 1 4 4 SER N N 203 113.880 113.880 124.265 -10.385 18000 1617 1 8 . 1 1 4 4 SER HA H 203 4.320 4.320 4.531 -0.211 18000 1618 1 8 . 1 1 4 4 SER C C 203 172.900 172.900 173.660 -0.760 18000 1619 1 8 . 1 1 4 4 SER CA C 203 57.870 57.870 57.196 0.674 18000 1620 1 8 . 1 1 4 4 SER CB C 203 61.700 61.700 62.841 -1.141 18000 1621 1 8 . 1 1 4 4 SER H H 203 7.700 7.700 8.332 -0.632 18000 1622 1 8 . 1 1 5 5 ARG HA H 204 4.240 4.240 4.086 0.154 18000 1623 1 8 . 1 1 5 5 ARG C C 204 174.810 174.810 174.926 -0.116 18000 1624 1 8 . 1 1 5 5 ARG CA C 204 54.270 54.270 56.800 -2.530 18000 1625 1 8 . 1 1 5 5 ARG CB C 204 28.700 28.700 30.571 -1.871 18000 1626 1 8 . 1 1 6 6 GLY N N 205 125.950 125.950 102.002 23.948 18000 1627 1 8 . 1 1 6 6 GLY HA H 205 4.400 4.400 4.144 0.256 18000 1628 1 8 . 1 1 6 6 GLY C C 205 171.910 171.910 174.556 -2.646 18000 1629 1 8 . 1 1 6 6 GLY CA C 205 43.570 43.570 45.718 -2.148 18000 1630 1 8 . 1 1 6 6 GLY CB C 205 28.340 28.340 27.862 0.478 18000 1631 1 8 . 1 1 6 6 GLY H H 205 7.930 7.930 7.820 0.110 18000 1632 1 8 . 1 1 7 7 ASN N N 206 118.380 118.380 120.165 -1.785 18000 1633 1 8 . 1 1 7 7 ASN HA H 206 4.760 4.760 4.643 0.117 18000 1634 1 8 . 1 1 7 7 ASN C C 206 173.810 173.810 177.572 -3.762 18000 1635 1 8 . 1 1 7 7 ASN CA C 206 51.430 51.430 55.003 -3.573 18000 1636 1 8 . 1 1 7 7 ASN CB C 206 37.090 37.090 38.011 -0.921 18000 1637 1 8 . 1 1 7 7 ASN H H 206 8.330 8.330 8.578 -0.248 18000 1638 1 8 . 1 1 8 8 THR N N 207 119.850 119.850 120.570 -0.720 18000 1639 1 8 . 1 1 8 8 THR HA H 207 4.270 4.270 4.145 0.125 18000 1640 1 8 . 1 1 8 8 THR C C 207 172.560 172.560 176.447 -3.887 18000 1641 1 8 . 1 1 8 8 THR CA C 207 60.420 60.420 65.387 -4.967 18000 1642 1 8 . 1 1 8 8 THR CB C 207 67.750 67.750 68.164 -0.414 18000 1643 1 8 . 1 1 8 8 THR H H 207 7.830 7.830 8.497 -0.667 18000 1644 1 8 . 1 1 9 9 ASP N N 208 121.180 121.180 118.217 2.963 18000 1645 1 8 . 1 1 9 9 ASP HA H 208 4.550 4.550 4.486 0.064 18000 1646 1 8 . 1 1 9 9 ASP C C 208 174.170 174.170 175.709 -1.539 18000 1647 1 8 . 1 1 9 9 ASP CA C 208 52.670 52.670 58.007 -5.337 18000 1648 1 8 . 1 1 9 9 ASP CB C 208 39.120 39.120 38.213 0.907 18000 1649 1 8 . 1 1 9 9 ASP H H 208 8.350 8.350 8.868 -0.518 18000 1650 1 8 . 1 1 10 10 ASN HA H 209 4.600 4.600 4.419 0.181 18000 1651 1 8 . 1 1 10 10 ASN C C 209 173.670 173.670 177.387 -3.717 18000 1652 1 8 . 1 1 10 10 ASN CA C 209 52.110 52.110 56.143 -4.033 18000 1653 1 8 . 1 1 10 10 ASN CB C 209 36.730 36.730 37.863 -1.133 18000 1654 1 8 . 1 1 11 11 LYS N N 210 120.380 120.380 117.350 3.030 18000 1655 1 8 . 1 1 11 11 LYS HA H 210 4.270 4.270 3.965 0.305 18000 1656 1 8 . 1 1 11 11 LYS C C 210 174.910 174.910 179.087 -4.177 18000 1657 1 8 . 1 1 11 11 LYS CA C 210 54.900 54.900 59.738 -4.838 18000 1658 1 8 . 1 1 11 11 LYS CB C 210 30.670 30.670 31.764 -1.094 18000 1659 1 8 . 1 1 11 11 LYS H H 210 8.210 8.210 8.163 0.047 18000 1660 1 8 . 1 1 12 12 GLU N N 211 120.740 120.740 119.757 0.983 18000 1661 1 8 . 1 1 12 12 GLU HA H 211 4.070 4.070 4.005 0.065 18000 1662 1 8 . 1 1 12 12 GLU C C 211 174.810 174.810 179.539 -4.729 18000 1663 1 8 . 1 1 12 12 GLU CA C 211 55.940 55.940 59.838 -3.898 18000 1664 1 8 . 1 1 12 12 GLU CB C 211 27.700 27.700 29.142 -1.442 18000 1665 1 8 . 1 1 12 12 GLU H H 211 8.380 8.380 8.908 -0.528 18000 1666 1 8 . 1 1 13 13 TYR N N 212 119.430 119.430 119.482 -0.052 18000 1667 1 8 . 1 1 13 13 TYR HA H 212 4.380 4.380 4.231 0.149 18000 1668 1 8 . 1 1 13 13 TYR C C 212 174.830 174.830 178.426 -3.596 18000 1669 1 8 . 1 1 13 13 TYR CA C 212 57.420 57.420 61.078 -3.658 18000 1670 1 8 . 1 1 13 13 TYR CB C 212 36.530 36.530 38.184 -1.654 18000 1671 1 8 . 1 1 13 13 TYR H H 212 7.940 7.940 7.965 -0.025 18000 1672 1 8 . 1 1 14 14 ALA N N 213 121.810 121.810 119.743 2.067 18000 1673 1 8 . 1 1 14 14 ALA HA H 213 4.260 4.260 4.006 0.254 18000 1674 1 8 . 1 1 14 14 ALA C C 213 176.630 176.630 180.314 -3.684 18000 1675 1 8 . 1 1 14 14 ALA CA C 213 51.990 51.990 55.228 -3.238 18000 1676 1 8 . 1 1 14 14 ALA CB C 213 16.450 16.450 17.766 -1.316 18000 1677 1 8 . 1 1 14 14 ALA H H 213 7.920 7.920 8.474 -0.554 18000 1678 1 8 . 1 1 15 15 VAL N N 214 121.430 121.430 119.347 2.083 18000 1679 1 8 . 1 1 15 15 VAL HA H 214 3.470 3.470 3.564 -0.094 18000 1680 1 8 . 1 1 15 15 VAL C C 214 174.980 174.980 177.786 -2.806 18000 1681 1 8 . 1 1 15 15 VAL CA C 214 64.190 64.190 66.584 -2.394 18000 1682 1 8 . 1 1 15 15 VAL CB C 214 29.820 29.820 31.230 -1.410 18000 1683 1 8 . 1 1 15 15 VAL H H 214 8.680 8.680 8.680 -0.000 18000 1684 1 8 . 1 1 16 16 ASN N N 215 117.460 117.460 117.906 -0.446 18000 1685 1 8 . 1 1 16 16 ASN HA H 215 4.300 4.300 4.440 -0.140 18000 1686 1 8 . 1 1 16 16 ASN C C 215 176.320 176.320 177.136 -0.816 18000 1687 1 8 . 1 1 16 16 ASN CA C 215 54.190 54.190 55.813 -1.623 18000 1688 1 8 . 1 1 16 16 ASN CB C 215 35.360 35.360 37.734 -2.374 18000 1689 1 8 . 1 1 16 16 ASN H H 215 8.190 8.190 8.100 0.090 18000 1690 1 8 . 1 1 17 17 GLU N N 216 119.430 119.430 117.606 1.824 18000 1691 1 8 . 1 1 17 17 GLU HA H 216 4.000 4.000 4.182 -0.182 18000 1692 1 8 . 1 1 17 17 GLU C C 216 177.240 177.240 178.941 -1.701 18000 1693 1 8 . 1 1 17 17 GLU CA C 216 57.180 57.180 58.735 -1.555 18000 1694 1 8 . 1 1 17 17 GLU CB C 216 28.400 28.400 29.323 -0.923 18000 1695 1 8 . 1 1 17 17 GLU H H 216 7.730 7.730 8.129 -0.399 18000 1696 1 8 . 1 1 18 18 VAL N N 217 120.690 120.690 119.198 1.492 18000 1697 1 8 . 1 1 18 18 VAL HA H 217 3.530 3.530 3.877 -0.347 18000 1698 1 8 . 1 1 18 18 VAL C C 217 174.990 174.990 178.317 -3.327 18000 1699 1 8 . 1 1 18 18 VAL CA C 217 64.310 64.310 65.001 -0.691 18000 1700 1 8 . 1 1 18 18 VAL CB C 217 29.640 29.640 31.129 -1.489 18000 1701 1 8 . 1 1 18 18 VAL H H 217 7.820 7.820 8.265 -0.445 18000 1702 1 8 . 1 1 19 19 VAL N N 218 117.010 117.010 114.866 2.144 18000 1703 1 8 . 1 1 19 19 VAL HA H 218 3.500 3.500 3.835 -0.335 18000 1704 1 8 . 1 1 19 19 VAL C C 218 175.200 175.200 176.556 -1.356 18000 1705 1 8 . 1 1 19 19 VAL CA C 218 64.960 64.960 65.188 -0.228 18000 1706 1 8 . 1 1 19 19 VAL CB C 218 29.710 29.710 31.856 -2.146 18000 1707 1 8 . 1 1 19 19 VAL H H 218 8.260 8.260 7.690 0.570 18000 1708 1 8 . 1 1 20 20 ALA N N 219 120.360 120.360 118.294 2.066 18000 1709 1 8 . 1 1 20 20 ALA HA H 219 3.930 3.930 4.435 -0.505 18000 1710 1 8 . 1 1 20 20 ALA C C 219 178.310 178.310 177.216 1.094 18000 1711 1 8 . 1 1 20 20 ALA CA C 219 53.040 53.040 50.307 2.733 18000 1712 1 8 . 1 1 20 20 ALA CB C 219 16.280 16.280 18.421 -2.141 18000 1713 1 8 . 1 1 20 20 ALA H H 219 7.490 7.490 7.328 0.162 18000 1714 1 8 . 1 1 21 21 GLY N N 220 124.250 124.250 108.794 15.456 18000 1715 1 8 . 1 1 21 21 GLY HA H 220 4.250 4.250 4.466 -0.216 18000 1716 1 8 . 1 1 21 21 GLY C C 220 172.880 172.880 174.744 -1.864 18000 1717 1 8 . 1 1 21 21 GLY CA C 220 44.130 44.130 43.781 0.349 18000 1718 1 8 . 1 1 21 21 GLY CB C 220 29.290 29.290 29.537 -0.246 18000 1719 1 8 . 1 1 21 21 GLY H H 220 7.640 7.640 7.553 0.087 18000 1720 1 8 . 1 1 22 22 ILE N N 221 119.940 119.940 126.263 -6.323 18000 1721 1 8 . 1 1 22 22 ILE HA H 221 3.290 3.290 4.230 -0.940 18000 1722 1 8 . 1 1 22 22 ILE C C 221 175.100 175.100 174.622 0.478 18000 1723 1 8 . 1 1 22 22 ILE CA C 221 64.070 64.070 60.627 3.443 18000 1724 1 8 . 1 1 22 22 ILE CB C 221 35.260 35.260 37.580 -2.320 18000 1725 1 8 . 1 1 22 22 ILE H H 221 8.130 8.130 8.227 -0.097 18000 1726 1 8 . 1 1 23 23 LYS HA H 222 3.430 3.430 4.370 -0.940 18000 1727 1 8 . 1 1 23 23 LYS C C 222 175.280 175.280 175.015 0.265 18000 1728 1 8 . 1 1 23 23 LYS CA C 222 59.270 59.270 56.464 2.806 18000 1729 1 8 . 1 1 23 23 LYS CB C 222 30.670 30.670 31.070 -0.400 18000 1730 1 8 . 1 1 24 24 GLU N N 223 116.150 116.150 121.317 -5.167 18000 1731 1 8 . 1 1 24 24 GLU HA H 223 4.150 4.150 4.457 -0.307 18000 1732 1 8 . 1 1 24 24 GLU C C 223 177.330 177.330 176.542 0.788 18000 1733 1 8 . 1 1 24 24 GLU CA C 223 57.180 57.180 55.043 2.137 18000 1734 1 8 . 1 1 24 24 GLU CB C 223 27.670 27.670 30.988 -3.318 18000 1735 1 8 . 1 1 24 24 GLU H H 223 7.830 7.830 8.185 -0.355 18000 1736 1 8 . 1 1 25 25 TYR N N 224 119.760 119.760 125.079 -5.319 18000 1737 1 8 . 1 1 25 25 TYR HA H 224 4.480 4.480 4.459 0.021 18000 1738 1 8 . 1 1 25 25 TYR C C 224 175.680 175.680 175.487 0.193 18000 1739 1 8 . 1 1 25 25 TYR CA C 224 57.520 57.520 58.369 -0.849 18000 1740 1 8 . 1 1 25 25 TYR CB C 224 36.940 36.940 39.026 -2.086 18000 1741 1 8 . 1 1 25 25 TYR H H 224 8.630 8.630 8.616 0.014 18000 1742 1 8 . 1 1 26 26 PHE N N 225 120.090 120.090 128.223 -8.133 18000 1743 1 8 . 1 1 26 26 PHE HA H 225 3.410 3.410 4.340 -0.930 18000 1744 1 8 . 1 1 26 26 PHE C C 225 173.930 173.930 174.692 -0.762 18000 1745 1 8 . 1 1 26 26 PHE CA C 225 61.600 61.600 58.576 3.024 18000 1746 1 8 . 1 1 26 26 PHE CB C 225 36.590 36.590 38.967 -2.377 18000 1747 1 8 . 1 1 26 26 PHE H H 225 9.220 9.220 8.652 0.568 18000 1748 1 8 . 1 1 27 27 ASN N N 226 115.010 115.010 124.627 -9.617 18000 1749 1 8 . 1 1 27 27 ASN HA H 226 4.470 4.470 4.800 -0.330 18000 1750 1 8 . 1 1 27 27 ASN C C 226 176.630 176.630 173.616 3.014 18000 1751 1 8 . 1 1 27 27 ASN CA C 226 54.160 54.160 51.607 2.553 18000 1752 1 8 . 1 1 27 27 ASN CB C 226 35.800 35.800 40.554 -4.754 18000 1753 1 8 . 1 1 27 27 ASN H H 226 8.210 8.210 7.931 0.279 18000 1754 1 8 . 1 1 28 28 VAL N N 227 115.120 115.120 116.318 -1.198 18000 1755 1 8 . 1 1 28 28 VAL HA H 227 4.300 4.300 4.581 -0.281 18000 1756 1 8 . 1 1 28 28 VAL C C 227 174.960 174.960 174.170 0.790 18000 1757 1 8 . 1 1 28 28 VAL CA C 227 61.320 61.320 58.667 2.653 18000 1758 1 8 . 1 1 28 28 VAL CB C 227 30.670 30.670 31.057 -0.387 18000 1759 1 8 . 1 1 28 28 VAL H H 227 7.430 7.430 8.121 -0.691 18000 1760 1 8 . 1 1 29 29 MET HA H 228 4.000 4.000 4.421 -0.421 18000 1761 1 8 . 1 1 29 29 MET C C 228 176.270 176.270 175.837 0.433 18000 1762 1 8 . 1 1 29 29 MET CA C 228 54.030 54.030 55.192 -1.162 18000 1763 1 8 . 1 1 29 29 MET CB C 228 31.510 31.510 33.365 -1.855 18000 1764 1 8 . 1 1 30 30 LEU N N 229 122.180 122.180 121.222 0.958 18000 1765 1 8 . 1 1 30 30 LEU HA H 229 3.150 3.150 4.005 -0.855 18000 1766 1 8 . 1 1 30 30 LEU C C 229 176.070 176.070 177.872 -1.802 18000 1767 1 8 . 1 1 30 30 LEU CA C 229 55.860 55.860 57.358 -1.498 18000 1768 1 8 . 1 1 30 30 LEU CB C 229 36.340 36.340 41.432 -5.092 18000 1769 1 8 . 1 1 30 30 LEU H H 229 7.890 7.890 8.693 -0.803 18000 1770 1 8 . 1 1 31 31 GLY N N 230 118.390 118.390 107.868 10.522 18000 1771 1 8 . 1 1 31 31 GLY HA H 230 4.090 4.090 4.179 -0.089 18000 1772 1 8 . 1 1 31 31 GLY C C 230 173.070 173.070 175.098 -2.028 18000 1773 1 8 . 1 1 31 31 GLY CA C 230 43.150 43.150 47.159 -4.009 18000 1774 1 8 . 1 1 31 31 GLY CB C 230 26.780 26.780 29.381 -2.601 18000 1775 1 8 . 1 1 31 31 GLY H H 230 8.350 8.350 8.265 0.085 18000 1776 1 8 . 1 1 32 32 THR N N 231 124.790 124.790 112.354 12.436 18000 1777 1 8 . 1 1 32 32 THR HA H 231 4.280 4.280 4.454 -0.174 18000 1778 1 8 . 1 1 32 32 THR C C 231 173.260 173.260 176.119 -2.859 18000 1779 1 8 . 1 1 32 32 THR CA C 231 60.030 60.030 63.289 -3.259 18000 1780 1 8 . 1 1 32 32 THR CB C 231 68.540 68.540 70.434 -1.894 18000 1781 1 8 . 1 1 32 32 THR H H 231 7.040 7.040 7.920 -0.880 18000 1782 1 8 . 1 1 33 33 GLN N N 232 114.740 114.740 117.450 -2.710 18000 1783 1 8 . 1 1 33 33 GLN HA H 232 5.090 5.090 4.405 0.685 18000 1784 1 8 . 1 1 33 33 GLN C C 232 175.790 175.790 175.877 -0.087 18000 1785 1 8 . 1 1 33 33 GLN CA C 232 53.650 53.650 56.280 -2.630 18000 1786 1 8 . 1 1 33 33 GLN CB C 232 30.520 30.520 30.204 0.316 18000 1787 1 8 . 1 1 33 33 GLN H H 232 8.110 8.110 8.625 -0.515 18000 1788 1 8 . 1 1 34 34 LEU N N 233 112.480 112.480 117.445 -4.965 18000 1789 1 8 . 1 1 34 34 LEU HA H 233 4.460 4.460 4.515 -0.055 18000 1790 1 8 . 1 1 34 34 LEU C C 233 172.610 172.610 176.556 -3.946 18000 1791 1 8 . 1 1 34 34 LEU CA C 233 52.460 52.460 54.353 -1.893 18000 1792 1 8 . 1 1 34 34 LEU CB C 233 39.140 39.140 43.748 -4.608 18000 1793 1 8 . 1 1 34 34 LEU H H 233 6.980 6.980 7.849 -0.869 18000 1794 1 8 . 1 1 35 35 LEU N N 234 115.860 115.860 124.908 -9.048 18000 1795 1 8 . 1 1 35 35 LEU HA H 234 4.510 4.510 4.204 0.306 18000 1796 1 8 . 1 1 35 35 LEU C C 234 178.330 178.330 176.785 1.545 18000 1797 1 8 . 1 1 35 35 LEU CA C 234 51.900 51.900 55.331 -3.431 18000 1798 1 8 . 1 1 35 35 LEU CB C 234 40.950 40.950 41.292 -0.342 18000 1799 1 8 . 1 1 35 35 LEU H H 234 7.560 7.560 7.679 -0.119 18000 1800 1 8 . 1 1 36 36 TYR N N 235 125.850 125.850 119.951 5.899 18000 1801 1 8 . 1 1 36 36 TYR HA H 235 4.790 4.790 4.588 0.202 18000 1802 1 8 . 1 1 36 36 TYR C C 235 176.260 176.260 175.843 0.417 18000 1803 1 8 . 1 1 36 36 TYR CA C 235 57.750 57.750 55.817 1.933 18000 1804 1 8 . 1 1 36 36 TYR CB C 235 37.100 37.100 40.081 -2.981 18000 1805 1 8 . 1 1 36 36 TYR H H 235 9.750 9.750 7.732 2.018 18000 1806 1 8 . 1 1 37 37 LYS N N 236 123.880 123.880 122.573 1.307 18000 1807 1 8 . 1 1 37 37 LYS HA H 236 3.930 3.930 4.370 -0.440 18000 1808 1 8 . 1 1 37 37 LYS C C 236 178.280 178.280 175.975 2.305 18000 1809 1 8 . 1 1 37 37 LYS CA C 236 59.210 59.210 56.341 2.869 18000 1810 1 8 . 1 1 37 37 LYS CB C 236 30.430 30.430 31.739 -1.309 18000 1811 1 8 . 1 1 37 37 LYS H H 236 9.340 9.340 8.769 0.571 18000 1812 1 8 . 1 1 38 38 PHE N N 237 117.150 117.150 125.700 -8.550 18000 1813 1 8 . 1 1 38 38 PHE HA H 237 4.460 4.460 4.719 -0.259 18000 1814 1 8 . 1 1 38 38 PHE C C 237 173.930 173.930 174.285 -0.355 18000 1815 1 8 . 1 1 38 38 PHE CA C 237 58.510 58.510 55.743 2.767 18000 1816 1 8 . 1 1 38 38 PHE CB C 237 38.370 38.370 39.359 -0.989 18000 1817 1 8 . 1 1 38 38 PHE H H 237 9.120 9.120 8.098 1.022 18000 1818 1 8 . 1 1 39 39 GLU HA H 238 4.160 4.160 4.351 -0.191 18000 1819 1 8 . 1 1 39 39 GLU C C 238 175.650 175.650 175.644 0.006 18000 1820 1 8 . 1 1 39 39 GLU CA C 238 55.070 55.070 56.716 -1.646 18000 1821 1 8 . 1 1 39 39 GLU CB C 238 31.540 31.540 29.259 2.281 18000 1822 1 8 . 1 1 40 40 ARG N N 239 120.330 120.330 123.681 -3.351 18000 1823 1 8 . 1 1 40 40 ARG HA H 239 4.250 4.250 4.257 -0.007 18000 1824 1 8 . 1 1 40 40 ARG C C 239 174.490 174.490 176.731 -2.241 18000 1825 1 8 . 1 1 40 40 ARG CA C 239 60.410 60.410 56.276 4.134 18000 1826 1 8 . 1 1 40 40 ARG H H 239 7.980 7.980 8.330 -0.350 18000 1827 1 8 . 1 1 41 41 PRO N N 240 115.390 115.390 115.087 0.303 18000 1828 1 8 . 1 1 41 41 PRO HA H 240 4.360 4.360 4.560 -0.200 18000 1829 1 8 . 1 1 41 41 PRO C C 240 176.330 176.330 178.219 -1.889 18000 1830 1 8 . 1 1 41 41 PRO CA C 240 64.400 64.400 64.617 -0.217 18000 1831 1 8 . 1 1 41 41 PRO CB C 240 62.240 62.240 63.646 -1.406 18000 1832 1 8 . 1 1 41 41 PRO H H 240 8.090 8.090 8.518 -0.428 18000 1833 1 9 . 1 1 2 2 ARG N N 201 119.330 119.330 124.633 -5.303 18000 1834 1 9 . 1 1 2 2 ARG HA H 201 3.560 3.560 4.579 -1.019 18000 1835 1 9 . 1 1 2 2 ARG C C 201 176.850 176.850 174.971 1.879 18000 1836 1 9 . 1 1 2 2 ARG CA C 201 55.340 55.340 55.560 -0.220 18000 1837 1 9 . 1 1 2 2 ARG CB C 201 27.020 27.020 30.685 -3.665 18000 1838 1 9 . 1 1 2 2 ARG H H 201 8.370 8.370 8.398 -0.028 18000 1839 1 9 . 1 1 3 3 LYS N N 202 118.540 118.540 127.748 -9.208 18000 1840 1 9 . 1 1 3 3 LYS HA H 202 4.010 4.010 4.425 -0.415 18000 1841 1 9 . 1 1 3 3 LYS C C 202 176.090 176.090 175.323 0.767 18000 1842 1 9 . 1 1 3 3 LYS CA C 202 56.960 56.960 55.658 1.302 18000 1843 1 9 . 1 1 3 3 LYS CB C 202 30.590 30.590 33.486 -2.896 18000 1844 1 9 . 1 1 3 3 LYS H H 202 7.940 7.940 8.160 -0.220 18000 1845 1 9 . 1 1 4 4 SER N N 203 113.880 113.880 124.898 -11.018 18000 1846 1 9 . 1 1 4 4 SER HA H 203 4.320 4.320 4.676 -0.356 18000 1847 1 9 . 1 1 4 4 SER C C 203 172.900 172.900 172.418 0.482 18000 1848 1 9 . 1 1 4 4 SER CA C 203 57.870 57.870 55.322 2.548 18000 1849 1 9 . 1 1 4 4 SER CB C 203 61.700 61.700 62.782 -1.082 18000 1850 1 9 . 1 1 4 4 SER H H 203 7.700 7.700 8.437 -0.737 18000 1851 1 9 . 1 1 5 5 ARG HA H 204 4.240 4.240 4.425 -0.185 18000 1852 1 9 . 1 1 5 5 ARG C C 204 174.810 174.810 174.890 -0.080 18000 1853 1 9 . 1 1 5 5 ARG CA C 204 54.270 54.270 55.805 -1.535 18000 1854 1 9 . 1 1 5 5 ARG CB C 204 28.700 28.700 30.643 -1.943 18000 1855 1 9 . 1 1 6 6 GLY N N 205 125.950 125.950 112.208 13.742 18000 1856 1 9 . 1 1 6 6 GLY HA H 205 4.400 4.400 4.394 0.006 18000 1857 1 9 . 1 1 6 6 GLY C C 205 171.910 171.910 175.452 -3.542 18000 1858 1 9 . 1 1 6 6 GLY CA C 205 43.570 43.570 44.551 -0.981 18000 1859 1 9 . 1 1 6 6 GLY CB C 205 28.340 28.340 29.350 -1.010 18000 1860 1 9 . 1 1 6 6 GLY H H 205 7.930 7.930 8.459 -0.529 18000 1861 1 9 . 1 1 7 7 ASN N N 206 118.380 118.380 120.451 -2.071 18000 1862 1 9 . 1 1 7 7 ASN HA H 206 4.760 4.760 4.615 0.145 18000 1863 1 9 . 1 1 7 7 ASN C C 206 173.810 173.810 177.528 -3.718 18000 1864 1 9 . 1 1 7 7 ASN CA C 206 51.430 51.430 54.855 -3.425 18000 1865 1 9 . 1 1 7 7 ASN CB C 206 37.090 37.090 37.444 -0.354 18000 1866 1 9 . 1 1 7 7 ASN H H 206 8.330 8.330 8.996 -0.666 18000 1867 1 9 . 1 1 8 8 THR N N 207 119.850 119.850 120.636 -0.786 18000 1868 1 9 . 1 1 8 8 THR HA H 207 4.270 4.270 4.235 0.035 18000 1869 1 9 . 1 1 8 8 THR C C 207 172.560 172.560 176.810 -4.250 18000 1870 1 9 . 1 1 8 8 THR CA C 207 60.420 60.420 65.130 -4.710 18000 1871 1 9 . 1 1 8 8 THR CB C 207 67.750 67.750 68.204 -0.454 18000 1872 1 9 . 1 1 8 8 THR H H 207 7.830 7.830 8.697 -0.867 18000 1873 1 9 . 1 1 9 9 ASP N N 208 121.180 121.180 118.848 2.332 18000 1874 1 9 . 1 1 9 9 ASP HA H 208 4.550 4.550 4.657 -0.107 18000 1875 1 9 . 1 1 9 9 ASP C C 208 174.170 174.170 175.729 -1.559 18000 1876 1 9 . 1 1 9 9 ASP CA C 208 52.670 52.670 58.163 -5.493 18000 1877 1 9 . 1 1 9 9 ASP CB C 208 39.120 39.120 38.138 0.982 18000 1878 1 9 . 1 1 9 9 ASP H H 208 8.350 8.350 7.793 0.557 18000 1879 1 9 . 1 1 10 10 ASN HA H 209 4.600 4.600 4.541 0.059 18000 1880 1 9 . 1 1 10 10 ASN C C 209 173.670 173.670 177.399 -3.729 18000 1881 1 9 . 1 1 10 10 ASN CA C 209 52.110 52.110 55.699 -3.588 18000 1882 1 9 . 1 1 10 10 ASN CB C 209 36.730 36.730 37.927 -1.197 18000 1883 1 9 . 1 1 11 11 LYS N N 210 120.380 120.380 118.382 1.998 18000 1884 1 9 . 1 1 11 11 LYS HA H 210 4.270 4.270 4.002 0.268 18000 1885 1 9 . 1 1 11 11 LYS C C 210 174.910 174.910 179.164 -4.254 18000 1886 1 9 . 1 1 11 11 LYS CA C 210 54.900 54.900 59.662 -4.762 18000 1887 1 9 . 1 1 11 11 LYS CB C 210 30.670 30.670 31.709 -1.039 18000 1888 1 9 . 1 1 11 11 LYS H H 210 8.210 8.210 8.250 -0.040 18000 1889 1 9 . 1 1 12 12 GLU N N 211 120.740 120.740 120.992 -0.252 18000 1890 1 9 . 1 1 12 12 GLU HA H 211 4.070 4.070 4.061 0.009 18000 1891 1 9 . 1 1 12 12 GLU C C 211 174.810 174.810 179.189 -4.379 18000 1892 1 9 . 1 1 12 12 GLU CA C 211 55.940 55.940 59.847 -3.907 18000 1893 1 9 . 1 1 12 12 GLU CB C 211 27.700 27.700 29.162 -1.462 18000 1894 1 9 . 1 1 12 12 GLU H H 211 8.380 8.380 8.480 -0.100 18000 1895 1 9 . 1 1 13 13 TYR N N 212 119.430 119.430 118.706 0.724 18000 1896 1 9 . 1 1 13 13 TYR HA H 212 4.380 4.380 4.263 0.117 18000 1897 1 9 . 1 1 13 13 TYR C C 212 174.830 174.830 178.307 -3.477 18000 1898 1 9 . 1 1 13 13 TYR CA C 212 57.420 57.420 60.907 -3.487 18000 1899 1 9 . 1 1 13 13 TYR CB C 212 36.530 36.530 38.148 -1.618 18000 1900 1 9 . 1 1 13 13 TYR H H 212 7.940 7.940 7.945 -0.005 18000 1901 1 9 . 1 1 14 14 ALA N N 213 121.810 121.810 120.955 0.855 18000 1902 1 9 . 1 1 14 14 ALA HA H 213 4.260 4.260 4.007 0.253 18000 1903 1 9 . 1 1 14 14 ALA C C 213 176.630 176.630 179.670 -3.040 18000 1904 1 9 . 1 1 14 14 ALA CA C 213 51.990 51.990 55.476 -3.486 18000 1905 1 9 . 1 1 14 14 ALA CB C 213 16.450 16.450 18.722 -2.272 18000 1906 1 9 . 1 1 14 14 ALA H H 213 7.920 7.920 8.337 -0.417 18000 1907 1 9 . 1 1 15 15 VAL N N 214 121.430 121.430 119.001 2.429 18000 1908 1 9 . 1 1 15 15 VAL HA H 214 3.470 3.470 3.559 -0.089 18000 1909 1 9 . 1 1 15 15 VAL C C 214 174.980 174.980 177.672 -2.692 18000 1910 1 9 . 1 1 15 15 VAL CA C 214 64.190 64.190 66.443 -2.253 18000 1911 1 9 . 1 1 15 15 VAL CB C 214 29.820 29.820 31.312 -1.492 18000 1912 1 9 . 1 1 15 15 VAL H H 214 8.680 8.680 8.475 0.205 18000 1913 1 9 . 1 1 16 16 ASN N N 215 117.460 117.460 118.256 -0.796 18000 1914 1 9 . 1 1 16 16 ASN HA H 215 4.300 4.300 4.408 -0.108 18000 1915 1 9 . 1 1 16 16 ASN C C 215 176.320 176.320 177.415 -1.095 18000 1916 1 9 . 1 1 16 16 ASN CA C 215 54.190 54.190 55.923 -1.733 18000 1917 1 9 . 1 1 16 16 ASN CB C 215 35.360 35.360 37.687 -2.327 18000 1918 1 9 . 1 1 16 16 ASN H H 215 8.190 8.190 8.076 0.114 18000 1919 1 9 . 1 1 17 17 GLU N N 216 119.430 119.430 117.485 1.945 18000 1920 1 9 . 1 1 17 17 GLU HA H 216 4.000 4.000 4.144 -0.144 18000 1921 1 9 . 1 1 17 17 GLU C C 216 177.240 177.240 178.915 -1.675 18000 1922 1 9 . 1 1 17 17 GLU CA C 216 57.180 57.180 58.870 -1.690 18000 1923 1 9 . 1 1 17 17 GLU CB C 216 28.400 28.400 29.162 -0.762 18000 1924 1 9 . 1 1 17 17 GLU H H 216 7.730 7.730 8.537 -0.807 18000 1925 1 9 . 1 1 18 18 VAL N N 217 120.690 120.690 118.915 1.775 18000 1926 1 9 . 1 1 18 18 VAL HA H 217 3.530 3.530 3.905 -0.375 18000 1927 1 9 . 1 1 18 18 VAL C C 217 174.990 174.990 178.328 -3.338 18000 1928 1 9 . 1 1 18 18 VAL CA C 217 64.310 64.310 64.934 -0.624 18000 1929 1 9 . 1 1 18 18 VAL CB C 217 29.640 29.640 31.153 -1.513 18000 1930 1 9 . 1 1 18 18 VAL H H 217 7.820 7.820 7.916 -0.096 18000 1931 1 9 . 1 1 19 19 VAL N N 218 117.010 117.010 114.956 2.054 18000 1932 1 9 . 1 1 19 19 VAL HA H 218 3.500 3.500 3.863 -0.363 18000 1933 1 9 . 1 1 19 19 VAL C C 218 175.200 175.200 176.462 -1.262 18000 1934 1 9 . 1 1 19 19 VAL CA C 218 64.960 64.960 65.055 -0.095 18000 1935 1 9 . 1 1 19 19 VAL CB C 218 29.710 29.710 31.787 -2.077 18000 1936 1 9 . 1 1 19 19 VAL H H 218 8.260 8.260 7.627 0.633 18000 1937 1 9 . 1 1 20 20 ALA N N 219 120.360 120.360 118.332 2.028 18000 1938 1 9 . 1 1 20 20 ALA HA H 219 3.930 3.930 4.364 -0.434 18000 1939 1 9 . 1 1 20 20 ALA C C 219 178.310 178.310 177.439 0.871 18000 1940 1 9 . 1 1 20 20 ALA CA C 219 53.040 53.040 50.641 2.399 18000 1941 1 9 . 1 1 20 20 ALA CB C 219 16.280 16.280 18.647 -2.367 18000 1942 1 9 . 1 1 20 20 ALA H H 219 7.490 7.490 7.348 0.142 18000 1943 1 9 . 1 1 21 21 GLY N N 220 124.250 124.250 108.693 15.557 18000 1944 1 9 . 1 1 21 21 GLY HA H 220 4.250 4.250 4.479 -0.229 18000 1945 1 9 . 1 1 21 21 GLY C C 220 172.880 172.880 174.455 -1.575 18000 1946 1 9 . 1 1 21 21 GLY CA C 220 44.130 44.130 43.552 0.578 18000 1947 1 9 . 1 1 21 21 GLY CB C 220 29.290 29.290 29.538 -0.248 18000 1948 1 9 . 1 1 21 21 GLY H H 220 7.640 7.640 7.434 0.206 18000 1949 1 9 . 1 1 22 22 ILE N N 221 119.940 119.940 126.294 -6.354 18000 1950 1 9 . 1 1 22 22 ILE HA H 221 3.290 3.290 4.224 -0.934 18000 1951 1 9 . 1 1 22 22 ILE C C 221 175.100 175.100 174.557 0.543 18000 1952 1 9 . 1 1 22 22 ILE CA C 221 64.070 64.070 59.992 4.078 18000 1953 1 9 . 1 1 22 22 ILE CB C 221 35.260 35.260 37.807 -2.547 18000 1954 1 9 . 1 1 22 22 ILE H H 221 8.130 8.130 8.201 -0.071 18000 1955 1 9 . 1 1 23 23 LYS HA H 222 3.430 3.430 4.321 -0.891 18000 1956 1 9 . 1 1 23 23 LYS C C 222 175.280 175.280 175.342 -0.062 18000 1957 1 9 . 1 1 23 23 LYS CA C 222 59.270 59.270 56.790 2.480 18000 1958 1 9 . 1 1 23 23 LYS CB C 222 30.670 30.670 31.194 -0.524 18000 1959 1 9 . 1 1 24 24 GLU N N 223 116.150 116.150 120.282 -4.132 18000 1960 1 9 . 1 1 24 24 GLU HA H 223 4.150 4.150 4.577 -0.427 18000 1961 1 9 . 1 1 24 24 GLU C C 223 177.330 177.330 175.826 1.504 18000 1962 1 9 . 1 1 24 24 GLU CA C 223 57.180 57.180 54.154 3.026 18000 1963 1 9 . 1 1 24 24 GLU CB C 223 27.670 27.670 31.015 -3.345 18000 1964 1 9 . 1 1 24 24 GLU H H 223 7.830 7.830 7.984 -0.154 18000 1965 1 9 . 1 1 25 25 TYR N N 224 119.760 119.760 121.662 -1.902 18000 1966 1 9 . 1 1 25 25 TYR HA H 224 4.480 4.480 4.479 0.001 18000 1967 1 9 . 1 1 25 25 TYR C C 224 175.680 175.680 175.509 0.171 18000 1968 1 9 . 1 1 25 25 TYR CA C 224 57.520 57.520 58.541 -1.021 18000 1969 1 9 . 1 1 25 25 TYR CB C 224 36.940 36.940 38.994 -2.054 18000 1970 1 9 . 1 1 25 25 TYR H H 224 8.630 8.630 8.516 0.114 18000 1971 1 9 . 1 1 26 26 PHE N N 225 120.090 120.090 126.860 -6.770 18000 1972 1 9 . 1 1 26 26 PHE HA H 225 3.410 3.410 4.308 -0.898 18000 1973 1 9 . 1 1 26 26 PHE C C 225 173.930 173.930 174.870 -0.940 18000 1974 1 9 . 1 1 26 26 PHE CA C 225 61.600 61.600 59.063 2.537 18000 1975 1 9 . 1 1 26 26 PHE CB C 225 36.590 36.590 39.484 -2.894 18000 1976 1 9 . 1 1 26 26 PHE H H 225 9.220 9.220 8.568 0.652 18000 1977 1 9 . 1 1 27 27 ASN N N 226 115.010 115.010 124.460 -9.450 18000 1978 1 9 . 1 1 27 27 ASN HA H 226 4.470 4.470 4.707 -0.237 18000 1979 1 9 . 1 1 27 27 ASN C C 226 176.630 176.630 173.575 3.055 18000 1980 1 9 . 1 1 27 27 ASN CA C 226 54.160 54.160 51.322 2.838 18000 1981 1 9 . 1 1 27 27 ASN CB C 226 35.800 35.800 41.721 -5.920 18000 1982 1 9 . 1 1 27 27 ASN H H 226 8.210 8.210 8.111 0.099 18000 1983 1 9 . 1 1 28 28 VAL N N 227 115.120 115.120 121.746 -6.626 18000 1984 1 9 . 1 1 28 28 VAL HA H 227 4.300 4.300 4.314 -0.014 18000 1985 1 9 . 1 1 28 28 VAL C C 227 174.960 174.960 174.216 0.744 18000 1986 1 9 . 1 1 28 28 VAL CA C 227 61.320 61.320 59.757 1.563 18000 1987 1 9 . 1 1 28 28 VAL CB C 227 30.670 30.670 31.656 -0.986 18000 1988 1 9 . 1 1 28 28 VAL H H 227 7.430 7.430 7.984 -0.554 18000 1989 1 9 . 1 1 29 29 MET HA H 228 4.000 4.000 4.511 -0.511 18000 1990 1 9 . 1 1 29 29 MET C C 228 176.270 176.270 176.161 0.109 18000 1991 1 9 . 1 1 29 29 MET CA C 228 54.030 54.030 54.752 -0.722 18000 1992 1 9 . 1 1 29 29 MET CB C 228 31.510 31.510 33.333 -1.823 18000 1993 1 9 . 1 1 30 30 LEU N N 229 122.180 122.180 123.361 -1.181 18000 1994 1 9 . 1 1 30 30 LEU HA H 229 3.150 3.150 3.996 -0.846 18000 1995 1 9 . 1 1 30 30 LEU C C 229 176.070 176.070 178.077 -2.007 18000 1996 1 9 . 1 1 30 30 LEU CA C 229 55.860 55.860 57.338 -1.478 18000 1997 1 9 . 1 1 30 30 LEU CB C 229 36.340 36.340 41.554 -5.214 18000 1998 1 9 . 1 1 30 30 LEU H H 229 7.890 7.890 8.693 -0.803 18000 1999 1 9 . 1 1 31 31 GLY N N 230 118.390 118.390 108.207 10.183 18000 2000 1 9 . 1 1 31 31 GLY HA H 230 4.090 4.090 4.165 -0.075 18000 2001 1 9 . 1 1 31 31 GLY C C 230 173.070 173.070 175.316 -2.246 18000 2002 1 9 . 1 1 31 31 GLY CA C 230 43.150 43.150 47.273 -4.123 18000 2003 1 9 . 1 1 31 31 GLY CB C 230 26.780 26.780 29.357 -2.577 18000 2004 1 9 . 1 1 31 31 GLY H H 230 8.350 8.350 8.276 0.074 18000 2005 1 9 . 1 1 32 32 THR N N 231 124.790 124.790 111.879 12.911 18000 2006 1 9 . 1 1 32 32 THR HA H 231 4.280 4.280 4.426 -0.146 18000 2007 1 9 . 1 1 32 32 THR C C 231 173.260 173.260 175.804 -2.544 18000 2008 1 9 . 1 1 32 32 THR CA C 231 60.030 60.030 63.190 -3.159 18000 2009 1 9 . 1 1 32 32 THR CB C 231 68.540 68.540 70.448 -1.908 18000 2010 1 9 . 1 1 32 32 THR H H 231 7.040 7.040 8.018 -0.978 18000 2011 1 9 . 1 1 33 33 GLN N N 232 114.740 114.740 116.311 -1.571 18000 2012 1 9 . 1 1 33 33 GLN HA H 232 5.090 5.090 4.498 0.592 18000 2013 1 9 . 1 1 33 33 GLN C C 232 175.790 175.790 175.352 0.438 18000 2014 1 9 . 1 1 33 33 GLN CA C 232 53.650 53.650 55.860 -2.210 18000 2015 1 9 . 1 1 33 33 GLN CB C 232 30.520 30.520 30.287 0.233 18000 2016 1 9 . 1 1 33 33 GLN H H 232 8.110 8.110 8.262 -0.152 18000 2017 1 9 . 1 1 34 34 LEU N N 233 112.480 112.480 118.663 -6.183 18000 2018 1 9 . 1 1 34 34 LEU HA H 233 4.460 4.460 4.472 -0.012 18000 2019 1 9 . 1 1 34 34 LEU C C 233 172.610 172.610 175.574 -2.964 18000 2020 1 9 . 1 1 34 34 LEU CA C 233 52.460 52.460 55.318 -2.858 18000 2021 1 9 . 1 1 34 34 LEU CB C 233 39.140 39.140 44.094 -4.954 18000 2022 1 9 . 1 1 34 34 LEU H H 233 6.980 6.980 7.976 -0.996 18000 2023 1 9 . 1 1 35 35 LEU N N 234 115.860 115.860 122.203 -6.343 18000 2024 1 9 . 1 1 35 35 LEU HA H 234 4.510 4.510 4.101 0.409 18000 2025 1 9 . 1 1 35 35 LEU C C 234 178.330 178.330 175.802 2.528 18000 2026 1 9 . 1 1 35 35 LEU CA C 234 51.900 51.900 55.564 -3.664 18000 2027 1 9 . 1 1 35 35 LEU CB C 234 40.950 40.950 41.458 -0.508 18000 2028 1 9 . 1 1 35 35 LEU H H 234 7.560 7.560 8.073 -0.513 18000 2029 1 9 . 1 1 36 36 TYR N N 235 125.850 125.850 120.208 5.642 18000 2030 1 9 . 1 1 36 36 TYR HA H 235 4.790 4.790 4.766 0.024 18000 2031 1 9 . 1 1 36 36 TYR C C 235 176.260 176.260 175.349 0.911 18000 2032 1 9 . 1 1 36 36 TYR CA C 235 57.750 57.750 56.887 0.863 18000 2033 1 9 . 1 1 36 36 TYR CB C 235 37.100 37.100 39.918 -2.818 18000 2034 1 9 . 1 1 36 36 TYR H H 235 9.750 9.750 7.846 1.904 18000 2035 1 9 . 1 1 37 37 LYS N N 236 123.880 123.880 124.369 -0.489 18000 2036 1 9 . 1 1 37 37 LYS HA H 236 3.930 3.930 4.539 -0.609 18000 2037 1 9 . 1 1 37 37 LYS C C 236 178.280 178.280 175.846 2.434 18000 2038 1 9 . 1 1 37 37 LYS CA C 236 59.210 59.210 55.577 3.633 18000 2039 1 9 . 1 1 37 37 LYS CB C 236 30.430 30.430 33.108 -2.678 18000 2040 1 9 . 1 1 37 37 LYS H H 236 9.340 9.340 8.617 0.723 18000 2041 1 9 . 1 1 38 38 PHE N N 237 117.150 117.150 120.994 -3.844 18000 2042 1 9 . 1 1 38 38 PHE HA H 237 4.460 4.460 4.719 -0.259 18000 2043 1 9 . 1 1 38 38 PHE C C 237 173.930 173.930 175.477 -1.547 18000 2044 1 9 . 1 1 38 38 PHE CA C 237 58.510 58.510 56.573 1.937 18000 2045 1 9 . 1 1 38 38 PHE CB C 237 38.370 38.370 39.012 -0.642 18000 2046 1 9 . 1 1 38 38 PHE H H 237 9.120 9.120 8.283 0.837 18000 2047 1 9 . 1 1 39 39 GLU HA H 238 4.160 4.160 4.317 -0.157 18000 2048 1 9 . 1 1 39 39 GLU C C 238 175.650 175.650 176.115 -0.465 18000 2049 1 9 . 1 1 39 39 GLU CA C 238 55.070 55.070 56.916 -1.846 18000 2050 1 9 . 1 1 39 39 GLU CB C 238 31.540 31.540 30.281 1.259 18000 2051 1 9 . 1 1 40 40 ARG N N 239 120.330 120.330 119.233 1.097 18000 2052 1 9 . 1 1 40 40 ARG HA H 239 4.250 4.250 4.473 -0.223 18000 2053 1 9 . 1 1 40 40 ARG C C 239 174.490 174.490 174.227 0.263 18000 2054 1 9 . 1 1 40 40 ARG CA C 239 60.410 60.410 55.539 4.871 18000 2055 1 9 . 1 1 40 40 ARG H H 239 7.980 7.980 8.229 -0.249 18000 2056 1 9 . 1 1 41 41 PRO N N 240 115.390 115.390 115.135 0.255 18000 2057 1 9 . 1 1 41 41 PRO HA H 240 4.360 4.360 5.243 -0.883 18000 2058 1 9 . 1 1 41 41 PRO C C 240 176.330 176.330 176.422 -0.092 18000 2059 1 9 . 1 1 41 41 PRO CA C 240 64.400 64.400 63.294 1.106 18000 2060 1 9 . 1 1 41 41 PRO CB C 240 62.240 62.240 64.870 -2.630 18000 2061 1 9 . 1 1 41 41 PRO H H 240 8.090 8.090 8.593 -0.503 18000 2062 1 10 . 1 1 2 2 ARG N N 201 119.330 119.330 120.870 -1.540 18000 2063 1 10 . 1 1 2 2 ARG HA H 201 3.560 3.560 4.729 -1.169 18000 2064 1 10 . 1 1 2 2 ARG C C 201 176.850 176.850 175.030 1.820 18000 2065 1 10 . 1 1 2 2 ARG CA C 201 55.340 55.340 55.095 0.245 18000 2066 1 10 . 1 1 2 2 ARG CB C 201 27.020 27.020 31.185 -4.165 18000 2067 1 10 . 1 1 2 2 ARG H H 201 8.370 8.370 7.381 0.989 18000 2068 1 10 . 1 1 3 3 LYS N N 202 118.540 118.540 123.697 -5.157 18000 2069 1 10 . 1 1 3 3 LYS HA H 202 4.010 4.010 4.548 -0.538 18000 2070 1 10 . 1 1 3 3 LYS C C 202 176.090 176.090 176.446 -0.356 18000 2071 1 10 . 1 1 3 3 LYS CA C 202 56.960 56.960 55.873 1.087 18000 2072 1 10 . 1 1 3 3 LYS CB C 202 30.590 30.590 34.588 -3.998 18000 2073 1 10 . 1 1 3 3 LYS H H 202 7.940 7.940 8.364 -0.424 18000 2074 1 10 . 1 1 4 4 SER N N 203 113.880 113.880 124.158 -10.278 18000 2075 1 10 . 1 1 4 4 SER HA H 203 4.320 4.320 4.926 -0.606 18000 2076 1 10 . 1 1 4 4 SER C C 203 172.900 172.900 173.076 -0.176 18000 2077 1 10 . 1 1 4 4 SER CA C 203 57.870 57.870 56.017 1.853 18000 2078 1 10 . 1 1 4 4 SER CB C 203 61.700 61.700 62.641 -0.940 18000 2079 1 10 . 1 1 4 4 SER H H 203 7.700 7.700 8.478 -0.778 18000 2080 1 10 . 1 1 5 5 ARG HA H 204 4.240 4.240 4.289 -0.049 18000 2081 1 10 . 1 1 5 5 ARG C C 204 174.810 174.810 174.818 -0.008 18000 2082 1 10 . 1 1 5 5 ARG CA C 204 54.270 54.270 56.094 -1.824 18000 2083 1 10 . 1 1 5 5 ARG CB C 204 28.700 28.700 30.996 -2.296 18000 2084 1 10 . 1 1 6 6 GLY N N 205 125.950 125.950 109.117 16.833 18000 2085 1 10 . 1 1 6 6 GLY HA H 205 4.400 4.400 4.432 -0.032 18000 2086 1 10 . 1 1 6 6 GLY C C 205 171.910 171.910 174.130 -2.220 18000 2087 1 10 . 1 1 6 6 GLY CA C 205 43.570 43.570 44.241 -0.671 18000 2088 1 10 . 1 1 6 6 GLY CB C 205 28.340 28.340 30.561 -2.221 18000 2089 1 10 . 1 1 6 6 GLY H H 205 7.930 7.930 8.307 -0.377 18000 2090 1 10 . 1 1 7 7 ASN N N 206 118.380 118.380 122.437 -4.057 18000 2091 1 10 . 1 1 7 7 ASN HA H 206 4.760 4.760 4.829 -0.069 18000 2092 1 10 . 1 1 7 7 ASN C C 206 173.810 173.810 177.847 -4.037 18000 2093 1 10 . 1 1 7 7 ASN CA C 206 51.430 51.430 54.951 -3.521 18000 2094 1 10 . 1 1 7 7 ASN CB C 206 37.090 37.090 38.069 -0.979 18000 2095 1 10 . 1 1 7 7 ASN H H 206 8.330 8.330 8.893 -0.563 18000 2096 1 10 . 1 1 8 8 THR N N 207 119.850 119.850 120.667 -0.817 18000 2097 1 10 . 1 1 8 8 THR HA H 207 4.270 4.270 4.109 0.161 18000 2098 1 10 . 1 1 8 8 THR C C 207 172.560 172.560 176.952 -4.392 18000 2099 1 10 . 1 1 8 8 THR CA C 207 60.420 60.420 65.656 -5.236 18000 2100 1 10 . 1 1 8 8 THR CB C 207 67.750 67.750 68.286 -0.536 18000 2101 1 10 . 1 1 8 8 THR H H 207 7.830 7.830 8.556 -0.726 18000 2102 1 10 . 1 1 9 9 ASP N N 208 121.180 121.180 118.573 2.607 18000 2103 1 10 . 1 1 9 9 ASP HA H 208 4.550 4.550 5.076 -0.526 18000 2104 1 10 . 1 1 9 9 ASP C C 208 174.170 174.170 175.973 -1.803 18000 2105 1 10 . 1 1 9 9 ASP CA C 208 52.670 52.670 57.690 -5.020 18000 2106 1 10 . 1 1 9 9 ASP CB C 208 39.120 39.120 38.194 0.926 18000 2107 1 10 . 1 1 9 9 ASP H H 208 8.350 8.350 8.817 -0.467 18000 2108 1 10 . 1 1 10 10 ASN HA H 209 4.600 4.600 4.470 0.130 18000 2109 1 10 . 1 1 10 10 ASN C C 209 173.670 173.670 177.421 -3.751 18000 2110 1 10 . 1 1 10 10 ASN CA C 209 52.110 52.110 56.160 -4.050 18000 2111 1 10 . 1 1 10 10 ASN CB C 209 36.730 36.730 37.975 -1.245 18000 2112 1 10 . 1 1 11 11 LYS N N 210 120.380 120.380 117.546 2.834 18000 2113 1 10 . 1 1 11 11 LYS HA H 210 4.270 4.270 4.010 0.260 18000 2114 1 10 . 1 1 11 11 LYS C C 210 174.910 174.910 178.671 -3.761 18000 2115 1 10 . 1 1 11 11 LYS CA C 210 54.900 54.900 60.538 -5.638 18000 2116 1 10 . 1 1 11 11 LYS CB C 210 30.670 30.670 32.300 -1.631 18000 2117 1 10 . 1 1 11 11 LYS H H 210 8.210 8.210 8.475 -0.265 18000 2118 1 10 . 1 1 12 12 GLU N N 211 120.740 120.740 120.880 -0.140 18000 2119 1 10 . 1 1 12 12 GLU HA H 211 4.070 4.070 3.988 0.082 18000 2120 1 10 . 1 1 12 12 GLU C C 211 174.810 174.810 179.239 -4.429 18000 2121 1 10 . 1 1 12 12 GLU CA C 211 55.940 55.940 60.006 -4.066 18000 2122 1 10 . 1 1 12 12 GLU CB C 211 27.700 27.700 29.476 -1.776 18000 2123 1 10 . 1 1 12 12 GLU H H 211 8.380 8.380 8.205 0.175 18000 2124 1 10 . 1 1 13 13 TYR N N 212 119.430 119.430 118.812 0.618 18000 2125 1 10 . 1 1 13 13 TYR HA H 212 4.380 4.380 4.208 0.172 18000 2126 1 10 . 1 1 13 13 TYR C C 212 174.830 174.830 178.409 -3.579 18000 2127 1 10 . 1 1 13 13 TYR CA C 212 57.420 57.420 61.002 -3.582 18000 2128 1 10 . 1 1 13 13 TYR CB C 212 36.530 36.530 38.019 -1.489 18000 2129 1 10 . 1 1 13 13 TYR H H 212 7.940 7.940 8.097 -0.157 18000 2130 1 10 . 1 1 14 14 ALA N N 213 121.810 121.810 120.403 1.407 18000 2131 1 10 . 1 1 14 14 ALA HA H 213 4.260 4.260 4.002 0.258 18000 2132 1 10 . 1 1 14 14 ALA C C 213 176.630 176.630 179.585 -2.955 18000 2133 1 10 . 1 1 14 14 ALA CA C 213 51.990 51.990 55.302 -3.312 18000 2134 1 10 . 1 1 14 14 ALA CB C 213 16.450 16.450 18.737 -2.287 18000 2135 1 10 . 1 1 14 14 ALA H H 213 7.920 7.920 8.070 -0.150 18000 2136 1 10 . 1 1 15 15 VAL N N 214 121.430 121.430 119.230 2.200 18000 2137 1 10 . 1 1 15 15 VAL HA H 214 3.470 3.470 3.569 -0.099 18000 2138 1 10 . 1 1 15 15 VAL C C 214 174.980 174.980 177.763 -2.783 18000 2139 1 10 . 1 1 15 15 VAL CA C 214 64.190 64.190 66.506 -2.316 18000 2140 1 10 . 1 1 15 15 VAL CB C 214 29.820 29.820 31.368 -1.548 18000 2141 1 10 . 1 1 15 15 VAL H H 214 8.680 8.680 8.637 0.043 18000 2142 1 10 . 1 1 16 16 ASN N N 215 117.460 117.460 118.136 -0.676 18000 2143 1 10 . 1 1 16 16 ASN HA H 215 4.300 4.300 4.426 -0.126 18000 2144 1 10 . 1 1 16 16 ASN C C 215 176.320 176.320 177.290 -0.970 18000 2145 1 10 . 1 1 16 16 ASN CA C 215 54.190 54.190 55.971 -1.781 18000 2146 1 10 . 1 1 16 16 ASN CB C 215 35.360 35.360 37.585 -2.225 18000 2147 1 10 . 1 1 16 16 ASN H H 215 8.190 8.190 8.592 -0.402 18000 2148 1 10 . 1 1 17 17 GLU N N 216 119.430 119.430 117.783 1.647 18000 2149 1 10 . 1 1 17 17 GLU HA H 216 4.000 4.000 4.104 -0.104 18000 2150 1 10 . 1 1 17 17 GLU C C 216 177.240 177.240 178.463 -1.223 18000 2151 1 10 . 1 1 17 17 GLU CA C 216 57.180 57.180 58.994 -1.814 18000 2152 1 10 . 1 1 17 17 GLU CB C 216 28.400 28.400 29.125 -0.725 18000 2153 1 10 . 1 1 17 17 GLU H H 216 7.730 7.730 8.060 -0.330 18000 2154 1 10 . 1 1 18 18 VAL N N 217 120.690 120.690 118.054 2.636 18000 2155 1 10 . 1 1 18 18 VAL HA H 217 3.530 3.530 3.866 -0.336 18000 2156 1 10 . 1 1 18 18 VAL C C 217 174.990 174.990 178.716 -3.726 18000 2157 1 10 . 1 1 18 18 VAL CA C 217 64.310 64.310 64.936 -0.626 18000 2158 1 10 . 1 1 18 18 VAL CB C 217 29.640 29.640 31.141 -1.501 18000 2159 1 10 . 1 1 18 18 VAL H H 217 7.820 7.820 7.813 0.007 18000 2160 1 10 . 1 1 19 19 VAL N N 218 117.010 117.010 115.836 1.174 18000 2161 1 10 . 1 1 19 19 VAL HA H 218 3.500 3.500 3.808 -0.307 18000 2162 1 10 . 1 1 19 19 VAL C C 218 175.200 175.200 176.762 -1.562 18000 2163 1 10 . 1 1 19 19 VAL CA C 218 64.960 64.960 65.454 -0.494 18000 2164 1 10 . 1 1 19 19 VAL CB C 218 29.710 29.710 31.825 -2.115 18000 2165 1 10 . 1 1 19 19 VAL H H 218 8.260 8.260 7.883 0.377 18000 2166 1 10 . 1 1 20 20 ALA N N 219 120.360 120.360 117.544 2.816 18000 2167 1 10 . 1 1 20 20 ALA HA H 219 3.930 3.930 4.251 -0.321 18000 2168 1 10 . 1 1 20 20 ALA C C 219 178.310 178.310 177.741 0.569 18000 2169 1 10 . 1 1 20 20 ALA CA C 219 53.040 53.040 51.956 1.084 18000 2170 1 10 . 1 1 20 20 ALA CB C 219 16.280 16.280 18.840 -2.560 18000 2171 1 10 . 1 1 20 20 ALA H H 219 7.490 7.490 7.324 0.166 18000 2172 1 10 . 1 1 21 21 GLY N N 220 124.250 124.250 108.896 15.354 18000 2173 1 10 . 1 1 21 21 GLY HA H 220 4.250 4.250 4.244 0.006 18000 2174 1 10 . 1 1 21 21 GLY C C 220 172.880 172.880 174.808 -1.928 18000 2175 1 10 . 1 1 21 21 GLY CA C 220 44.130 44.130 44.142 -0.012 18000 2176 1 10 . 1 1 21 21 GLY CB C 220 29.290 29.290 28.941 0.349 18000 2177 1 10 . 1 1 21 21 GLY H H 220 7.640 7.640 7.481 0.159 18000 2178 1 10 . 1 1 22 22 ILE N N 221 119.940 119.940 126.120 -6.180 18000 2179 1 10 . 1 1 22 22 ILE HA H 221 3.290 3.290 4.185 -0.895 18000 2180 1 10 . 1 1 22 22 ILE C C 221 175.100 175.100 174.775 0.325 18000 2181 1 10 . 1 1 22 22 ILE CA C 221 64.070 64.070 60.090 3.980 18000 2182 1 10 . 1 1 22 22 ILE CB C 221 35.260 35.260 37.762 -2.502 18000 2183 1 10 . 1 1 22 22 ILE H H 221 8.130 8.130 8.087 0.043 18000 2184 1 10 . 1 1 23 23 LYS HA H 222 3.430 3.430 4.289 -0.859 18000 2185 1 10 . 1 1 23 23 LYS C C 222 175.280 175.280 175.206 0.074 18000 2186 1 10 . 1 1 23 23 LYS CA C 222 59.270 59.270 57.003 2.267 18000 2187 1 10 . 1 1 23 23 LYS CB C 222 30.670 30.670 31.266 -0.596 18000 2188 1 10 . 1 1 24 24 GLU N N 223 116.150 116.150 122.473 -6.323 18000 2189 1 10 . 1 1 24 24 GLU HA H 223 4.150 4.150 4.559 -0.409 18000 2190 1 10 . 1 1 24 24 GLU C C 223 177.330 177.330 176.381 0.949 18000 2191 1 10 . 1 1 24 24 GLU CA C 223 57.180 57.180 54.696 2.484 18000 2192 1 10 . 1 1 24 24 GLU CB C 223 27.670 27.670 31.354 -3.684 18000 2193 1 10 . 1 1 24 24 GLU H H 223 7.830 7.830 8.113 -0.283 18000 2194 1 10 . 1 1 25 25 TYR N N 224 119.760 119.760 122.361 -2.601 18000 2195 1 10 . 1 1 25 25 TYR HA H 224 4.480 4.480 4.546 -0.066 18000 2196 1 10 . 1 1 25 25 TYR C C 224 175.680 175.680 175.404 0.276 18000 2197 1 10 . 1 1 25 25 TYR CA C 224 57.520 57.520 57.920 -0.401 18000 2198 1 10 . 1 1 25 25 TYR CB C 224 36.940 36.940 39.229 -2.289 18000 2199 1 10 . 1 1 25 25 TYR H H 224 8.630 8.630 8.385 0.245 18000 2200 1 10 . 1 1 26 26 PHE N N 225 120.090 120.090 125.990 -5.900 18000 2201 1 10 . 1 1 26 26 PHE HA H 225 3.410 3.410 4.454 -1.044 18000 2202 1 10 . 1 1 26 26 PHE C C 225 173.930 173.930 175.035 -1.105 18000 2203 1 10 . 1 1 26 26 PHE CA C 225 61.600 61.600 59.157 2.443 18000 2204 1 10 . 1 1 26 26 PHE CB C 225 36.590 36.590 39.645 -3.055 18000 2205 1 10 . 1 1 26 26 PHE H H 225 9.220 9.220 8.760 0.460 18000 2206 1 10 . 1 1 27 27 ASN N N 226 115.010 115.010 124.109 -9.099 18000 2207 1 10 . 1 1 27 27 ASN HA H 226 4.470 4.470 4.937 -0.467 18000 2208 1 10 . 1 1 27 27 ASN C C 226 176.630 176.630 173.105 3.525 18000 2209 1 10 . 1 1 27 27 ASN CA C 226 54.160 54.160 51.040 3.120 18000 2210 1 10 . 1 1 27 27 ASN CB C 226 35.800 35.800 41.766 -5.966 18000 2211 1 10 . 1 1 27 27 ASN H H 226 8.210 8.210 7.977 0.233 18000 2212 1 10 . 1 1 28 28 VAL N N 227 115.120 115.120 120.411 -5.291 18000 2213 1 10 . 1 1 28 28 VAL HA H 227 4.300 4.300 4.343 -0.043 18000 2214 1 10 . 1 1 28 28 VAL C C 227 174.960 174.960 173.948 1.012 18000 2215 1 10 . 1 1 28 28 VAL CA C 227 61.320 61.320 59.658 1.661 18000 2216 1 10 . 1 1 28 28 VAL CB C 227 30.670 30.670 32.815 -2.145 18000 2217 1 10 . 1 1 28 28 VAL H H 227 7.430 7.430 8.317 -0.887 18000 2218 1 10 . 1 1 29 29 MET HA H 228 4.000 4.000 4.499 -0.499 18000 2219 1 10 . 1 1 29 29 MET C C 228 176.270 176.270 176.114 0.156 18000 2220 1 10 . 1 1 29 29 MET CA C 228 54.030 54.030 54.858 -0.828 18000 2221 1 10 . 1 1 29 29 MET CB C 228 31.510 31.510 33.615 -2.105 18000 2222 1 10 . 1 1 30 30 LEU N N 229 122.180 122.180 123.251 -1.071 18000 2223 1 10 . 1 1 30 30 LEU HA H 229 3.150 3.150 3.979 -0.829 18000 2224 1 10 . 1 1 30 30 LEU C C 229 176.070 176.070 178.696 -2.626 18000 2225 1 10 . 1 1 30 30 LEU CA C 229 55.860 55.860 58.165 -2.305 18000 2226 1 10 . 1 1 30 30 LEU CB C 229 36.340 36.340 42.045 -5.705 18000 2227 1 10 . 1 1 30 30 LEU H H 229 7.890 7.890 8.542 -0.652 18000 2228 1 10 . 1 1 31 31 GLY N N 230 118.390 118.390 108.169 10.221 18000 2229 1 10 . 1 1 31 31 GLY HA H 230 4.090 4.090 4.117 -0.027 18000 2230 1 10 . 1 1 31 31 GLY C C 230 173.070 173.070 175.756 -2.686 18000 2231 1 10 . 1 1 31 31 GLY CA C 230 43.150 43.150 47.209 -4.059 18000 2232 1 10 . 1 1 31 31 GLY CB C 230 26.780 26.780 29.391 -2.611 18000 2233 1 10 . 1 1 31 31 GLY H H 230 8.350 8.350 8.332 0.018 18000 2234 1 10 . 1 1 32 32 THR N N 231 124.790 124.790 111.336 13.454 18000 2235 1 10 . 1 1 32 32 THR HA H 231 4.280 4.280 4.434 -0.154 18000 2236 1 10 . 1 1 32 32 THR C C 231 173.260 173.260 175.486 -2.226 18000 2237 1 10 . 1 1 32 32 THR CA C 231 60.030 60.030 62.830 -2.800 18000 2238 1 10 . 1 1 32 32 THR CB C 231 68.540 68.540 70.609 -2.069 18000 2239 1 10 . 1 1 32 32 THR H H 231 7.040 7.040 7.679 -0.639 18000 2240 1 10 . 1 1 33 33 GLN N N 232 114.740 114.740 118.551 -3.811 18000 2241 1 10 . 1 1 33 33 GLN HA H 232 5.090 5.090 4.455 0.635 18000 2242 1 10 . 1 1 33 33 GLN C C 232 175.790 175.790 175.426 0.364 18000 2243 1 10 . 1 1 33 33 GLN CA C 232 53.650 53.650 55.795 -2.145 18000 2244 1 10 . 1 1 33 33 GLN CB C 232 30.520 30.520 29.071 1.449 18000 2245 1 10 . 1 1 33 33 GLN H H 232 8.110 8.110 8.169 -0.059 18000 2246 1 10 . 1 1 34 34 LEU N N 233 112.480 112.480 126.287 -13.807 18000 2247 1 10 . 1 1 34 34 LEU HA H 233 4.460 4.460 4.399 0.061 18000 2248 1 10 . 1 1 34 34 LEU C C 233 172.610 172.610 178.333 -5.723 18000 2249 1 10 . 1 1 34 34 LEU CA C 233 52.460 52.460 55.299 -2.839 18000 2250 1 10 . 1 1 34 34 LEU CB C 233 39.140 39.140 42.890 -3.750 18000 2251 1 10 . 1 1 34 34 LEU H H 233 6.980 6.980 9.083 -2.103 18000 2252 1 10 . 1 1 35 35 LEU N N 234 115.860 115.860 118.636 -2.776 18000 2253 1 10 . 1 1 35 35 LEU HA H 234 4.510 4.510 3.834 0.676 18000 2254 1 10 . 1 1 35 35 LEU C C 234 178.330 178.330 176.591 1.739 18000 2255 1 10 . 1 1 35 35 LEU CA C 234 51.900 51.900 57.501 -5.601 18000 2256 1 10 . 1 1 35 35 LEU CB C 234 40.950 40.950 40.285 0.665 18000 2257 1 10 . 1 1 35 35 LEU H H 234 7.560 7.560 8.088 -0.528 18000 2258 1 10 . 1 1 36 36 TYR N N 235 125.850 125.850 124.546 1.304 18000 2259 1 10 . 1 1 36 36 TYR HA H 235 4.790 4.790 4.644 0.146 18000 2260 1 10 . 1 1 36 36 TYR C C 235 176.260 176.260 175.372 0.888 18000 2261 1 10 . 1 1 36 36 TYR CA C 235 57.750 57.750 57.550 0.200 18000 2262 1 10 . 1 1 36 36 TYR CB C 235 37.100 37.100 39.017 -1.917 18000 2263 1 10 . 1 1 36 36 TYR H H 235 9.750 9.750 8.081 1.669 18000 2264 1 10 . 1 1 37 37 LYS N N 236 123.880 123.880 126.931 -3.051 18000 2265 1 10 . 1 1 37 37 LYS HA H 236 3.930 3.930 4.536 -0.606 18000 2266 1 10 . 1 1 37 37 LYS C C 236 178.280 178.280 176.529 1.751 18000 2267 1 10 . 1 1 37 37 LYS CA C 236 59.210 59.210 55.449 3.761 18000 2268 1 10 . 1 1 37 37 LYS CB C 236 30.430 30.430 33.346 -2.916 18000 2269 1 10 . 1 1 37 37 LYS H H 236 9.340 9.340 8.390 0.950 18000 2270 1 10 . 1 1 38 38 PHE N N 237 117.150 117.150 121.602 -4.452 18000 2271 1 10 . 1 1 38 38 PHE HA H 237 4.460 4.460 4.575 -0.115 18000 2272 1 10 . 1 1 38 38 PHE C C 237 173.930 173.930 174.331 -0.401 18000 2273 1 10 . 1 1 38 38 PHE CA C 237 58.510 58.510 56.221 2.288 18000 2274 1 10 . 1 1 38 38 PHE CB C 237 38.370 38.370 38.970 -0.600 18000 2275 1 10 . 1 1 38 38 PHE H H 237 9.120 9.120 8.412 0.708 18000 2276 1 10 . 1 1 39 39 GLU HA H 238 4.160 4.160 4.395 -0.235 18000 2277 1 10 . 1 1 39 39 GLU C C 238 175.650 175.650 175.928 -0.278 18000 2278 1 10 . 1 1 39 39 GLU CA C 238 55.070 55.070 56.365 -1.295 18000 2279 1 10 . 1 1 39 39 GLU CB C 238 31.540 31.540 29.323 2.217 18000 2280 1 10 . 1 1 40 40 ARG N N 239 120.330 120.330 125.091 -4.761 18000 2281 1 10 . 1 1 40 40 ARG HA H 239 4.250 4.250 4.204 0.046 18000 2282 1 10 . 1 1 40 40 ARG C C 239 174.490 174.490 174.717 -0.227 18000 2283 1 10 . 1 1 40 40 ARG CA C 239 60.410 60.410 55.546 4.864 18000 2284 1 10 . 1 1 40 40 ARG H H 239 7.980 7.980 8.189 -0.209 18000 2285 1 10 . 1 1 41 41 PRO N N 240 115.390 115.390 115.075 0.315 18000 2286 1 10 . 1 1 41 41 PRO HA H 240 4.360 4.360 4.615 -0.255 18000 2287 1 10 . 1 1 41 41 PRO C C 240 176.330 176.330 176.348 -0.018 18000 2288 1 10 . 1 1 41 41 PRO CA C 240 64.400 64.400 62.577 1.823 18000 2289 1 10 . 1 1 41 41 PRO CB C 240 62.240 62.240 63.844 -1.604 18000 2290 1 10 . 1 1 41 41 PRO H H 240 8.090 8.090 8.214 -0.124 18000 2291 1 11 . 1 1 2 2 ARG N N 201 119.330 119.330 117.934 1.396 18000 2292 1 11 . 1 1 2 2 ARG HA H 201 3.560 3.560 4.638 -1.078 18000 2293 1 11 . 1 1 2 2 ARG C C 201 176.850 176.850 175.455 1.395 18000 2294 1 11 . 1 1 2 2 ARG CA C 201 55.340 55.340 55.197 0.143 18000 2295 1 11 . 1 1 2 2 ARG CB C 201 27.020 27.020 31.078 -4.058 18000 2296 1 11 . 1 1 2 2 ARG H H 201 8.370 8.370 8.397 -0.027 18000 2297 1 11 . 1 1 3 3 LYS N N 202 118.540 118.540 123.725 -5.185 18000 2298 1 11 . 1 1 3 3 LYS HA H 202 4.010 4.010 4.095 -0.085 18000 2299 1 11 . 1 1 3 3 LYS C C 202 176.090 176.090 176.355 -0.265 18000 2300 1 11 . 1 1 3 3 LYS CA C 202 56.960 56.960 57.055 -0.095 18000 2301 1 11 . 1 1 3 3 LYS CB C 202 30.590 30.590 31.555 -0.965 18000 2302 1 11 . 1 1 3 3 LYS H H 202 7.940 7.940 8.541 -0.601 18000 2303 1 11 . 1 1 4 4 SER N N 203 113.880 113.880 123.798 -9.918 18000 2304 1 11 . 1 1 4 4 SER HA H 203 4.320 4.320 4.822 -0.502 18000 2305 1 11 . 1 1 4 4 SER C C 203 172.900 172.900 172.522 0.378 18000 2306 1 11 . 1 1 4 4 SER CA C 203 57.870 57.870 55.822 2.049 18000 2307 1 11 . 1 1 4 4 SER CB C 203 61.700 61.700 62.948 -1.248 18000 2308 1 11 . 1 1 4 4 SER H H 203 7.700 7.700 8.094 -0.394 18000 2309 1 11 . 1 1 5 5 ARG HA H 204 4.240 4.240 4.336 -0.096 18000 2310 1 11 . 1 1 5 5 ARG C C 204 174.810 174.810 174.386 0.424 18000 2311 1 11 . 1 1 5 5 ARG CA C 204 54.270 54.270 55.616 -1.346 18000 2312 1 11 . 1 1 5 5 ARG CB C 204 28.700 28.700 30.795 -2.095 18000 2313 1 11 . 1 1 6 6 GLY N N 205 125.950 125.950 109.112 16.838 18000 2314 1 11 . 1 1 6 6 GLY HA H 205 4.400 4.400 4.370 0.030 18000 2315 1 11 . 1 1 6 6 GLY C C 205 171.910 171.910 174.552 -2.642 18000 2316 1 11 . 1 1 6 6 GLY CA C 205 43.570 43.570 44.520 -0.950 18000 2317 1 11 . 1 1 6 6 GLY CB C 205 28.340 28.340 29.821 -1.481 18000 2318 1 11 . 1 1 6 6 GLY H H 205 7.930 7.930 8.386 -0.456 18000 2319 1 11 . 1 1 7 7 ASN N N 206 118.380 118.380 119.719 -1.339 18000 2320 1 11 . 1 1 7 7 ASN HA H 206 4.760 4.760 4.641 0.119 18000 2321 1 11 . 1 1 7 7 ASN C C 206 173.810 173.810 177.575 -3.765 18000 2322 1 11 . 1 1 7 7 ASN CA C 206 51.430 51.430 54.959 -3.529 18000 2323 1 11 . 1 1 7 7 ASN CB C 206 37.090 37.090 38.342 -1.252 18000 2324 1 11 . 1 1 7 7 ASN H H 206 8.330 8.330 8.792 -0.462 18000 2325 1 11 . 1 1 8 8 THR N N 207 119.850 119.850 120.264 -0.414 18000 2326 1 11 . 1 1 8 8 THR HA H 207 4.270 4.270 4.061 0.209 18000 2327 1 11 . 1 1 8 8 THR C C 207 172.560 172.560 176.888 -4.328 18000 2328 1 11 . 1 1 8 8 THR CA C 207 60.420 60.420 65.887 -5.467 18000 2329 1 11 . 1 1 8 8 THR CB C 207 67.750 67.750 68.292 -0.542 18000 2330 1 11 . 1 1 8 8 THR H H 207 7.830 7.830 8.656 -0.826 18000 2331 1 11 . 1 1 9 9 ASP N N 208 121.180 121.180 117.774 3.406 18000 2332 1 11 . 1 1 9 9 ASP HA H 208 4.550 4.550 4.628 -0.078 18000 2333 1 11 . 1 1 9 9 ASP C C 208 174.170 174.170 176.509 -2.339 18000 2334 1 11 . 1 1 9 9 ASP CA C 208 52.670 52.670 58.106 -5.436 18000 2335 1 11 . 1 1 9 9 ASP CB C 208 39.120 39.120 38.072 1.048 18000 2336 1 11 . 1 1 9 9 ASP H H 208 8.350 8.350 8.272 0.078 18000 2337 1 11 . 1 1 10 10 ASN HA H 209 4.600 4.600 4.472 0.128 18000 2338 1 11 . 1 1 10 10 ASN C C 209 173.670 173.670 177.427 -3.757 18000 2339 1 11 . 1 1 10 10 ASN CA C 209 52.110 52.110 56.148 -4.038 18000 2340 1 11 . 1 1 10 10 ASN CB C 209 36.730 36.730 37.941 -1.211 18000 2341 1 11 . 1 1 11 11 LYS N N 210 120.380 120.380 117.381 2.999 18000 2342 1 11 . 1 1 11 11 LYS HA H 210 4.270 4.270 4.036 0.234 18000 2343 1 11 . 1 1 11 11 LYS C C 210 174.910 174.910 178.880 -3.970 18000 2344 1 11 . 1 1 11 11 LYS CA C 210 54.900 54.900 60.037 -5.137 18000 2345 1 11 . 1 1 11 11 LYS CB C 210 30.670 30.670 31.967 -1.297 18000 2346 1 11 . 1 1 11 11 LYS H H 210 8.210 8.210 8.526 -0.316 18000 2347 1 11 . 1 1 12 12 GLU N N 211 120.740 120.740 120.197 0.543 18000 2348 1 11 . 1 1 12 12 GLU HA H 211 4.070 4.070 4.025 0.045 18000 2349 1 11 . 1 1 12 12 GLU C C 211 174.810 174.810 179.511 -4.701 18000 2350 1 11 . 1 1 12 12 GLU CA C 211 55.940 55.940 59.768 -3.828 18000 2351 1 11 . 1 1 12 12 GLU CB C 211 27.700 27.700 29.128 -1.429 18000 2352 1 11 . 1 1 12 12 GLU H H 211 8.380 8.380 8.386 -0.006 18000 2353 1 11 . 1 1 13 13 TYR N N 212 119.430 119.430 119.233 0.197 18000 2354 1 11 . 1 1 13 13 TYR HA H 212 4.380 4.380 4.235 0.145 18000 2355 1 11 . 1 1 13 13 TYR C C 212 174.830 174.830 178.185 -3.355 18000 2356 1 11 . 1 1 13 13 TYR CA C 212 57.420 57.420 61.099 -3.679 18000 2357 1 11 . 1 1 13 13 TYR CB C 212 36.530 36.530 38.124 -1.594 18000 2358 1 11 . 1 1 13 13 TYR H H 212 7.940 7.940 8.224 -0.284 18000 2359 1 11 . 1 1 14 14 ALA N N 213 121.810 121.810 119.998 1.812 18000 2360 1 11 . 1 1 14 14 ALA HA H 213 4.260 4.260 3.871 0.389 18000 2361 1 11 . 1 1 14 14 ALA C C 213 176.630 176.630 180.138 -3.508 18000 2362 1 11 . 1 1 14 14 ALA CA C 213 51.990 51.990 55.470 -3.480 18000 2363 1 11 . 1 1 14 14 ALA CB C 213 16.450 16.450 18.681 -2.231 18000 2364 1 11 . 1 1 14 14 ALA H H 213 7.920 7.920 8.379 -0.459 18000 2365 1 11 . 1 1 15 15 VAL N N 214 121.430 121.430 118.723 2.707 18000 2366 1 11 . 1 1 15 15 VAL HA H 214 3.470 3.470 3.582 -0.112 18000 2367 1 11 . 1 1 15 15 VAL C C 214 174.980 174.980 177.868 -2.888 18000 2368 1 11 . 1 1 15 15 VAL CA C 214 64.190 64.190 66.171 -1.981 18000 2369 1 11 . 1 1 15 15 VAL CB C 214 29.820 29.820 31.344 -1.524 18000 2370 1 11 . 1 1 15 15 VAL H H 214 8.680 8.680 8.562 0.118 18000 2371 1 11 . 1 1 16 16 ASN N N 215 117.460 117.460 118.388 -0.928 18000 2372 1 11 . 1 1 16 16 ASN HA H 215 4.300 4.300 4.404 -0.104 18000 2373 1 11 . 1 1 16 16 ASN C C 215 176.320 176.320 177.411 -1.091 18000 2374 1 11 . 1 1 16 16 ASN CA C 215 54.190 54.190 55.989 -1.799 18000 2375 1 11 . 1 1 16 16 ASN CB C 215 35.360 35.360 37.651 -2.291 18000 2376 1 11 . 1 1 16 16 ASN H H 215 8.190 8.190 8.255 -0.065 18000 2377 1 11 . 1 1 17 17 GLU N N 216 119.430 119.430 117.535 1.895 18000 2378 1 11 . 1 1 17 17 GLU HA H 216 4.000 4.000 4.494 -0.494 18000 2379 1 11 . 1 1 17 17 GLU C C 216 177.240 177.240 178.015 -0.775 18000 2380 1 11 . 1 1 17 17 GLU CA C 216 57.180 57.180 58.468 -1.288 18000 2381 1 11 . 1 1 17 17 GLU CB C 216 28.400 28.400 29.490 -1.090 18000 2382 1 11 . 1 1 17 17 GLU H H 216 7.730 7.730 8.561 -0.831 18000 2383 1 11 . 1 1 18 18 VAL N N 217 120.690 120.690 117.741 2.949 18000 2384 1 11 . 1 1 18 18 VAL HA H 217 3.530 3.530 3.947 -0.417 18000 2385 1 11 . 1 1 18 18 VAL C C 217 174.990 174.990 178.624 -3.634 18000 2386 1 11 . 1 1 18 18 VAL CA C 217 64.310 64.310 64.678 -0.368 18000 2387 1 11 . 1 1 18 18 VAL CB C 217 29.640 29.640 31.339 -1.699 18000 2388 1 11 . 1 1 18 18 VAL H H 217 7.820 7.820 7.900 -0.080 18000 2389 1 11 . 1 1 19 19 VAL N N 218 117.010 117.010 116.550 0.460 18000 2390 1 11 . 1 1 19 19 VAL HA H 218 3.500 3.500 3.825 -0.325 18000 2391 1 11 . 1 1 19 19 VAL C C 218 175.200 175.200 177.357 -2.157 18000 2392 1 11 . 1 1 19 19 VAL CA C 218 64.960 64.960 65.482 -0.522 18000 2393 1 11 . 1 1 19 19 VAL CB C 218 29.710 29.710 31.971 -2.261 18000 2394 1 11 . 1 1 19 19 VAL H H 218 8.260 8.260 7.825 0.435 18000 2395 1 11 . 1 1 20 20 ALA N N 219 120.360 120.360 117.993 2.367 18000 2396 1 11 . 1 1 20 20 ALA HA H 219 3.930 3.930 4.191 -0.261 18000 2397 1 11 . 1 1 20 20 ALA C C 219 178.310 178.310 177.574 0.736 18000 2398 1 11 . 1 1 20 20 ALA CA C 219 53.040 53.040 52.131 0.909 18000 2399 1 11 . 1 1 20 20 ALA CB C 219 16.280 16.280 18.928 -2.648 18000 2400 1 11 . 1 1 20 20 ALA H H 219 7.490 7.490 7.332 0.158 18000 2401 1 11 . 1 1 21 21 GLY N N 220 124.250 124.250 108.763 15.487 18000 2402 1 11 . 1 1 21 21 GLY HA H 220 4.250 4.250 4.252 -0.002 18000 2403 1 11 . 1 1 21 21 GLY C C 220 172.880 172.880 174.921 -2.041 18000 2404 1 11 . 1 1 21 21 GLY CA C 220 44.130 44.130 44.351 -0.221 18000 2405 1 11 . 1 1 21 21 GLY CB C 220 29.290 29.290 29.528 -0.238 18000 2406 1 11 . 1 1 21 21 GLY H H 220 7.640 7.640 7.348 0.292 18000 2407 1 11 . 1 1 22 22 ILE N N 221 119.940 119.940 125.920 -5.980 18000 2408 1 11 . 1 1 22 22 ILE HA H 221 3.290 3.290 4.202 -0.912 18000 2409 1 11 . 1 1 22 22 ILE C C 221 175.100 175.100 174.540 0.560 18000 2410 1 11 . 1 1 22 22 ILE CA C 221 64.070 64.070 59.339 4.731 18000 2411 1 11 . 1 1 22 22 ILE CB C 221 35.260 35.260 37.261 -2.001 18000 2412 1 11 . 1 1 22 22 ILE H H 221 8.130 8.130 8.160 -0.030 18000 2413 1 11 . 1 1 23 23 LYS HA H 222 3.430 3.430 4.360 -0.930 18000 2414 1 11 . 1 1 23 23 LYS C C 222 175.280 175.280 175.036 0.244 18000 2415 1 11 . 1 1 23 23 LYS CA C 222 59.270 59.270 56.657 2.614 18000 2416 1 11 . 1 1 23 23 LYS CB C 222 30.670 30.670 31.247 -0.577 18000 2417 1 11 . 1 1 24 24 GLU N N 223 116.150 116.150 122.059 -5.909 18000 2418 1 11 . 1 1 24 24 GLU HA H 223 4.150 4.150 4.477 -0.327 18000 2419 1 11 . 1 1 24 24 GLU C C 223 177.330 177.330 176.444 0.886 18000 2420 1 11 . 1 1 24 24 GLU CA C 223 57.180 57.180 54.928 2.252 18000 2421 1 11 . 1 1 24 24 GLU CB C 223 27.670 27.670 30.772 -3.102 18000 2422 1 11 . 1 1 24 24 GLU H H 223 7.830 7.830 8.158 -0.328 18000 2423 1 11 . 1 1 25 25 TYR N N 224 119.760 119.760 125.764 -6.004 18000 2424 1 11 . 1 1 25 25 TYR HA H 224 4.480 4.480 4.366 0.114 18000 2425 1 11 . 1 1 25 25 TYR C C 224 175.680 175.680 175.631 0.049 18000 2426 1 11 . 1 1 25 25 TYR CA C 224 57.520 57.520 58.300 -0.780 18000 2427 1 11 . 1 1 25 25 TYR CB C 224 36.940 36.940 39.166 -2.226 18000 2428 1 11 . 1 1 25 25 TYR H H 224 8.630 8.630 8.652 -0.022 18000 2429 1 11 . 1 1 26 26 PHE N N 225 120.090 120.090 126.291 -6.201 18000 2430 1 11 . 1 1 26 26 PHE HA H 225 3.410 3.410 4.373 -0.963 18000 2431 1 11 . 1 1 26 26 PHE C C 225 173.930 173.930 174.891 -0.961 18000 2432 1 11 . 1 1 26 26 PHE CA C 225 61.600 61.600 59.094 2.506 18000 2433 1 11 . 1 1 26 26 PHE CB C 225 36.590 36.590 38.970 -2.380 18000 2434 1 11 . 1 1 26 26 PHE H H 225 9.220 9.220 8.681 0.539 18000 2435 1 11 . 1 1 27 27 ASN N N 226 115.010 115.010 125.235 -10.225 18000 2436 1 11 . 1 1 27 27 ASN HA H 226 4.470 4.470 4.611 -0.141 18000 2437 1 11 . 1 1 27 27 ASN C C 226 176.630 176.630 173.399 3.231 18000 2438 1 11 . 1 1 27 27 ASN CA C 226 54.160 54.160 50.990 3.170 18000 2439 1 11 . 1 1 27 27 ASN CB C 226 35.800 35.800 41.464 -5.664 18000 2440 1 11 . 1 1 27 27 ASN H H 226 8.210 8.210 8.387 -0.177 18000 2441 1 11 . 1 1 28 28 VAL N N 227 115.120 115.120 121.379 -6.259 18000 2442 1 11 . 1 1 28 28 VAL HA H 227 4.300 4.300 4.391 -0.091 18000 2443 1 11 . 1 1 28 28 VAL C C 227 174.960 174.960 174.279 0.681 18000 2444 1 11 . 1 1 28 28 VAL CA C 227 61.320 61.320 59.336 1.984 18000 2445 1 11 . 1 1 28 28 VAL CB C 227 30.670 30.670 31.508 -0.838 18000 2446 1 11 . 1 1 28 28 VAL H H 227 7.430 7.430 7.957 -0.527 18000 2447 1 11 . 1 1 29 29 MET HA H 228 4.000 4.000 4.394 -0.394 18000 2448 1 11 . 1 1 29 29 MET C C 228 176.270 176.270 176.171 0.099 18000 2449 1 11 . 1 1 29 29 MET CA C 228 54.030 54.030 55.326 -1.296 18000 2450 1 11 . 1 1 29 29 MET CB C 228 31.510 31.510 33.713 -2.203 18000 2451 1 11 . 1 1 30 30 LEU N N 229 122.180 122.180 122.873 -0.693 18000 2452 1 11 . 1 1 30 30 LEU HA H 229 3.150 3.150 3.906 -0.756 18000 2453 1 11 . 1 1 30 30 LEU C C 229 176.070 176.070 178.080 -2.010 18000 2454 1 11 . 1 1 30 30 LEU CA C 229 55.860 55.860 58.147 -2.287 18000 2455 1 11 . 1 1 30 30 LEU CB C 229 36.340 36.340 42.146 -5.806 18000 2456 1 11 . 1 1 30 30 LEU H H 229 7.890 7.890 8.484 -0.594 18000 2457 1 11 . 1 1 31 31 GLY N N 230 118.390 118.390 105.399 12.991 18000 2458 1 11 . 1 1 31 31 GLY HA H 230 4.090 4.090 4.160 -0.070 18000 2459 1 11 . 1 1 31 31 GLY C C 230 173.070 173.070 175.533 -2.463 18000 2460 1 11 . 1 1 31 31 GLY CA C 230 43.150 43.150 46.407 -3.257 18000 2461 1 11 . 1 1 31 31 GLY CB C 230 26.780 26.780 29.059 -2.279 18000 2462 1 11 . 1 1 31 31 GLY H H 230 8.350 8.350 8.522 -0.172 18000 2463 1 11 . 1 1 32 32 THR N N 231 124.790 124.790 112.942 11.848 18000 2464 1 11 . 1 1 32 32 THR HA H 231 4.280 4.280 4.528 -0.248 18000 2465 1 11 . 1 1 32 32 THR C C 231 173.260 173.260 175.631 -2.371 18000 2466 1 11 . 1 1 32 32 THR CA C 231 60.030 60.030 62.873 -2.843 18000 2467 1 11 . 1 1 32 32 THR CB C 231 68.540 68.540 70.590 -2.050 18000 2468 1 11 . 1 1 32 32 THR H H 231 7.040 7.040 7.671 -0.631 18000 2469 1 11 . 1 1 33 33 GLN N N 232 114.740 114.740 118.949 -4.209 18000 2470 1 11 . 1 1 33 33 GLN HA H 232 5.090 5.090 4.417 0.673 18000 2471 1 11 . 1 1 33 33 GLN C C 232 175.790 175.790 174.333 1.457 18000 2472 1 11 . 1 1 33 33 GLN CA C 232 53.650 53.650 55.934 -2.284 18000 2473 1 11 . 1 1 33 33 GLN CB C 232 30.520 30.520 29.245 1.275 18000 2474 1 11 . 1 1 33 33 GLN H H 232 8.110 8.110 8.272 -0.162 18000 2475 1 11 . 1 1 34 34 LEU N N 233 112.480 112.480 129.521 -17.041 18000 2476 1 11 . 1 1 34 34 LEU HA H 233 4.460 4.460 4.319 0.141 18000 2477 1 11 . 1 1 34 34 LEU C C 233 172.610 172.610 176.691 -4.081 18000 2478 1 11 . 1 1 34 34 LEU CA C 233 52.460 52.460 53.978 -1.518 18000 2479 1 11 . 1 1 34 34 LEU CB C 233 39.140 39.140 40.770 -1.630 18000 2480 1 11 . 1 1 34 34 LEU H H 233 6.980 6.980 8.701 -1.721 18000 2481 1 11 . 1 1 35 35 LEU N N 234 115.860 115.860 125.075 -9.215 18000 2482 1 11 . 1 1 35 35 LEU HA H 234 4.510 4.510 4.513 -0.003 18000 2483 1 11 . 1 1 35 35 LEU C C 234 178.330 178.330 177.069 1.261 18000 2484 1 11 . 1 1 35 35 LEU CA C 234 51.900 51.900 53.666 -1.766 18000 2485 1 11 . 1 1 35 35 LEU CB C 234 40.950 40.950 43.252 -2.302 18000 2486 1 11 . 1 1 35 35 LEU H H 234 7.560 7.560 7.967 -0.407 18000 2487 1 11 . 1 1 36 36 TYR N N 235 125.850 125.850 122.460 3.390 18000 2488 1 11 . 1 1 36 36 TYR HA H 235 4.790 4.790 4.418 0.372 18000 2489 1 11 . 1 1 36 36 TYR C C 235 176.260 176.260 175.077 1.183 18000 2490 1 11 . 1 1 36 36 TYR CA C 235 57.750 57.750 58.518 -0.768 18000 2491 1 11 . 1 1 36 36 TYR CB C 235 37.100 37.100 38.445 -1.345 18000 2492 1 11 . 1 1 36 36 TYR H H 235 9.750 9.750 8.303 1.447 18000 2493 1 11 . 1 1 37 37 LYS N N 236 123.880 123.880 126.986 -3.106 18000 2494 1 11 . 1 1 37 37 LYS HA H 236 3.930 3.930 4.611 -0.681 18000 2495 1 11 . 1 1 37 37 LYS C C 236 178.280 178.280 175.327 2.953 18000 2496 1 11 . 1 1 37 37 LYS CA C 236 59.210 59.210 56.144 3.066 18000 2497 1 11 . 1 1 37 37 LYS CB C 236 30.430 30.430 34.088 -3.658 18000 2498 1 11 . 1 1 37 37 LYS H H 236 9.340 9.340 8.500 0.840 18000 2499 1 11 . 1 1 38 38 PHE N N 237 117.150 117.150 123.424 -6.274 18000 2500 1 11 . 1 1 38 38 PHE HA H 237 4.460 4.460 4.815 -0.355 18000 2501 1 11 . 1 1 38 38 PHE C C 237 173.930 173.930 174.280 -0.350 18000 2502 1 11 . 1 1 38 38 PHE CA C 237 58.510 58.510 55.326 3.184 18000 2503 1 11 . 1 1 38 38 PHE CB C 237 38.370 38.370 39.383 -1.013 18000 2504 1 11 . 1 1 38 38 PHE H H 237 9.120 9.120 8.386 0.734 18000 2505 1 11 . 1 1 39 39 GLU HA H 238 4.160 4.160 4.371 -0.211 18000 2506 1 11 . 1 1 39 39 GLU C C 238 175.650 175.650 175.842 -0.192 18000 2507 1 11 . 1 1 39 39 GLU CA C 238 55.070 55.070 56.356 -1.286 18000 2508 1 11 . 1 1 39 39 GLU CB C 238 31.540 31.540 28.574 2.966 18000 2509 1 11 . 1 1 40 40 ARG N N 239 120.330 120.330 123.856 -3.526 18000 2510 1 11 . 1 1 40 40 ARG HA H 239 4.250 4.250 4.209 0.041 18000 2511 1 11 . 1 1 40 40 ARG C C 239 174.490 174.490 176.081 -1.591 18000 2512 1 11 . 1 1 40 40 ARG CA C 239 60.410 60.410 55.945 4.465 18000 2513 1 11 . 1 1 40 40 ARG H H 239 7.980 7.980 8.080 -0.100 18000 2514 1 11 . 1 1 41 41 PRO N N 240 115.390 115.390 114.760 0.630 18000 2515 1 11 . 1 1 41 41 PRO HA H 240 4.360 4.360 4.671 -0.311 18000 2516 1 11 . 1 1 41 41 PRO C C 240 176.330 176.330 178.030 -1.700 18000 2517 1 11 . 1 1 41 41 PRO CA C 240 64.400 64.400 63.714 0.686 18000 2518 1 11 . 1 1 41 41 PRO CB C 240 62.240 62.240 63.886 -1.646 18000 2519 1 11 . 1 1 41 41 PRO H H 240 8.090 8.090 8.306 -0.216 18000 2520 1 12 . 1 1 2 2 ARG N N 201 119.330 119.330 124.664 -5.334 18000 2521 1 12 . 1 1 2 2 ARG HA H 201 3.560 3.560 4.500 -0.940 18000 2522 1 12 . 1 1 2 2 ARG C C 201 176.850 176.850 175.431 1.419 18000 2523 1 12 . 1 1 2 2 ARG CA C 201 55.340 55.340 55.922 -0.582 18000 2524 1 12 . 1 1 2 2 ARG CB C 201 27.020 27.020 30.979 -3.959 18000 2525 1 12 . 1 1 2 2 ARG H H 201 8.370 8.370 8.135 0.235 18000 2526 1 12 . 1 1 3 3 LYS N N 202 118.540 118.540 127.319 -8.779 18000 2527 1 12 . 1 1 3 3 LYS HA H 202 4.010 4.010 4.360 -0.350 18000 2528 1 12 . 1 1 3 3 LYS C C 202 176.090 176.090 175.061 1.029 18000 2529 1 12 . 1 1 3 3 LYS CA C 202 56.960 56.960 55.542 1.418 18000 2530 1 12 . 1 1 3 3 LYS CB C 202 30.590 30.590 33.752 -3.162 18000 2531 1 12 . 1 1 3 3 LYS H H 202 7.940 7.940 7.994 -0.054 18000 2532 1 12 . 1 1 4 4 SER N N 203 113.880 113.880 124.573 -10.693 18000 2533 1 12 . 1 1 4 4 SER HA H 203 4.320 4.320 4.667 -0.347 18000 2534 1 12 . 1 1 4 4 SER C C 203 172.900 172.900 172.919 -0.019 18000 2535 1 12 . 1 1 4 4 SER CA C 203 57.870 57.870 55.767 2.103 18000 2536 1 12 . 1 1 4 4 SER CB C 203 61.700 61.700 62.517 -0.817 18000 2537 1 12 . 1 1 4 4 SER H H 203 7.700 7.700 8.297 -0.597 18000 2538 1 12 . 1 1 5 5 ARG HA H 204 4.240 4.240 4.377 -0.137 18000 2539 1 12 . 1 1 5 5 ARG C C 204 174.810 174.810 175.056 -0.246 18000 2540 1 12 . 1 1 5 5 ARG CA C 204 54.270 54.270 55.544 -1.274 18000 2541 1 12 . 1 1 5 5 ARG CB C 204 28.700 28.700 30.748 -2.049 18000 2542 1 12 . 1 1 6 6 GLY N N 205 125.950 125.950 106.886 19.064 18000 2543 1 12 . 1 1 6 6 GLY HA H 205 4.400 4.400 4.473 -0.073 18000 2544 1 12 . 1 1 6 6 GLY C C 205 171.910 171.910 174.296 -2.386 18000 2545 1 12 . 1 1 6 6 GLY CA C 205 43.570 43.570 44.441 -0.871 18000 2546 1 12 . 1 1 6 6 GLY CB C 205 28.340 28.340 29.488 -1.148 18000 2547 1 12 . 1 1 6 6 GLY H H 205 7.930 7.930 8.276 -0.346 18000 2548 1 12 . 1 1 7 7 ASN N N 206 118.380 118.380 120.174 -1.794 18000 2549 1 12 . 1 1 7 7 ASN HA H 206 4.760 4.760 4.822 -0.062 18000 2550 1 12 . 1 1 7 7 ASN C C 206 173.810 173.810 177.641 -3.831 18000 2551 1 12 . 1 1 7 7 ASN CA C 206 51.430 51.430 54.035 -2.604 18000 2552 1 12 . 1 1 7 7 ASN CB C 206 37.090 37.090 38.111 -1.020 18000 2553 1 12 . 1 1 7 7 ASN H H 206 8.330 8.330 8.942 -0.612 18000 2554 1 12 . 1 1 8 8 THR N N 207 119.850 119.850 121.418 -1.568 18000 2555 1 12 . 1 1 8 8 THR HA H 207 4.270 4.270 4.114 0.156 18000 2556 1 12 . 1 1 8 8 THR C C 207 172.560 172.560 176.716 -4.156 18000 2557 1 12 . 1 1 8 8 THR CA C 207 60.420 60.420 65.209 -4.789 18000 2558 1 12 . 1 1 8 8 THR CB C 207 67.750 67.750 68.293 -0.543 18000 2559 1 12 . 1 1 8 8 THR H H 207 7.830 7.830 8.603 -0.773 18000 2560 1 12 . 1 1 9 9 ASP N N 208 121.180 121.180 118.620 2.560 18000 2561 1 12 . 1 1 9 9 ASP HA H 208 4.550 4.550 4.855 -0.305 18000 2562 1 12 . 1 1 9 9 ASP C C 208 174.170 174.170 176.808 -2.638 18000 2563 1 12 . 1 1 9 9 ASP CA C 208 52.670 52.670 58.102 -5.432 18000 2564 1 12 . 1 1 9 9 ASP CB C 208 39.120 39.120 37.940 1.180 18000 2565 1 12 . 1 1 9 9 ASP H H 208 8.350 8.350 8.130 0.220 18000 2566 1 12 . 1 1 10 10 ASN HA H 209 4.600 4.600 4.482 0.118 18000 2567 1 12 . 1 1 10 10 ASN C C 209 173.670 173.670 177.531 -3.861 18000 2568 1 12 . 1 1 10 10 ASN CA C 209 52.110 52.110 56.162 -4.052 18000 2569 1 12 . 1 1 10 10 ASN CB C 209 36.730 36.730 37.988 -1.258 18000 2570 1 12 . 1 1 11 11 LYS N N 210 120.380 120.380 117.444 2.936 18000 2571 1 12 . 1 1 11 11 LYS HA H 210 4.270 4.270 4.010 0.260 18000 2572 1 12 . 1 1 11 11 LYS C C 210 174.910 174.910 178.773 -3.863 18000 2573 1 12 . 1 1 11 11 LYS CA C 210 54.900 54.900 60.490 -5.590 18000 2574 1 12 . 1 1 11 11 LYS CB C 210 30.670 30.670 32.255 -1.585 18000 2575 1 12 . 1 1 11 11 LYS H H 210 8.210 8.210 8.345 -0.135 18000 2576 1 12 . 1 1 12 12 GLU N N 211 120.740 120.740 120.732 0.008 18000 2577 1 12 . 1 1 12 12 GLU HA H 211 4.070 4.070 4.015 0.055 18000 2578 1 12 . 1 1 12 12 GLU C C 211 174.810 174.810 179.399 -4.589 18000 2579 1 12 . 1 1 12 12 GLU CA C 211 55.940 55.940 59.909 -3.969 18000 2580 1 12 . 1 1 12 12 GLU CB C 211 27.700 27.700 29.544 -1.844 18000 2581 1 12 . 1 1 12 12 GLU H H 211 8.380 8.380 8.509 -0.129 18000 2582 1 12 . 1 1 13 13 TYR N N 212 119.430 119.430 119.037 0.393 18000 2583 1 12 . 1 1 13 13 TYR HA H 212 4.380 4.380 4.211 0.169 18000 2584 1 12 . 1 1 13 13 TYR C C 212 174.830 174.830 178.317 -3.487 18000 2585 1 12 . 1 1 13 13 TYR CA C 212 57.420 57.420 60.996 -3.576 18000 2586 1 12 . 1 1 13 13 TYR CB C 212 36.530 36.530 38.019 -1.489 18000 2587 1 12 . 1 1 13 13 TYR H H 212 7.940 7.940 8.601 -0.661 18000 2588 1 12 . 1 1 14 14 ALA N N 213 121.810 121.810 120.604 1.206 18000 2589 1 12 . 1 1 14 14 ALA HA H 213 4.260 4.260 3.997 0.263 18000 2590 1 12 . 1 1 14 14 ALA C C 213 176.630 176.630 179.607 -2.977 18000 2591 1 12 . 1 1 14 14 ALA CA C 213 51.990 51.990 55.348 -3.358 18000 2592 1 12 . 1 1 14 14 ALA CB C 213 16.450 16.450 18.771 -2.321 18000 2593 1 12 . 1 1 14 14 ALA H H 213 7.920 7.920 8.035 -0.115 18000 2594 1 12 . 1 1 15 15 VAL N N 214 121.430 121.430 118.747 2.683 18000 2595 1 12 . 1 1 15 15 VAL HA H 214 3.470 3.470 3.571 -0.101 18000 2596 1 12 . 1 1 15 15 VAL C C 214 174.980 174.980 177.771 -2.791 18000 2597 1 12 . 1 1 15 15 VAL CA C 214 64.190 64.190 66.275 -2.085 18000 2598 1 12 . 1 1 15 15 VAL CB C 214 29.820 29.820 31.265 -1.445 18000 2599 1 12 . 1 1 15 15 VAL H H 214 8.680 8.680 8.619 0.061 18000 2600 1 12 . 1 1 16 16 ASN N N 215 117.460 117.460 118.336 -0.876 18000 2601 1 12 . 1 1 16 16 ASN HA H 215 4.300 4.300 4.427 -0.127 18000 2602 1 12 . 1 1 16 16 ASN C C 215 176.320 176.320 177.198 -0.878 18000 2603 1 12 . 1 1 16 16 ASN CA C 215 54.190 54.190 55.959 -1.768 18000 2604 1 12 . 1 1 16 16 ASN CB C 215 35.360 35.360 37.582 -2.222 18000 2605 1 12 . 1 1 16 16 ASN H H 215 8.190 8.190 8.503 -0.313 18000 2606 1 12 . 1 1 17 17 GLU N N 216 119.430 119.430 117.532 1.898 18000 2607 1 12 . 1 1 17 17 GLU HA H 216 4.000 4.000 4.111 -0.111 18000 2608 1 12 . 1 1 17 17 GLU C C 216 177.240 177.240 178.425 -1.185 18000 2609 1 12 . 1 1 17 17 GLU CA C 216 57.180 57.180 58.984 -1.804 18000 2610 1 12 . 1 1 17 17 GLU CB C 216 28.400 28.400 29.097 -0.697 18000 2611 1 12 . 1 1 17 17 GLU H H 216 7.730 7.730 8.065 -0.335 18000 2612 1 12 . 1 1 18 18 VAL N N 217 120.690 120.690 118.210 2.480 18000 2613 1 12 . 1 1 18 18 VAL HA H 217 3.530 3.530 3.871 -0.341 18000 2614 1 12 . 1 1 18 18 VAL C C 217 174.990 174.990 177.965 -2.975 18000 2615 1 12 . 1 1 18 18 VAL CA C 217 64.310 64.310 64.866 -0.556 18000 2616 1 12 . 1 1 18 18 VAL CB C 217 29.640 29.640 31.290 -1.649 18000 2617 1 12 . 1 1 18 18 VAL H H 217 7.820 7.820 7.863 -0.043 18000 2618 1 12 . 1 1 19 19 VAL N N 218 117.010 117.010 116.094 0.916 18000 2619 1 12 . 1 1 19 19 VAL HA H 218 3.500 3.500 3.839 -0.339 18000 2620 1 12 . 1 1 19 19 VAL C C 218 175.200 175.200 177.829 -2.629 18000 2621 1 12 . 1 1 19 19 VAL CA C 218 64.960 64.960 65.627 -0.667 18000 2622 1 12 . 1 1 19 19 VAL CB C 218 29.710 29.710 32.371 -2.661 18000 2623 1 12 . 1 1 19 19 VAL H H 218 8.260 8.260 7.627 0.633 18000 2624 1 12 . 1 1 20 20 ALA N N 219 120.360 120.360 118.577 1.783 18000 2625 1 12 . 1 1 20 20 ALA HA H 219 3.930 3.930 4.187 -0.257 18000 2626 1 12 . 1 1 20 20 ALA C C 219 178.310 178.310 178.249 0.061 18000 2627 1 12 . 1 1 20 20 ALA CA C 219 53.040 53.040 52.547 0.493 18000 2628 1 12 . 1 1 20 20 ALA CB C 219 16.280 16.280 19.161 -2.881 18000 2629 1 12 . 1 1 20 20 ALA H H 219 7.490 7.490 7.268 0.222 18000 2630 1 12 . 1 1 21 21 GLY N N 220 124.250 124.250 109.488 14.762 18000 2631 1 12 . 1 1 21 21 GLY HA H 220 4.250 4.250 4.190 0.060 18000 2632 1 12 . 1 1 21 21 GLY C C 220 172.880 172.880 174.769 -1.889 18000 2633 1 12 . 1 1 21 21 GLY CA C 220 44.130 44.130 44.768 -0.638 18000 2634 1 12 . 1 1 21 21 GLY CB C 220 29.290 29.290 29.206 0.084 18000 2635 1 12 . 1 1 21 21 GLY H H 220 7.640 7.640 7.499 0.141 18000 2636 1 12 . 1 1 22 22 ILE N N 221 119.940 119.940 125.496 -5.556 18000 2637 1 12 . 1 1 22 22 ILE HA H 221 3.290 3.290 4.301 -1.011 18000 2638 1 12 . 1 1 22 22 ILE C C 221 175.100 175.100 174.481 0.619 18000 2639 1 12 . 1 1 22 22 ILE CA C 221 64.070 64.070 59.454 4.616 18000 2640 1 12 . 1 1 22 22 ILE CB C 221 35.260 35.260 37.913 -2.653 18000 2641 1 12 . 1 1 22 22 ILE H H 221 8.130 8.130 8.097 0.033 18000 2642 1 12 . 1 1 23 23 LYS HA H 222 3.430 3.430 4.361 -0.931 18000 2643 1 12 . 1 1 23 23 LYS C C 222 175.280 175.280 175.667 -0.387 18000 2644 1 12 . 1 1 23 23 LYS CA C 222 59.270 59.270 56.745 2.526 18000 2645 1 12 . 1 1 23 23 LYS CB C 222 30.670 30.670 31.911 -1.241 18000 2646 1 12 . 1 1 24 24 GLU N N 223 116.150 116.150 120.346 -4.196 18000 2647 1 12 . 1 1 24 24 GLU HA H 223 4.150 4.150 4.243 -0.093 18000 2648 1 12 . 1 1 24 24 GLU C C 223 177.330 177.330 176.407 0.923 18000 2649 1 12 . 1 1 24 24 GLU CA C 223 57.180 57.180 56.044 1.136 18000 2650 1 12 . 1 1 24 24 GLU CB C 223 27.670 27.670 30.286 -2.616 18000 2651 1 12 . 1 1 24 24 GLU H H 223 7.830 7.830 8.390 -0.560 18000 2652 1 12 . 1 1 25 25 TYR N N 224 119.760 119.760 119.869 -0.109 18000 2653 1 12 . 1 1 25 25 TYR HA H 224 4.480 4.480 4.341 0.139 18000 2654 1 12 . 1 1 25 25 TYR C C 224 175.680 175.680 173.850 1.830 18000 2655 1 12 . 1 1 25 25 TYR CA C 224 57.520 57.520 58.200 -0.680 18000 2656 1 12 . 1 1 25 25 TYR CB C 224 36.940 36.940 38.975 -2.035 18000 2657 1 12 . 1 1 25 25 TYR H H 224 8.630 8.630 7.966 0.664 18000 2658 1 12 . 1 1 26 26 PHE N N 225 120.090 120.090 124.146 -4.056 18000 2659 1 12 . 1 1 26 26 PHE HA H 225 3.410 3.410 4.418 -1.008 18000 2660 1 12 . 1 1 26 26 PHE C C 225 173.930 173.930 174.910 -0.980 18000 2661 1 12 . 1 1 26 26 PHE CA C 225 61.600 61.600 59.016 2.584 18000 2662 1 12 . 1 1 26 26 PHE CB C 225 36.590 36.590 38.962 -2.373 18000 2663 1 12 . 1 1 26 26 PHE H H 225 9.220 9.220 8.621 0.599 18000 2664 1 12 . 1 1 27 27 ASN N N 226 115.010 115.010 123.863 -8.853 18000 2665 1 12 . 1 1 27 27 ASN HA H 226 4.470 4.470 4.693 -0.223 18000 2666 1 12 . 1 1 27 27 ASN C C 226 176.630 176.630 173.807 2.823 18000 2667 1 12 . 1 1 27 27 ASN CA C 226 54.160 54.160 51.492 2.668 18000 2668 1 12 . 1 1 27 27 ASN CB C 226 35.800 35.800 41.759 -5.959 18000 2669 1 12 . 1 1 27 27 ASN H H 226 8.210 8.210 8.334 -0.124 18000 2670 1 12 . 1 1 28 28 VAL N N 227 115.120 115.120 122.224 -7.104 18000 2671 1 12 . 1 1 28 28 VAL HA H 227 4.300 4.300 4.397 -0.097 18000 2672 1 12 . 1 1 28 28 VAL C C 227 174.960 174.960 173.943 1.017 18000 2673 1 12 . 1 1 28 28 VAL CA C 227 61.320 61.320 59.576 1.744 18000 2674 1 12 . 1 1 28 28 VAL CB C 227 30.670 30.670 32.079 -1.409 18000 2675 1 12 . 1 1 28 28 VAL H H 227 7.430 7.430 8.062 -0.632 18000 2676 1 12 . 1 1 29 29 MET HA H 228 4.000 4.000 4.362 -0.362 18000 2677 1 12 . 1 1 29 29 MET C C 228 176.270 176.270 175.914 0.356 18000 2678 1 12 . 1 1 29 29 MET CA C 228 54.030 54.030 55.345 -1.315 18000 2679 1 12 . 1 1 29 29 MET CB C 228 31.510 31.510 33.261 -1.751 18000 2680 1 12 . 1 1 30 30 LEU N N 229 122.180 122.180 122.020 0.160 18000 2681 1 12 . 1 1 30 30 LEU HA H 229 3.150 3.150 4.010 -0.860 18000 2682 1 12 . 1 1 30 30 LEU C C 229 176.070 176.070 177.289 -1.219 18000 2683 1 12 . 1 1 30 30 LEU CA C 229 55.860 55.860 57.426 -1.566 18000 2684 1 12 . 1 1 30 30 LEU CB C 229 36.340 36.340 42.086 -5.746 18000 2685 1 12 . 1 1 30 30 LEU H H 229 7.890 7.890 8.407 -0.517 18000 2686 1 12 . 1 1 31 31 GLY N N 230 118.390 118.390 105.720 12.670 18000 2687 1 12 . 1 1 31 31 GLY HA H 230 4.090 4.090 4.151 -0.061 18000 2688 1 12 . 1 1 31 31 GLY C C 230 173.070 173.070 174.920 -1.850 18000 2689 1 12 . 1 1 31 31 GLY CA C 230 43.150 43.150 46.383 -3.232 18000 2690 1 12 . 1 1 31 31 GLY CB C 230 26.780 26.780 29.026 -2.246 18000 2691 1 12 . 1 1 31 31 GLY H H 230 8.350 8.350 8.440 -0.090 18000 2692 1 12 . 1 1 32 32 THR N N 231 124.790 124.790 112.873 11.917 18000 2693 1 12 . 1 1 32 32 THR HA H 231 4.280 4.280 4.472 -0.192 18000 2694 1 12 . 1 1 32 32 THR C C 231 173.260 173.260 176.179 -2.919 18000 2695 1 12 . 1 1 32 32 THR CA C 231 60.030 60.030 63.935 -3.905 18000 2696 1 12 . 1 1 32 32 THR CB C 231 68.540 68.540 70.394 -1.853 18000 2697 1 12 . 1 1 32 32 THR H H 231 7.040 7.040 7.618 -0.578 18000 2698 1 12 . 1 1 33 33 GLN N N 232 114.740 114.740 117.161 -2.421 18000 2699 1 12 . 1 1 33 33 GLN HA H 232 5.090 5.090 4.321 0.769 18000 2700 1 12 . 1 1 33 33 GLN C C 232 175.790 175.790 175.240 0.550 18000 2701 1 12 . 1 1 33 33 GLN CA C 232 53.650 53.650 56.512 -2.862 18000 2702 1 12 . 1 1 33 33 GLN CB C 232 30.520 30.520 30.700 -0.180 18000 2703 1 12 . 1 1 33 33 GLN H H 232 8.110 8.110 8.373 -0.263 18000 2704 1 12 . 1 1 34 34 LEU N N 233 112.480 112.480 124.627 -12.147 18000 2705 1 12 . 1 1 34 34 LEU HA H 233 4.460 4.460 4.036 0.424 18000 2706 1 12 . 1 1 34 34 LEU C C 233 172.610 172.610 177.166 -4.556 18000 2707 1 12 . 1 1 34 34 LEU CA C 233 52.460 52.460 55.518 -3.058 18000 2708 1 12 . 1 1 34 34 LEU CB C 233 39.140 39.140 41.228 -2.088 18000 2709 1 12 . 1 1 34 34 LEU H H 233 6.980 6.980 8.210 -1.230 18000 2710 1 12 . 1 1 35 35 LEU N N 234 115.860 115.860 124.107 -8.247 18000 2711 1 12 . 1 1 35 35 LEU HA H 234 4.510 4.510 4.520 -0.010 18000 2712 1 12 . 1 1 35 35 LEU C C 234 178.330 178.330 177.041 1.289 18000 2713 1 12 . 1 1 35 35 LEU CA C 234 51.900 51.900 55.498 -3.598 18000 2714 1 12 . 1 1 35 35 LEU CB C 234 40.950 40.950 42.007 -1.057 18000 2715 1 12 . 1 1 35 35 LEU H H 234 7.560 7.560 8.103 -0.543 18000 2716 1 12 . 1 1 36 36 TYR N N 235 125.850 125.850 118.473 7.377 18000 2717 1 12 . 1 1 36 36 TYR HA H 235 4.790 4.790 4.567 0.223 18000 2718 1 12 . 1 1 36 36 TYR C C 235 176.260 176.260 175.004 1.256 18000 2719 1 12 . 1 1 36 36 TYR CA C 235 57.750 57.750 57.800 -0.050 18000 2720 1 12 . 1 1 36 36 TYR CB C 235 37.100 37.100 38.893 -1.793 18000 2721 1 12 . 1 1 36 36 TYR H H 235 9.750 9.750 7.668 2.082 18000 2722 1 12 . 1 1 37 37 LYS N N 236 123.880 123.880 122.553 1.327 18000 2723 1 12 . 1 1 37 37 LYS HA H 236 3.930 3.930 4.609 -0.679 18000 2724 1 12 . 1 1 37 37 LYS C C 236 178.280 178.280 175.523 2.757 18000 2725 1 12 . 1 1 37 37 LYS CA C 236 59.210 59.210 55.460 3.750 18000 2726 1 12 . 1 1 37 37 LYS CB C 236 30.430 30.430 34.040 -3.610 18000 2727 1 12 . 1 1 37 37 LYS H H 236 9.340 9.340 7.639 1.701 18000 2728 1 12 . 1 1 38 38 PHE N N 237 117.150 117.150 123.217 -6.067 18000 2729 1 12 . 1 1 38 38 PHE HA H 237 4.460 4.460 4.678 -0.218 18000 2730 1 12 . 1 1 38 38 PHE C C 237 173.930 173.930 174.804 -0.874 18000 2731 1 12 . 1 1 38 38 PHE CA C 237 58.510 58.510 56.691 1.819 18000 2732 1 12 . 1 1 38 38 PHE CB C 237 38.370 38.370 38.777 -0.407 18000 2733 1 12 . 1 1 38 38 PHE H H 237 9.120 9.120 8.602 0.518 18000 2734 1 12 . 1 1 39 39 GLU HA H 238 4.160 4.160 4.524 -0.364 18000 2735 1 12 . 1 1 39 39 GLU C C 238 175.650 175.650 176.058 -0.408 18000 2736 1 12 . 1 1 39 39 GLU CA C 238 55.070 55.070 55.928 -0.859 18000 2737 1 12 . 1 1 39 39 GLU CB C 238 31.540 31.540 29.399 2.141 18000 2738 1 12 . 1 1 40 40 ARG N N 239 120.330 120.330 125.145 -4.815 18000 2739 1 12 . 1 1 40 40 ARG HA H 239 4.250 4.250 4.057 0.193 18000 2740 1 12 . 1 1 40 40 ARG C C 239 174.490 174.490 175.451 -0.961 18000 2741 1 12 . 1 1 40 40 ARG CA C 239 60.410 60.410 55.545 4.865 18000 2742 1 12 . 1 1 40 40 ARG H H 239 7.980 7.980 8.202 -0.222 18000 2743 1 12 . 1 1 41 41 PRO N N 240 115.390 115.390 115.563 -0.173 18000 2744 1 12 . 1 1 41 41 PRO HA H 240 4.360 4.360 4.488 -0.128 18000 2745 1 12 . 1 1 41 41 PRO C C 240 176.330 176.330 177.900 -1.570 18000 2746 1 12 . 1 1 41 41 PRO CA C 240 64.400 64.400 64.508 -0.108 18000 2747 1 12 . 1 1 41 41 PRO CB C 240 62.240 62.240 63.298 -1.058 18000 2748 1 12 . 1 1 41 41 PRO H H 240 8.090 8.090 8.935 -0.845 18000 2749 1 13 . 1 1 2 2 ARG N N 201 119.330 119.330 121.757 -2.427 18000 2750 1 13 . 1 1 2 2 ARG HA H 201 3.560 3.560 4.247 -0.687 18000 2751 1 13 . 1 1 2 2 ARG C C 201 176.850 176.850 176.264 0.586 18000 2752 1 13 . 1 1 2 2 ARG CA C 201 55.340 55.340 57.321 -1.981 18000 2753 1 13 . 1 1 2 2 ARG CB C 201 27.020 27.020 31.236 -4.216 18000 2754 1 13 . 1 1 2 2 ARG H H 201 8.370 8.370 8.011 0.359 18000 2755 1 13 . 1 1 3 3 LYS N N 202 118.540 118.540 121.559 -3.019 18000 2756 1 13 . 1 1 3 3 LYS HA H 202 4.010 4.010 4.208 -0.198 18000 2757 1 13 . 1 1 3 3 LYS C C 202 176.090 176.090 176.772 -0.682 18000 2758 1 13 . 1 1 3 3 LYS CA C 202 56.960 56.960 56.704 0.256 18000 2759 1 13 . 1 1 3 3 LYS CB C 202 30.590 30.590 32.455 -1.865 18000 2760 1 13 . 1 1 3 3 LYS H H 202 7.940 7.940 8.138 -0.198 18000 2761 1 13 . 1 1 4 4 SER N N 203 113.880 113.880 122.769 -8.889 18000 2762 1 13 . 1 1 4 4 SER HA H 203 4.320 4.320 4.469 -0.149 18000 2763 1 13 . 1 1 4 4 SER C C 203 172.900 172.900 173.901 -1.001 18000 2764 1 13 . 1 1 4 4 SER CA C 203 57.870 57.870 56.758 1.113 18000 2765 1 13 . 1 1 4 4 SER CB C 203 61.700 61.700 62.251 -0.551 18000 2766 1 13 . 1 1 4 4 SER H H 203 7.700 7.700 8.344 -0.644 18000 2767 1 13 . 1 1 5 5 ARG HA H 204 4.240 4.240 4.153 0.087 18000 2768 1 13 . 1 1 5 5 ARG C C 204 174.810 174.810 174.939 -0.129 18000 2769 1 13 . 1 1 5 5 ARG CA C 204 54.270 54.270 56.851 -2.581 18000 2770 1 13 . 1 1 5 5 ARG CB C 204 28.700 28.700 30.678 -1.978 18000 2771 1 13 . 1 1 6 6 GLY N N 205 125.950 125.950 104.467 21.483 18000 2772 1 13 . 1 1 6 6 GLY HA H 205 4.400 4.400 4.208 0.192 18000 2773 1 13 . 1 1 6 6 GLY C C 205 171.910 171.910 174.093 -2.183 18000 2774 1 13 . 1 1 6 6 GLY CA C 205 43.570 43.570 45.285 -1.714 18000 2775 1 13 . 1 1 6 6 GLY CB C 205 28.340 28.340 29.630 -1.290 18000 2776 1 13 . 1 1 6 6 GLY H H 205 7.930 7.930 7.635 0.295 18000 2777 1 13 . 1 1 7 7 ASN N N 206 118.380 118.380 121.910 -3.530 18000 2778 1 13 . 1 1 7 7 ASN HA H 206 4.760 4.760 4.772 -0.012 18000 2779 1 13 . 1 1 7 7 ASN C C 206 173.810 173.810 177.453 -3.643 18000 2780 1 13 . 1 1 7 7 ASN CA C 206 51.430 51.430 54.995 -3.565 18000 2781 1 13 . 1 1 7 7 ASN CB C 206 37.090 37.090 37.926 -0.836 18000 2782 1 13 . 1 1 7 7 ASN H H 206 8.330 8.330 8.702 -0.372 18000 2783 1 13 . 1 1 8 8 THR N N 207 119.850 119.850 120.542 -0.692 18000 2784 1 13 . 1 1 8 8 THR HA H 207 4.270 4.270 4.127 0.143 18000 2785 1 13 . 1 1 8 8 THR C C 207 172.560 172.560 176.546 -3.986 18000 2786 1 13 . 1 1 8 8 THR CA C 207 60.420 60.420 65.310 -4.890 18000 2787 1 13 . 1 1 8 8 THR CB C 207 67.750 67.750 68.299 -0.549 18000 2788 1 13 . 1 1 8 8 THR H H 207 7.830 7.830 8.459 -0.629 18000 2789 1 13 . 1 1 9 9 ASP N N 208 121.180 121.180 118.525 2.655 18000 2790 1 13 . 1 1 9 9 ASP HA H 208 4.550 4.550 4.544 0.006 18000 2791 1 13 . 1 1 9 9 ASP C C 208 174.170 174.170 176.323 -2.153 18000 2792 1 13 . 1 1 9 9 ASP CA C 208 52.670 52.670 58.193 -5.523 18000 2793 1 13 . 1 1 9 9 ASP CB C 208 39.120 39.120 38.089 1.031 18000 2794 1 13 . 1 1 9 9 ASP H H 208 8.350 8.350 8.896 -0.546 18000 2795 1 13 . 1 1 10 10 ASN HA H 209 4.600 4.600 4.482 0.118 18000 2796 1 13 . 1 1 10 10 ASN C C 209 173.670 173.670 177.403 -3.733 18000 2797 1 13 . 1 1 10 10 ASN CA C 209 52.110 52.110 56.105 -3.994 18000 2798 1 13 . 1 1 10 10 ASN CB C 209 36.730 36.730 38.015 -1.285 18000 2799 1 13 . 1 1 11 11 LYS N N 210 120.380 120.380 117.576 2.804 18000 2800 1 13 . 1 1 11 11 LYS HA H 210 4.270 4.270 4.043 0.227 18000 2801 1 13 . 1 1 11 11 LYS C C 210 174.910 174.910 178.876 -3.966 18000 2802 1 13 . 1 1 11 11 LYS CA C 210 54.900 54.900 60.304 -5.404 18000 2803 1 13 . 1 1 11 11 LYS CB C 210 30.670 30.670 32.210 -1.540 18000 2804 1 13 . 1 1 11 11 LYS H H 210 8.210 8.210 8.452 -0.242 18000 2805 1 13 . 1 1 12 12 GLU N N 211 120.740 120.740 120.480 0.260 18000 2806 1 13 . 1 1 12 12 GLU HA H 211 4.070 4.070 4.045 0.025 18000 2807 1 13 . 1 1 12 12 GLU C C 211 174.810 174.810 179.493 -4.683 18000 2808 1 13 . 1 1 12 12 GLU CA C 211 55.940 55.940 59.819 -3.879 18000 2809 1 13 . 1 1 12 12 GLU CB C 211 27.700 27.700 29.093 -1.393 18000 2810 1 13 . 1 1 12 12 GLU H H 211 8.380 8.380 8.766 -0.386 18000 2811 1 13 . 1 1 13 13 TYR N N 212 119.430 119.430 119.148 0.282 18000 2812 1 13 . 1 1 13 13 TYR HA H 212 4.380 4.380 4.246 0.134 18000 2813 1 13 . 1 1 13 13 TYR C C 212 174.830 174.830 178.270 -3.440 18000 2814 1 13 . 1 1 13 13 TYR CA C 212 57.420 57.420 60.848 -3.428 18000 2815 1 13 . 1 1 13 13 TYR CB C 212 36.530 36.530 38.187 -1.657 18000 2816 1 13 . 1 1 13 13 TYR H H 212 7.940 7.940 7.913 0.027 18000 2817 1 13 . 1 1 14 14 ALA N N 213 121.810 121.810 120.517 1.293 18000 2818 1 13 . 1 1 14 14 ALA HA H 213 4.260 4.260 3.933 0.327 18000 2819 1 13 . 1 1 14 14 ALA C C 213 176.630 176.630 179.700 -3.070 18000 2820 1 13 . 1 1 14 14 ALA CA C 213 51.990 51.990 55.540 -3.550 18000 2821 1 13 . 1 1 14 14 ALA CB C 213 16.450 16.450 18.731 -2.281 18000 2822 1 13 . 1 1 14 14 ALA H H 213 7.920 7.920 8.208 -0.288 18000 2823 1 13 . 1 1 15 15 VAL N N 214 121.430 121.430 118.619 2.811 18000 2824 1 13 . 1 1 15 15 VAL HA H 214 3.470 3.470 3.572 -0.102 18000 2825 1 13 . 1 1 15 15 VAL C C 214 174.980 174.980 177.697 -2.717 18000 2826 1 13 . 1 1 15 15 VAL CA C 214 64.190 64.190 66.499 -2.309 18000 2827 1 13 . 1 1 15 15 VAL CB C 214 29.820 29.820 31.401 -1.581 18000 2828 1 13 . 1 1 15 15 VAL H H 214 8.680 8.680 8.685 -0.005 18000 2829 1 13 . 1 1 16 16 ASN N N 215 117.460 117.460 117.928 -0.468 18000 2830 1 13 . 1 1 16 16 ASN HA H 215 4.300 4.300 4.405 -0.105 18000 2831 1 13 . 1 1 16 16 ASN C C 215 176.320 176.320 177.074 -0.754 18000 2832 1 13 . 1 1 16 16 ASN CA C 215 54.190 54.190 55.656 -1.466 18000 2833 1 13 . 1 1 16 16 ASN CB C 215 35.360 35.360 37.644 -2.284 18000 2834 1 13 . 1 1 16 16 ASN H H 215 8.190 8.190 8.075 0.115 18000 2835 1 13 . 1 1 17 17 GLU N N 216 119.430 119.430 117.621 1.809 18000 2836 1 13 . 1 1 17 17 GLU HA H 216 4.000 4.000 4.144 -0.144 18000 2837 1 13 . 1 1 17 17 GLU C C 216 177.240 177.240 177.972 -0.732 18000 2838 1 13 . 1 1 17 17 GLU CA C 216 57.180 57.180 58.910 -1.730 18000 2839 1 13 . 1 1 17 17 GLU CB C 216 28.400 28.400 29.214 -0.814 18000 2840 1 13 . 1 1 17 17 GLU H H 216 7.730 7.730 8.401 -0.671 18000 2841 1 13 . 1 1 18 18 VAL N N 217 120.690 120.690 117.837 2.853 18000 2842 1 13 . 1 1 18 18 VAL HA H 217 3.530 3.530 3.944 -0.414 18000 2843 1 13 . 1 1 18 18 VAL C C 217 174.990 174.990 178.712 -3.722 18000 2844 1 13 . 1 1 18 18 VAL CA C 217 64.310 64.310 64.881 -0.571 18000 2845 1 13 . 1 1 18 18 VAL CB C 217 29.640 29.640 31.210 -1.570 18000 2846 1 13 . 1 1 18 18 VAL H H 217 7.820 7.820 7.756 0.064 18000 2847 1 13 . 1 1 19 19 VAL N N 218 117.010 117.010 115.602 1.408 18000 2848 1 13 . 1 1 19 19 VAL HA H 218 3.500 3.500 3.856 -0.356 18000 2849 1 13 . 1 1 19 19 VAL C C 218 175.200 175.200 176.460 -1.260 18000 2850 1 13 . 1 1 19 19 VAL CA C 218 64.960 64.960 64.349 0.611 18000 2851 1 13 . 1 1 19 19 VAL CB C 218 29.710 29.710 31.236 -1.526 18000 2852 1 13 . 1 1 19 19 VAL H H 218 8.260 8.260 7.932 0.328 18000 2853 1 13 . 1 1 20 20 ALA N N 219 120.360 120.360 117.663 2.697 18000 2854 1 13 . 1 1 20 20 ALA HA H 219 3.930 3.930 4.371 -0.441 18000 2855 1 13 . 1 1 20 20 ALA C C 219 178.310 178.310 177.397 0.913 18000 2856 1 13 . 1 1 20 20 ALA CA C 219 53.040 53.040 51.022 2.018 18000 2857 1 13 . 1 1 20 20 ALA CB C 219 16.280 16.280 18.582 -2.302 18000 2858 1 13 . 1 1 20 20 ALA H H 219 7.490 7.490 7.249 0.241 18000 2859 1 13 . 1 1 21 21 GLY N N 220 124.250 124.250 108.805 15.445 18000 2860 1 13 . 1 1 21 21 GLY HA H 220 4.250 4.250 4.441 -0.191 18000 2861 1 13 . 1 1 21 21 GLY C C 220 172.880 172.880 174.561 -1.681 18000 2862 1 13 . 1 1 21 21 GLY CA C 220 44.130 44.130 43.819 0.311 18000 2863 1 13 . 1 1 21 21 GLY CB C 220 29.290 29.290 29.089 0.201 18000 2864 1 13 . 1 1 21 21 GLY H H 220 7.640 7.640 7.551 0.088 18000 2865 1 13 . 1 1 22 22 ILE N N 221 119.940 119.940 126.209 -6.269 18000 2866 1 13 . 1 1 22 22 ILE HA H 221 3.290 3.290 4.224 -0.934 18000 2867 1 13 . 1 1 22 22 ILE C C 221 175.100 175.100 174.449 0.651 18000 2868 1 13 . 1 1 22 22 ILE CA C 221 64.070 64.070 60.441 3.629 18000 2869 1 13 . 1 1 22 22 ILE CB C 221 35.260 35.260 37.848 -2.588 18000 2870 1 13 . 1 1 22 22 ILE H H 221 8.130 8.130 8.018 0.112 18000 2871 1 13 . 1 1 23 23 LYS HA H 222 3.430 3.430 4.342 -0.912 18000 2872 1 13 . 1 1 23 23 LYS C C 222 175.280 175.280 175.623 -0.343 18000 2873 1 13 . 1 1 23 23 LYS CA C 222 59.270 59.270 56.790 2.480 18000 2874 1 13 . 1 1 23 23 LYS CB C 222 30.670 30.670 32.056 -1.386 18000 2875 1 13 . 1 1 24 24 GLU N N 223 116.150 116.150 122.944 -6.794 18000 2876 1 13 . 1 1 24 24 GLU HA H 223 4.150 4.150 4.237 -0.088 18000 2877 1 13 . 1 1 24 24 GLU C C 223 177.330 177.330 176.047 1.283 18000 2878 1 13 . 1 1 24 24 GLU CA C 223 57.180 57.180 56.780 0.400 18000 2879 1 13 . 1 1 24 24 GLU CB C 223 27.670 27.670 30.516 -2.846 18000 2880 1 13 . 1 1 24 24 GLU H H 223 7.830 7.830 8.627 -0.797 18000 2881 1 13 . 1 1 25 25 TYR N N 224 119.760 119.760 119.626 0.134 18000 2882 1 13 . 1 1 25 25 TYR HA H 224 4.480 4.480 4.606 -0.126 18000 2883 1 13 . 1 1 25 25 TYR C C 224 175.680 175.680 174.152 1.528 18000 2884 1 13 . 1 1 25 25 TYR CA C 224 57.520 57.520 57.948 -0.428 18000 2885 1 13 . 1 1 25 25 TYR CB C 224 36.940 36.940 40.193 -3.253 18000 2886 1 13 . 1 1 25 25 TYR H H 224 8.630 8.630 8.037 0.593 18000 2887 1 13 . 1 1 26 26 PHE N N 225 120.090 120.090 125.940 -5.850 18000 2888 1 13 . 1 1 26 26 PHE HA H 225 3.410 3.410 4.908 -1.498 18000 2889 1 13 . 1 1 26 26 PHE C C 225 173.930 173.930 174.797 -0.867 18000 2890 1 13 . 1 1 26 26 PHE CA C 225 61.600 61.600 58.145 3.455 18000 2891 1 13 . 1 1 26 26 PHE CB C 225 36.590 36.590 39.275 -2.685 18000 2892 1 13 . 1 1 26 26 PHE H H 225 9.220 9.220 8.760 0.460 18000 2893 1 13 . 1 1 27 27 ASN N N 226 115.010 115.010 125.184 -10.174 18000 2894 1 13 . 1 1 27 27 ASN HA H 226 4.470 4.470 4.619 -0.149 18000 2895 1 13 . 1 1 27 27 ASN C C 226 176.630 176.630 173.331 3.299 18000 2896 1 13 . 1 1 27 27 ASN CA C 226 54.160 54.160 51.532 2.628 18000 2897 1 13 . 1 1 27 27 ASN CB C 226 35.800 35.800 39.200 -3.400 18000 2898 1 13 . 1 1 27 27 ASN H H 226 8.210 8.210 8.667 -0.457 18000 2899 1 13 . 1 1 28 28 VAL N N 227 115.120 115.120 115.989 -0.869 18000 2900 1 13 . 1 1 28 28 VAL HA H 227 4.300 4.300 3.191 1.109 18000 2901 1 13 . 1 1 28 28 VAL C C 227 174.960 174.960 173.353 1.607 18000 2902 1 13 . 1 1 28 28 VAL CA C 227 61.320 61.320 62.220 -0.900 18000 2903 1 13 . 1 1 28 28 VAL CB C 227 30.670 30.670 30.625 0.045 18000 2904 1 13 . 1 1 28 28 VAL H H 227 7.430 7.430 6.630 0.800 18000 2905 1 13 . 1 1 29 29 MET HA H 228 4.000 4.000 4.576 -0.576 18000 2906 1 13 . 1 1 29 29 MET C C 228 176.270 176.270 176.078 0.192 18000 2907 1 13 . 1 1 29 29 MET CA C 228 54.030 54.030 54.861 -0.831 18000 2908 1 13 . 1 1 29 29 MET CB C 228 31.510 31.510 33.350 -1.840 18000 2909 1 13 . 1 1 30 30 LEU N N 229 122.180 122.180 122.142 0.038 18000 2910 1 13 . 1 1 30 30 LEU HA H 229 3.150 3.150 4.073 -0.923 18000 2911 1 13 . 1 1 30 30 LEU C C 229 176.070 176.070 177.105 -1.035 18000 2912 1 13 . 1 1 30 30 LEU CA C 229 55.860 55.860 57.239 -1.379 18000 2913 1 13 . 1 1 30 30 LEU CB C 229 36.340 36.340 41.552 -5.212 18000 2914 1 13 . 1 1 30 30 LEU H H 229 7.890 7.890 8.593 -0.703 18000 2915 1 13 . 1 1 31 31 GLY N N 230 118.390 118.390 106.845 11.545 18000 2916 1 13 . 1 1 31 31 GLY HA H 230 4.090 4.090 4.199 -0.109 18000 2917 1 13 . 1 1 31 31 GLY C C 230 173.070 173.070 174.877 -1.807 18000 2918 1 13 . 1 1 31 31 GLY CA C 230 43.150 43.150 46.085 -2.935 18000 2919 1 13 . 1 1 31 31 GLY CB C 230 26.780 26.780 29.483 -2.703 18000 2920 1 13 . 1 1 31 31 GLY H H 230 8.350 8.350 8.323 0.027 18000 2921 1 13 . 1 1 32 32 THR N N 231 124.790 124.790 113.488 11.302 18000 2922 1 13 . 1 1 32 32 THR HA H 231 4.280 4.280 4.532 -0.252 18000 2923 1 13 . 1 1 32 32 THR C C 231 173.260 173.260 176.535 -3.275 18000 2924 1 13 . 1 1 32 32 THR CA C 231 60.030 60.030 63.517 -3.487 18000 2925 1 13 . 1 1 32 32 THR CB C 231 68.540 68.540 69.425 -0.885 18000 2926 1 13 . 1 1 32 32 THR H H 231 7.040 7.040 7.926 -0.886 18000 2927 1 13 . 1 1 33 33 GLN N N 232 114.740 114.740 115.331 -0.591 18000 2928 1 13 . 1 1 33 33 GLN HA H 232 5.090 5.090 4.318 0.772 18000 2929 1 13 . 1 1 33 33 GLN C C 232 175.790 175.790 176.296 -0.506 18000 2930 1 13 . 1 1 33 33 GLN CA C 232 53.650 53.650 55.733 -2.083 18000 2931 1 13 . 1 1 33 33 GLN CB C 232 30.520 30.520 30.785 -0.265 18000 2932 1 13 . 1 1 33 33 GLN H H 232 8.110 8.110 7.988 0.122 18000 2933 1 13 . 1 1 34 34 LEU N N 233 112.480 112.480 124.697 -12.217 18000 2934 1 13 . 1 1 34 34 LEU HA H 233 4.460 4.460 4.074 0.386 18000 2935 1 13 . 1 1 34 34 LEU C C 233 172.610 172.610 176.209 -3.599 18000 2936 1 13 . 1 1 34 34 LEU CA C 233 52.460 52.460 55.553 -3.094 18000 2937 1 13 . 1 1 34 34 LEU CB C 233 39.140 39.140 41.339 -2.199 18000 2938 1 13 . 1 1 34 34 LEU H H 233 6.980 6.980 7.932 -0.952 18000 2939 1 13 . 1 1 35 35 LEU N N 234 115.860 115.860 121.454 -5.594 18000 2940 1 13 . 1 1 35 35 LEU HA H 234 4.510 4.510 4.249 0.261 18000 2941 1 13 . 1 1 35 35 LEU C C 234 178.330 178.330 176.611 1.719 18000 2942 1 13 . 1 1 35 35 LEU CA C 234 51.900 51.900 54.767 -2.867 18000 2943 1 13 . 1 1 35 35 LEU CB C 234 40.950 40.950 40.793 0.157 18000 2944 1 13 . 1 1 35 35 LEU H H 234 7.560 7.560 7.732 -0.172 18000 2945 1 13 . 1 1 36 36 TYR N N 235 125.850 125.850 122.959 2.891 18000 2946 1 13 . 1 1 36 36 TYR HA H 235 4.790 4.790 4.424 0.366 18000 2947 1 13 . 1 1 36 36 TYR C C 235 176.260 176.260 176.297 -0.037 18000 2948 1 13 . 1 1 36 36 TYR CA C 235 57.750 57.750 57.865 -0.115 18000 2949 1 13 . 1 1 36 36 TYR CB C 235 37.100 37.100 38.648 -1.548 18000 2950 1 13 . 1 1 36 36 TYR H H 235 9.750 9.750 7.870 1.880 18000 2951 1 13 . 1 1 37 37 LYS N N 236 123.880 123.880 128.411 -4.531 18000 2952 1 13 . 1 1 37 37 LYS HA H 236 3.930 3.930 4.357 -0.427 18000 2953 1 13 . 1 1 37 37 LYS C C 236 178.280 178.280 175.438 2.842 18000 2954 1 13 . 1 1 37 37 LYS CA C 236 59.210 59.210 55.915 3.295 18000 2955 1 13 . 1 1 37 37 LYS CB C 236 30.430 30.430 31.411 -0.981 18000 2956 1 13 . 1 1 37 37 LYS H H 236 9.340 9.340 8.787 0.553 18000 2957 1 13 . 1 1 38 38 PHE N N 237 117.150 117.150 120.634 -3.484 18000 2958 1 13 . 1 1 38 38 PHE HA H 237 4.460 4.460 4.907 -0.447 18000 2959 1 13 . 1 1 38 38 PHE C C 237 173.930 173.930 173.456 0.474 18000 2960 1 13 . 1 1 38 38 PHE CA C 237 58.510 58.510 54.426 4.084 18000 2961 1 13 . 1 1 38 38 PHE CB C 237 38.370 38.370 40.979 -2.609 18000 2962 1 13 . 1 1 38 38 PHE H H 237 9.120 9.120 7.937 1.183 18000 2963 1 13 . 1 1 39 39 GLU HA H 238 4.160 4.160 4.310 -0.150 18000 2964 1 13 . 1 1 39 39 GLU C C 238 175.650 175.650 176.150 -0.500 18000 2965 1 13 . 1 1 39 39 GLU CA C 238 55.070 55.070 56.563 -1.493 18000 2966 1 13 . 1 1 39 39 GLU CB C 238 31.540 31.540 28.717 2.823 18000 2967 1 13 . 1 1 40 40 ARG N N 239 120.330 120.330 126.748 -6.418 18000 2968 1 13 . 1 1 40 40 ARG HA H 239 4.250 4.250 3.992 0.258 18000 2969 1 13 . 1 1 40 40 ARG C C 239 174.490 174.490 174.469 0.021 18000 2970 1 13 . 1 1 40 40 ARG CA C 239 60.410 60.410 56.161 4.249 18000 2971 1 13 . 1 1 40 40 ARG H H 239 7.980 7.980 8.142 -0.162 18000 2972 1 13 . 1 1 41 41 PRO N N 240 115.390 115.390 116.774 -1.384 18000 2973 1 13 . 1 1 41 41 PRO HA H 240 4.360 4.360 4.819 -0.459 18000 2974 1 13 . 1 1 41 41 PRO C C 240 176.330 176.330 175.704 0.626 18000 2975 1 13 . 1 1 41 41 PRO CA C 240 64.400 64.400 63.289 1.111 18000 2976 1 13 . 1 1 41 41 PRO CB C 240 62.240 62.240 64.412 -2.171 18000 2977 1 13 . 1 1 41 41 PRO H H 240 8.090 8.090 8.339 -0.249 18000 2978 1 14 . 1 1 2 2 ARG N N 201 119.330 119.330 123.398 -4.068 18000 2979 1 14 . 1 1 2 2 ARG HA H 201 3.560 3.560 4.579 -1.019 18000 2980 1 14 . 1 1 2 2 ARG C C 201 176.850 176.850 174.775 2.075 18000 2981 1 14 . 1 1 2 2 ARG CA C 201 55.340 55.340 56.201 -0.861 18000 2982 1 14 . 1 1 2 2 ARG CB C 201 27.020 27.020 32.202 -5.182 18000 2983 1 14 . 1 1 2 2 ARG H H 201 8.370 8.370 8.328 0.042 18000 2984 1 14 . 1 1 3 3 LYS N N 202 118.540 118.540 128.226 -9.686 18000 2985 1 14 . 1 1 3 3 LYS HA H 202 4.010 4.010 4.543 -0.533 18000 2986 1 14 . 1 1 3 3 LYS C C 202 176.090 176.090 175.471 0.619 18000 2987 1 14 . 1 1 3 3 LYS CA C 202 56.960 56.960 56.306 0.653 18000 2988 1 14 . 1 1 3 3 LYS CB C 202 30.590 30.590 33.103 -2.513 18000 2989 1 14 . 1 1 3 3 LYS H H 202 7.940 7.940 8.180 -0.240 18000 2990 1 14 . 1 1 4 4 SER N N 203 113.880 113.880 124.783 -10.903 18000 2991 1 14 . 1 1 4 4 SER HA H 203 4.320 4.320 4.855 -0.535 18000 2992 1 14 . 1 1 4 4 SER C C 203 172.900 172.900 172.795 0.105 18000 2993 1 14 . 1 1 4 4 SER CA C 203 57.870 57.870 56.477 1.393 18000 2994 1 14 . 1 1 4 4 SER CB C 203 61.700 61.700 63.934 -2.234 18000 2995 1 14 . 1 1 4 4 SER H H 203 7.700 7.700 8.676 -0.976 18000 2996 1 14 . 1 1 5 5 ARG HA H 204 4.240 4.240 4.374 -0.134 18000 2997 1 14 . 1 1 5 5 ARG C C 204 174.810 174.810 174.474 0.336 18000 2998 1 14 . 1 1 5 5 ARG CA C 204 54.270 54.270 55.961 -1.691 18000 2999 1 14 . 1 1 5 5 ARG CB C 204 28.700 28.700 31.181 -2.482 18000 3000 1 14 . 1 1 6 6 GLY N N 205 125.950 125.950 110.324 15.626 18000 3001 1 14 . 1 1 6 6 GLY HA H 205 4.400 4.400 4.414 -0.014 18000 3002 1 14 . 1 1 6 6 GLY C C 205 171.910 171.910 173.898 -1.988 18000 3003 1 14 . 1 1 6 6 GLY CA C 205 43.570 43.570 44.618 -1.048 18000 3004 1 14 . 1 1 6 6 GLY CB C 205 28.340 28.340 30.131 -1.791 18000 3005 1 14 . 1 1 6 6 GLY H H 205 7.930 7.930 8.345 -0.415 18000 3006 1 14 . 1 1 7 7 ASN N N 206 118.380 118.380 118.858 -0.478 18000 3007 1 14 . 1 1 7 7 ASN HA H 206 4.760 4.760 4.807 -0.047 18000 3008 1 14 . 1 1 7 7 ASN C C 206 173.810 173.810 177.687 -3.877 18000 3009 1 14 . 1 1 7 7 ASN CA C 206 51.430 51.430 54.380 -2.950 18000 3010 1 14 . 1 1 7 7 ASN CB C 206 37.090 37.090 37.654 -0.564 18000 3011 1 14 . 1 1 7 7 ASN H H 206 8.330 8.330 8.813 -0.483 18000 3012 1 14 . 1 1 8 8 THR N N 207 119.850 119.850 120.723 -0.873 18000 3013 1 14 . 1 1 8 8 THR HA H 207 4.270 4.270 4.235 0.035 18000 3014 1 14 . 1 1 8 8 THR C C 207 172.560 172.560 176.784 -4.224 18000 3015 1 14 . 1 1 8 8 THR CA C 207 60.420 60.420 65.251 -4.831 18000 3016 1 14 . 1 1 8 8 THR CB C 207 67.750 67.750 68.184 -0.434 18000 3017 1 14 . 1 1 8 8 THR H H 207 7.830 7.830 8.576 -0.746 18000 3018 1 14 . 1 1 9 9 ASP N N 208 121.180 121.180 118.467 2.713 18000 3019 1 14 . 1 1 9 9 ASP HA H 208 4.550 4.550 4.593 -0.043 18000 3020 1 14 . 1 1 9 9 ASP C C 208 174.170 174.170 176.229 -2.059 18000 3021 1 14 . 1 1 9 9 ASP CA C 208 52.670 52.670 58.578 -5.908 18000 3022 1 14 . 1 1 9 9 ASP CB C 208 39.120 39.120 37.975 1.145 18000 3023 1 14 . 1 1 9 9 ASP H H 208 8.350 8.350 8.264 0.086 18000 3024 1 14 . 1 1 10 10 ASN HA H 209 4.600 4.600 4.512 0.088 18000 3025 1 14 . 1 1 10 10 ASN C C 209 173.670 173.670 177.461 -3.791 18000 3026 1 14 . 1 1 10 10 ASN CA C 209 52.110 52.110 56.063 -3.953 18000 3027 1 14 . 1 1 10 10 ASN CB C 209 36.730 36.730 38.009 -1.279 18000 3028 1 14 . 1 1 11 11 LYS N N 210 120.380 120.380 117.056 3.324 18000 3029 1 14 . 1 1 11 11 LYS HA H 210 4.270 4.270 4.048 0.222 18000 3030 1 14 . 1 1 11 11 LYS C C 210 174.910 174.910 178.898 -3.988 18000 3031 1 14 . 1 1 11 11 LYS CA C 210 54.900 54.900 59.942 -5.042 18000 3032 1 14 . 1 1 11 11 LYS CB C 210 30.670 30.670 32.127 -1.457 18000 3033 1 14 . 1 1 11 11 LYS H H 210 8.210 8.210 8.259 -0.049 18000 3034 1 14 . 1 1 12 12 GLU N N 211 120.740 120.740 121.507 -0.767 18000 3035 1 14 . 1 1 12 12 GLU HA H 211 4.070 4.070 4.042 0.028 18000 3036 1 14 . 1 1 12 12 GLU C C 211 174.810 174.810 179.203 -4.393 18000 3037 1 14 . 1 1 12 12 GLU CA C 211 55.940 55.940 60.093 -4.154 18000 3038 1 14 . 1 1 12 12 GLU CB C 211 27.700 27.700 29.549 -1.849 18000 3039 1 14 . 1 1 12 12 GLU H H 211 8.380 8.380 8.294 0.086 18000 3040 1 14 . 1 1 13 13 TYR N N 212 119.430 119.430 119.177 0.253 18000 3041 1 14 . 1 1 13 13 TYR HA H 212 4.380 4.380 4.236 0.144 18000 3042 1 14 . 1 1 13 13 TYR C C 212 174.830 174.830 178.418 -3.588 18000 3043 1 14 . 1 1 13 13 TYR CA C 212 57.420 57.420 60.926 -3.506 18000 3044 1 14 . 1 1 13 13 TYR CB C 212 36.530 36.530 38.247 -1.717 18000 3045 1 14 . 1 1 13 13 TYR H H 212 7.940 7.940 8.161 -0.221 18000 3046 1 14 . 1 1 14 14 ALA N N 213 121.810 121.810 120.540 1.270 18000 3047 1 14 . 1 1 14 14 ALA HA H 213 4.260 4.260 3.998 0.262 18000 3048 1 14 . 1 1 14 14 ALA C C 213 176.630 176.630 179.693 -3.063 18000 3049 1 14 . 1 1 14 14 ALA CA C 213 51.990 51.990 55.333 -3.343 18000 3050 1 14 . 1 1 14 14 ALA CB C 213 16.450 16.450 18.729 -2.279 18000 3051 1 14 . 1 1 14 14 ALA H H 213 7.920 7.920 8.360 -0.440 18000 3052 1 14 . 1 1 15 15 VAL N N 214 121.430 121.430 118.759 2.671 18000 3053 1 14 . 1 1 15 15 VAL HA H 214 3.470 3.470 3.596 -0.126 18000 3054 1 14 . 1 1 15 15 VAL C C 214 174.980 174.980 177.584 -2.604 18000 3055 1 14 . 1 1 15 15 VAL CA C 214 64.190 64.190 66.305 -2.115 18000 3056 1 14 . 1 1 15 15 VAL CB C 214 29.820 29.820 31.317 -1.497 18000 3057 1 14 . 1 1 15 15 VAL H H 214 8.680 8.680 8.549 0.131 18000 3058 1 14 . 1 1 16 16 ASN N N 215 117.460 117.460 118.406 -0.946 18000 3059 1 14 . 1 1 16 16 ASN HA H 215 4.300 4.300 4.466 -0.166 18000 3060 1 14 . 1 1 16 16 ASN C C 215 176.320 176.320 176.879 -0.559 18000 3061 1 14 . 1 1 16 16 ASN CA C 215 54.190 54.190 55.812 -1.622 18000 3062 1 14 . 1 1 16 16 ASN CB C 215 35.360 35.360 37.780 -2.420 18000 3063 1 14 . 1 1 16 16 ASN H H 215 8.190 8.190 8.045 0.145 18000 3064 1 14 . 1 1 17 17 GLU N N 216 119.430 119.430 116.822 2.608 18000 3065 1 14 . 1 1 17 17 GLU HA H 216 4.000 4.000 4.228 -0.228 18000 3066 1 14 . 1 1 17 17 GLU C C 216 177.240 177.240 178.459 -1.219 18000 3067 1 14 . 1 1 17 17 GLU CA C 216 57.180 57.180 58.572 -1.392 18000 3068 1 14 . 1 1 17 17 GLU CB C 216 28.400 28.400 29.457 -1.057 18000 3069 1 14 . 1 1 17 17 GLU H H 216 7.730 7.730 8.163 -0.433 18000 3070 1 14 . 1 1 18 18 VAL N N 217 120.690 120.690 118.936 1.754 18000 3071 1 14 . 1 1 18 18 VAL HA H 217 3.530 3.530 3.911 -0.381 18000 3072 1 14 . 1 1 18 18 VAL C C 217 174.990 174.990 178.495 -3.505 18000 3073 1 14 . 1 1 18 18 VAL CA C 217 64.310 64.310 64.992 -0.682 18000 3074 1 14 . 1 1 18 18 VAL CB C 217 29.640 29.640 31.092 -1.452 18000 3075 1 14 . 1 1 18 18 VAL H H 217 7.820 7.820 7.894 -0.074 18000 3076 1 14 . 1 1 19 19 VAL N N 218 117.010 117.010 115.288 1.722 18000 3077 1 14 . 1 1 19 19 VAL HA H 218 3.500 3.500 3.837 -0.337 18000 3078 1 14 . 1 1 19 19 VAL C C 218 175.200 175.200 176.586 -1.386 18000 3079 1 14 . 1 1 19 19 VAL CA C 218 64.960 64.960 65.306 -0.346 18000 3080 1 14 . 1 1 19 19 VAL CB C 218 29.710 29.710 31.711 -2.001 18000 3081 1 14 . 1 1 19 19 VAL H H 218 8.260 8.260 7.836 0.424 18000 3082 1 14 . 1 1 20 20 ALA N N 219 120.360 120.360 117.782 2.578 18000 3083 1 14 . 1 1 20 20 ALA HA H 219 3.930 3.930 4.318 -0.388 18000 3084 1 14 . 1 1 20 20 ALA C C 219 178.310 178.310 177.701 0.609 18000 3085 1 14 . 1 1 20 20 ALA CA C 219 53.040 53.040 51.196 1.844 18000 3086 1 14 . 1 1 20 20 ALA CB C 219 16.280 16.280 18.793 -2.513 18000 3087 1 14 . 1 1 20 20 ALA H H 219 7.490 7.490 7.328 0.162 18000 3088 1 14 . 1 1 21 21 GLY N N 220 124.250 124.250 109.231 15.019 18000 3089 1 14 . 1 1 21 21 GLY HA H 220 4.250 4.250 4.381 -0.131 18000 3090 1 14 . 1 1 21 21 GLY C C 220 172.880 172.880 174.821 -1.941 18000 3091 1 14 . 1 1 21 21 GLY CA C 220 44.130 44.130 43.764 0.367 18000 3092 1 14 . 1 1 21 21 GLY CB C 220 29.290 29.290 29.057 0.233 18000 3093 1 14 . 1 1 21 21 GLY H H 220 7.640 7.640 7.599 0.041 18000 3094 1 14 . 1 1 22 22 ILE N N 221 119.940 119.940 125.934 -5.994 18000 3095 1 14 . 1 1 22 22 ILE HA H 221 3.290 3.290 4.230 -0.940 18000 3096 1 14 . 1 1 22 22 ILE C C 221 175.100 175.100 174.653 0.447 18000 3097 1 14 . 1 1 22 22 ILE CA C 221 64.070 64.070 59.133 4.937 18000 3098 1 14 . 1 1 22 22 ILE CB C 221 35.260 35.260 37.284 -2.024 18000 3099 1 14 . 1 1 22 22 ILE H H 221 8.130 8.130 8.058 0.072 18000 3100 1 14 . 1 1 23 23 LYS HA H 222 3.430 3.430 4.359 -0.929 18000 3101 1 14 . 1 1 23 23 LYS C C 222 175.280 175.280 175.129 0.151 18000 3102 1 14 . 1 1 23 23 LYS CA C 222 59.270 59.270 56.642 2.628 18000 3103 1 14 . 1 1 23 23 LYS CB C 222 30.670 30.670 31.221 -0.551 18000 3104 1 14 . 1 1 24 24 GLU N N 223 116.150 116.150 121.203 -5.053 18000 3105 1 14 . 1 1 24 24 GLU HA H 223 4.150 4.150 4.508 -0.358 18000 3106 1 14 . 1 1 24 24 GLU C C 223 177.330 177.330 176.069 1.261 18000 3107 1 14 . 1 1 24 24 GLU CA C 223 57.180 57.180 54.803 2.377 18000 3108 1 14 . 1 1 24 24 GLU CB C 223 27.670 27.670 31.297 -3.627 18000 3109 1 14 . 1 1 24 24 GLU H H 223 7.830 7.830 8.170 -0.340 18000 3110 1 14 . 1 1 25 25 TYR N N 224 119.760 119.760 122.734 -2.974 18000 3111 1 14 . 1 1 25 25 TYR HA H 224 4.480 4.480 4.445 0.035 18000 3112 1 14 . 1 1 25 25 TYR C C 224 175.680 175.680 175.380 0.300 18000 3113 1 14 . 1 1 25 25 TYR CA C 224 57.520 57.520 58.460 -0.940 18000 3114 1 14 . 1 1 25 25 TYR CB C 224 36.940 36.940 39.167 -2.227 18000 3115 1 14 . 1 1 25 25 TYR H H 224 8.630 8.630 8.438 0.192 18000 3116 1 14 . 1 1 26 26 PHE N N 225 120.090 120.090 125.479 -5.389 18000 3117 1 14 . 1 1 26 26 PHE HA H 225 3.410 3.410 4.374 -0.964 18000 3118 1 14 . 1 1 26 26 PHE C C 225 173.930 173.930 175.034 -1.104 18000 3119 1 14 . 1 1 26 26 PHE CA C 225 61.600 61.600 58.986 2.614 18000 3120 1 14 . 1 1 26 26 PHE CB C 225 36.590 36.590 39.339 -2.749 18000 3121 1 14 . 1 1 26 26 PHE H H 225 9.220 9.220 8.499 0.721 18000 3122 1 14 . 1 1 27 27 ASN N N 226 115.010 115.010 123.656 -8.646 18000 3123 1 14 . 1 1 27 27 ASN HA H 226 4.470 4.470 4.806 -0.336 18000 3124 1 14 . 1 1 27 27 ASN C C 226 176.630 176.630 173.519 3.111 18000 3125 1 14 . 1 1 27 27 ASN CA C 226 54.160 54.160 51.510 2.650 18000 3126 1 14 . 1 1 27 27 ASN CB C 226 35.800 35.800 41.186 -5.386 18000 3127 1 14 . 1 1 27 27 ASN H H 226 8.210 8.210 7.829 0.381 18000 3128 1 14 . 1 1 28 28 VAL N N 227 115.120 115.120 123.001 -7.881 18000 3129 1 14 . 1 1 28 28 VAL HA H 227 4.300 4.300 4.397 -0.097 18000 3130 1 14 . 1 1 28 28 VAL C C 227 174.960 174.960 174.611 0.349 18000 3131 1 14 . 1 1 28 28 VAL CA C 227 61.320 61.320 60.487 0.833 18000 3132 1 14 . 1 1 28 28 VAL CB C 227 30.670 30.670 31.479 -0.809 18000 3133 1 14 . 1 1 28 28 VAL H H 227 7.430 7.430 8.376 -0.946 18000 3134 1 14 . 1 1 29 29 MET HA H 228 4.000 4.000 4.394 -0.394 18000 3135 1 14 . 1 1 29 29 MET C C 228 176.270 176.270 176.236 0.034 18000 3136 1 14 . 1 1 29 29 MET CA C 228 54.030 54.030 55.388 -1.358 18000 3137 1 14 . 1 1 29 29 MET CB C 228 31.510 31.510 33.571 -2.061 18000 3138 1 14 . 1 1 30 30 LEU N N 229 122.180 122.180 121.470 0.710 18000 3139 1 14 . 1 1 30 30 LEU HA H 229 3.150 3.150 3.992 -0.842 18000 3140 1 14 . 1 1 30 30 LEU C C 229 176.070 176.070 177.390 -1.320 18000 3141 1 14 . 1 1 30 30 LEU CA C 229 55.860 55.860 57.508 -1.647 18000 3142 1 14 . 1 1 30 30 LEU CB C 229 36.340 36.340 42.257 -5.917 18000 3143 1 14 . 1 1 30 30 LEU H H 229 7.890 7.890 8.401 -0.511 18000 3144 1 14 . 1 1 31 31 GLY N N 230 118.390 118.390 104.950 13.440 18000 3145 1 14 . 1 1 31 31 GLY HA H 230 4.090 4.090 4.126 -0.036 18000 3146 1 14 . 1 1 31 31 GLY C C 230 173.070 173.070 175.027 -1.957 18000 3147 1 14 . 1 1 31 31 GLY CA C 230 43.150 43.150 46.666 -3.515 18000 3148 1 14 . 1 1 31 31 GLY CB C 230 26.780 26.780 29.122 -2.341 18000 3149 1 14 . 1 1 31 31 GLY H H 230 8.350 8.350 8.593 -0.243 18000 3150 1 14 . 1 1 32 32 THR N N 231 124.790 124.790 111.954 12.836 18000 3151 1 14 . 1 1 32 32 THR HA H 231 4.280 4.280 4.518 -0.238 18000 3152 1 14 . 1 1 32 32 THR C C 231 173.260 173.260 176.313 -3.053 18000 3153 1 14 . 1 1 32 32 THR CA C 231 60.030 60.030 63.309 -3.279 18000 3154 1 14 . 1 1 32 32 THR CB C 231 68.540 68.540 70.661 -2.121 18000 3155 1 14 . 1 1 32 32 THR H H 231 7.040 7.040 7.616 -0.576 18000 3156 1 14 . 1 1 33 33 GLN N N 232 114.740 114.740 116.793 -2.053 18000 3157 1 14 . 1 1 33 33 GLN HA H 232 5.090 5.090 4.337 0.753 18000 3158 1 14 . 1 1 33 33 GLN C C 232 175.790 175.790 175.695 0.095 18000 3159 1 14 . 1 1 33 33 GLN CA C 232 53.650 53.650 56.812 -3.162 18000 3160 1 14 . 1 1 33 33 GLN CB C 232 30.520 30.520 30.889 -0.369 18000 3161 1 14 . 1 1 33 33 GLN H H 232 8.110 8.110 8.288 -0.178 18000 3162 1 14 . 1 1 34 34 LEU N N 233 112.480 112.480 125.364 -12.884 18000 3163 1 14 . 1 1 34 34 LEU HA H 233 4.460 4.460 3.958 0.502 18000 3164 1 14 . 1 1 34 34 LEU C C 233 172.610 172.610 175.880 -3.270 18000 3165 1 14 . 1 1 34 34 LEU CA C 233 52.460 52.460 55.832 -3.372 18000 3166 1 14 . 1 1 34 34 LEU CB C 233 39.140 39.140 40.011 -0.871 18000 3167 1 14 . 1 1 34 34 LEU H H 233 6.980 6.980 8.229 -1.249 18000 3168 1 14 . 1 1 35 35 LEU N N 234 115.860 115.860 121.681 -5.821 18000 3169 1 14 . 1 1 35 35 LEU HA H 234 4.510 4.510 4.230 0.280 18000 3170 1 14 . 1 1 35 35 LEU C C 234 178.330 178.330 176.135 2.195 18000 3171 1 14 . 1 1 35 35 LEU CA C 234 51.900 51.900 55.492 -3.592 18000 3172 1 14 . 1 1 35 35 LEU CB C 234 40.950 40.950 41.808 -0.858 18000 3173 1 14 . 1 1 35 35 LEU H H 234 7.560 7.560 7.720 -0.160 18000 3174 1 14 . 1 1 36 36 TYR N N 235 125.850 125.850 125.903 -0.053 18000 3175 1 14 . 1 1 36 36 TYR HA H 235 4.790 4.790 4.663 0.127 18000 3176 1 14 . 1 1 36 36 TYR C C 235 176.260 176.260 174.714 1.546 18000 3177 1 14 . 1 1 36 36 TYR CA C 235 57.750 57.750 56.687 1.063 18000 3178 1 14 . 1 1 36 36 TYR CB C 235 37.100 37.100 40.079 -2.979 18000 3179 1 14 . 1 1 36 36 TYR H H 235 9.750 9.750 8.071 1.679 18000 3180 1 14 . 1 1 37 37 LYS N N 236 123.880 123.880 129.373 -5.493 18000 3181 1 14 . 1 1 37 37 LYS HA H 236 3.930 3.930 4.523 -0.593 18000 3182 1 14 . 1 1 37 37 LYS C C 236 178.280 178.280 175.912 2.368 18000 3183 1 14 . 1 1 37 37 LYS CA C 236 59.210 59.210 56.210 3.000 18000 3184 1 14 . 1 1 37 37 LYS CB C 236 30.430 30.430 32.095 -1.665 18000 3185 1 14 . 1 1 37 37 LYS H H 236 9.340 9.340 8.826 0.514 18000 3186 1 14 . 1 1 38 38 PHE N N 237 117.150 117.150 120.756 -3.606 18000 3187 1 14 . 1 1 38 38 PHE HA H 237 4.460 4.460 4.277 0.183 18000 3188 1 14 . 1 1 38 38 PHE C C 237 173.930 173.930 174.120 -0.190 18000 3189 1 14 . 1 1 38 38 PHE CA C 237 58.510 58.510 57.449 1.061 18000 3190 1 14 . 1 1 38 38 PHE CB C 237 38.370 38.370 37.599 0.771 18000 3191 1 14 . 1 1 38 38 PHE H H 237 9.120 9.120 8.210 0.910 18000 3192 1 14 . 1 1 39 39 GLU HA H 238 4.160 4.160 4.048 0.112 18000 3193 1 14 . 1 1 39 39 GLU C C 238 175.650 175.650 177.376 -1.726 18000 3194 1 14 . 1 1 39 39 GLU CA C 238 55.070 55.070 58.589 -3.519 18000 3195 1 14 . 1 1 39 39 GLU CB C 238 31.540 31.540 29.859 1.681 18000 3196 1 14 . 1 1 40 40 ARG N N 239 120.330 120.330 117.542 2.788 18000 3197 1 14 . 1 1 40 40 ARG HA H 239 4.250 4.250 4.019 0.231 18000 3198 1 14 . 1 1 40 40 ARG C C 239 174.490 174.490 176.938 -2.448 18000 3199 1 14 . 1 1 40 40 ARG CA C 239 60.410 60.410 56.535 3.875 18000 3200 1 14 . 1 1 40 40 ARG H H 239 7.980 7.980 8.363 -0.383 18000 3201 1 14 . 1 1 41 41 PRO N N 240 115.390 115.390 117.897 -2.507 18000 3202 1 14 . 1 1 41 41 PRO HA H 240 4.360 4.360 4.521 -0.161 18000 3203 1 14 . 1 1 41 41 PRO C C 240 176.330 176.330 177.598 -1.268 18000 3204 1 14 . 1 1 41 41 PRO CA C 240 64.400 64.400 64.854 -0.454 18000 3205 1 14 . 1 1 41 41 PRO CB C 240 62.240 62.240 63.450 -1.210 18000 3206 1 14 . 1 1 41 41 PRO H H 240 8.090 8.090 8.302 -0.212 18000 3207 1 15 . 1 1 2 2 ARG N N 201 119.330 119.330 122.381 -3.051 18000 3208 1 15 . 1 1 2 2 ARG HA H 201 3.560 3.560 4.572 -1.012 18000 3209 1 15 . 1 1 2 2 ARG C C 201 176.850 176.850 175.366 1.484 18000 3210 1 15 . 1 1 2 2 ARG CA C 201 55.340 55.340 55.536 -0.196 18000 3211 1 15 . 1 1 2 2 ARG CB C 201 27.020 27.020 31.080 -4.060 18000 3212 1 15 . 1 1 2 2 ARG H H 201 8.370 8.370 8.466 -0.096 18000 3213 1 15 . 1 1 3 3 LYS N N 202 118.540 118.540 128.119 -9.579 18000 3214 1 15 . 1 1 3 3 LYS HA H 202 4.010 4.010 4.106 -0.096 18000 3215 1 15 . 1 1 3 3 LYS C C 202 176.090 176.090 176.058 0.032 18000 3216 1 15 . 1 1 3 3 LYS CA C 202 56.960 56.960 56.915 0.045 18000 3217 1 15 . 1 1 3 3 LYS CB C 202 30.590 30.590 32.377 -1.787 18000 3218 1 15 . 1 1 3 3 LYS H H 202 7.940 7.940 8.300 -0.360 18000 3219 1 15 . 1 1 4 4 SER N N 203 113.880 113.880 123.897 -10.017 18000 3220 1 15 . 1 1 4 4 SER HA H 203 4.320 4.320 4.874 -0.554 18000 3221 1 15 . 1 1 4 4 SER C C 203 172.900 172.900 172.482 0.418 18000 3222 1 15 . 1 1 4 4 SER CA C 203 57.870 57.870 55.693 2.177 18000 3223 1 15 . 1 1 4 4 SER CB C 203 61.700 61.700 63.411 -1.711 18000 3224 1 15 . 1 1 4 4 SER H H 203 7.700 7.700 8.689 -0.989 18000 3225 1 15 . 1 1 5 5 ARG HA H 204 4.240 4.240 4.294 -0.054 18000 3226 1 15 . 1 1 5 5 ARG C C 204 174.810 174.810 174.350 0.460 18000 3227 1 15 . 1 1 5 5 ARG CA C 204 54.270 54.270 55.858 -1.588 18000 3228 1 15 . 1 1 5 5 ARG CB C 204 28.700 28.700 30.781 -2.081 18000 3229 1 15 . 1 1 6 6 GLY N N 205 125.950 125.950 109.699 16.251 18000 3230 1 15 . 1 1 6 6 GLY HA H 205 4.400 4.400 4.490 -0.090 18000 3231 1 15 . 1 1 6 6 GLY C C 205 171.910 171.910 175.079 -3.169 18000 3232 1 15 . 1 1 6 6 GLY CA C 205 43.570 43.570 44.304 -0.734 18000 3233 1 15 . 1 1 6 6 GLY CB C 205 28.340 28.340 30.253 -1.913 18000 3234 1 15 . 1 1 6 6 GLY H H 205 7.930 7.930 8.406 -0.476 18000 3235 1 15 . 1 1 7 7 ASN N N 206 118.380 118.380 123.967 -5.587 18000 3236 1 15 . 1 1 7 7 ASN HA H 206 4.760 4.760 4.615 0.145 18000 3237 1 15 . 1 1 7 7 ASN C C 206 173.810 173.810 177.508 -3.698 18000 3238 1 15 . 1 1 7 7 ASN CA C 206 51.430 51.430 54.892 -3.462 18000 3239 1 15 . 1 1 7 7 ASN CB C 206 37.090 37.090 37.705 -0.615 18000 3240 1 15 . 1 1 7 7 ASN H H 206 8.330 8.330 9.050 -0.720 18000 3241 1 15 . 1 1 8 8 THR N N 207 119.850 119.850 120.728 -0.878 18000 3242 1 15 . 1 1 8 8 THR HA H 207 4.270 4.270 4.147 0.123 18000 3243 1 15 . 1 1 8 8 THR C C 207 172.560 172.560 176.800 -4.240 18000 3244 1 15 . 1 1 8 8 THR CA C 207 60.420 60.420 65.351 -4.931 18000 3245 1 15 . 1 1 8 8 THR CB C 207 67.750 67.750 68.191 -0.441 18000 3246 1 15 . 1 1 8 8 THR H H 207 7.830 7.830 8.531 -0.701 18000 3247 1 15 . 1 1 9 9 ASP N N 208 121.180 121.180 118.314 2.866 18000 3248 1 15 . 1 1 9 9 ASP HA H 208 4.550 4.550 4.675 -0.125 18000 3249 1 15 . 1 1 9 9 ASP C C 208 174.170 174.170 175.356 -1.186 18000 3250 1 15 . 1 1 9 9 ASP CA C 208 52.670 52.670 58.054 -5.384 18000 3251 1 15 . 1 1 9 9 ASP CB C 208 39.120 39.120 38.335 0.785 18000 3252 1 15 . 1 1 9 9 ASP H H 208 8.350 8.350 8.273 0.077 18000 3253 1 15 . 1 1 10 10 ASN HA H 209 4.600 4.600 4.419 0.181 18000 3254 1 15 . 1 1 10 10 ASN C C 209 173.670 173.670 177.400 -3.730 18000 3255 1 15 . 1 1 10 10 ASN CA C 209 52.110 52.110 56.273 -4.163 18000 3256 1 15 . 1 1 10 10 ASN CB C 209 36.730 36.730 37.912 -1.182 18000 3257 1 15 . 1 1 11 11 LYS N N 210 120.380 120.380 117.224 3.156 18000 3258 1 15 . 1 1 11 11 LYS HA H 210 4.270 4.270 3.967 0.303 18000 3259 1 15 . 1 1 11 11 LYS C C 210 174.910 174.910 178.755 -3.845 18000 3260 1 15 . 1 1 11 11 LYS CA C 210 54.900 54.900 60.507 -5.607 18000 3261 1 15 . 1 1 11 11 LYS CB C 210 30.670 30.670 32.137 -1.467 18000 3262 1 15 . 1 1 11 11 LYS H H 210 8.210 8.210 8.361 -0.151 18000 3263 1 15 . 1 1 12 12 GLU N N 211 120.740 120.740 120.320 0.420 18000 3264 1 15 . 1 1 12 12 GLU HA H 211 4.070 4.070 4.006 0.064 18000 3265 1 15 . 1 1 12 12 GLU C C 211 174.810 174.810 179.413 -4.603 18000 3266 1 15 . 1 1 12 12 GLU CA C 211 55.940 55.940 59.766 -3.826 18000 3267 1 15 . 1 1 12 12 GLU CB C 211 27.700 27.700 29.504 -1.804 18000 3268 1 15 . 1 1 12 12 GLU H H 211 8.380 8.380 7.836 0.544 18000 3269 1 15 . 1 1 13 13 TYR N N 212 119.430 119.430 119.109 0.321 18000 3270 1 15 . 1 1 13 13 TYR HA H 212 4.380 4.380 4.233 0.147 18000 3271 1 15 . 1 1 13 13 TYR C C 212 174.830 174.830 178.234 -3.404 18000 3272 1 15 . 1 1 13 13 TYR CA C 212 57.420 57.420 61.022 -3.602 18000 3273 1 15 . 1 1 13 13 TYR CB C 212 36.530 36.530 38.163 -1.633 18000 3274 1 15 . 1 1 13 13 TYR H H 212 7.940 7.940 8.544 -0.604 18000 3275 1 15 . 1 1 14 14 ALA N N 213 121.810 121.810 120.666 1.144 18000 3276 1 15 . 1 1 14 14 ALA HA H 213 4.260 4.260 4.003 0.257 18000 3277 1 15 . 1 1 14 14 ALA C C 213 176.630 176.630 179.617 -2.987 18000 3278 1 15 . 1 1 14 14 ALA CA C 213 51.990 51.990 55.293 -3.303 18000 3279 1 15 . 1 1 14 14 ALA CB C 213 16.450 16.450 18.745 -2.295 18000 3280 1 15 . 1 1 14 14 ALA H H 213 7.920 7.920 8.295 -0.375 18000 3281 1 15 . 1 1 15 15 VAL N N 214 121.430 121.430 119.212 2.218 18000 3282 1 15 . 1 1 15 15 VAL HA H 214 3.470 3.470 3.547 -0.077 18000 3283 1 15 . 1 1 15 15 VAL C C 214 174.980 174.980 177.656 -2.676 18000 3284 1 15 . 1 1 15 15 VAL CA C 214 64.190 64.190 66.503 -2.313 18000 3285 1 15 . 1 1 15 15 VAL CB C 214 29.820 29.820 31.230 -1.410 18000 3286 1 15 . 1 1 15 15 VAL H H 214 8.680 8.680 8.618 0.062 18000 3287 1 15 . 1 1 16 16 ASN N N 215 117.460 117.460 118.396 -0.936 18000 3288 1 15 . 1 1 16 16 ASN HA H 215 4.300 4.300 4.448 -0.148 18000 3289 1 15 . 1 1 16 16 ASN C C 215 176.320 176.320 177.314 -0.994 18000 3290 1 15 . 1 1 16 16 ASN CA C 215 54.190 54.190 55.890 -1.700 18000 3291 1 15 . 1 1 16 16 ASN CB C 215 35.360 35.360 37.660 -2.300 18000 3292 1 15 . 1 1 16 16 ASN H H 215 8.190 8.190 8.299 -0.109 18000 3293 1 15 . 1 1 17 17 GLU N N 216 119.430 119.430 117.769 1.661 18000 3294 1 15 . 1 1 17 17 GLU HA H 216 4.000 4.000 4.120 -0.120 18000 3295 1 15 . 1 1 17 17 GLU C C 216 177.240 177.240 178.840 -1.600 18000 3296 1 15 . 1 1 17 17 GLU CA C 216 57.180 57.180 58.567 -1.387 18000 3297 1 15 . 1 1 17 17 GLU CB C 216 28.400 28.400 29.351 -0.951 18000 3298 1 15 . 1 1 17 17 GLU H H 216 7.730 7.730 8.069 -0.339 18000 3299 1 15 . 1 1 18 18 VAL N N 217 120.690 120.690 119.093 1.597 18000 3300 1 15 . 1 1 18 18 VAL HA H 217 3.530 3.530 3.901 -0.371 18000 3301 1 15 . 1 1 18 18 VAL C C 217 174.990 174.990 178.373 -3.383 18000 3302 1 15 . 1 1 18 18 VAL CA C 217 64.310 64.310 64.898 -0.588 18000 3303 1 15 . 1 1 18 18 VAL CB C 217 29.640 29.640 31.160 -1.520 18000 3304 1 15 . 1 1 18 18 VAL H H 217 7.820 7.820 8.103 -0.283 18000 3305 1 15 . 1 1 19 19 VAL N N 218 117.010 117.010 115.518 1.492 18000 3306 1 15 . 1 1 19 19 VAL HA H 218 3.500 3.500 3.809 -0.309 18000 3307 1 15 . 1 1 19 19 VAL C C 218 175.200 175.200 176.764 -1.564 18000 3308 1 15 . 1 1 19 19 VAL CA C 218 64.960 64.960 65.398 -0.438 18000 3309 1 15 . 1 1 19 19 VAL CB C 218 29.710 29.710 31.809 -2.099 18000 3310 1 15 . 1 1 19 19 VAL H H 218 8.260 8.260 7.974 0.286 18000 3311 1 15 . 1 1 20 20 ALA N N 219 120.360 120.360 118.340 2.020 18000 3312 1 15 . 1 1 20 20 ALA HA H 219 3.930 3.930 4.217 -0.287 18000 3313 1 15 . 1 1 20 20 ALA C C 219 178.310 178.310 177.626 0.684 18000 3314 1 15 . 1 1 20 20 ALA CA C 219 53.040 53.040 51.868 1.172 18000 3315 1 15 . 1 1 20 20 ALA CB C 219 16.280 16.280 18.867 -2.587 18000 3316 1 15 . 1 1 20 20 ALA H H 219 7.490 7.490 7.292 0.198 18000 3317 1 15 . 1 1 21 21 GLY N N 220 124.250 124.250 108.694 15.556 18000 3318 1 15 . 1 1 21 21 GLY HA H 220 4.250 4.250 4.335 -0.085 18000 3319 1 15 . 1 1 21 21 GLY C C 220 172.880 172.880 174.574 -1.694 18000 3320 1 15 . 1 1 21 21 GLY CA C 220 44.130 44.130 43.266 0.864 18000 3321 1 15 . 1 1 21 21 GLY CB C 220 29.290 29.290 28.335 0.955 18000 3322 1 15 . 1 1 21 21 GLY H H 220 7.640 7.640 7.472 0.168 18000 3323 1 15 . 1 1 22 22 ILE N N 221 119.940 119.940 126.126 -6.186 18000 3324 1 15 . 1 1 22 22 ILE HA H 221 3.290 3.290 4.125 -0.835 18000 3325 1 15 . 1 1 22 22 ILE C C 221 175.100 175.100 174.989 0.111 18000 3326 1 15 . 1 1 22 22 ILE CA C 221 64.070 64.070 60.723 3.347 18000 3327 1 15 . 1 1 22 22 ILE CB C 221 35.260 35.260 37.962 -2.702 18000 3328 1 15 . 1 1 22 22 ILE H H 221 8.130 8.130 7.865 0.265 18000 3329 1 15 . 1 1 23 23 LYS HA H 222 3.430 3.430 4.278 -0.848 18000 3330 1 15 . 1 1 23 23 LYS C C 222 175.280 175.280 175.233 0.047 18000 3331 1 15 . 1 1 23 23 LYS CA C 222 59.270 59.270 56.844 2.426 18000 3332 1 15 . 1 1 23 23 LYS CB C 222 30.670 30.670 31.268 -0.598 18000 3333 1 15 . 1 1 24 24 GLU N N 223 116.150 116.150 120.466 -4.316 18000 3334 1 15 . 1 1 24 24 GLU HA H 223 4.150 4.150 4.526 -0.376 18000 3335 1 15 . 1 1 24 24 GLU C C 223 177.330 177.330 175.528 1.802 18000 3336 1 15 . 1 1 24 24 GLU CA C 223 57.180 57.180 54.193 2.987 18000 3337 1 15 . 1 1 24 24 GLU CB C 223 27.670 27.670 31.232 -3.562 18000 3338 1 15 . 1 1 24 24 GLU H H 223 7.830 7.830 8.018 -0.188 18000 3339 1 15 . 1 1 25 25 TYR N N 224 119.760 119.760 122.412 -2.652 18000 3340 1 15 . 1 1 25 25 TYR HA H 224 4.480 4.480 4.492 -0.012 18000 3341 1 15 . 1 1 25 25 TYR C C 224 175.680 175.680 175.495 0.185 18000 3342 1 15 . 1 1 25 25 TYR CA C 224 57.520 57.520 58.410 -0.890 18000 3343 1 15 . 1 1 25 25 TYR CB C 224 36.940 36.940 39.229 -2.289 18000 3344 1 15 . 1 1 25 25 TYR H H 224 8.630 8.630 8.420 0.210 18000 3345 1 15 . 1 1 26 26 PHE N N 225 120.090 120.090 124.382 -4.292 18000 3346 1 15 . 1 1 26 26 PHE HA H 225 3.410 3.410 4.464 -1.054 18000 3347 1 15 . 1 1 26 26 PHE C C 225 173.930 173.930 175.057 -1.127 18000 3348 1 15 . 1 1 26 26 PHE CA C 225 61.600 61.600 59.099 2.501 18000 3349 1 15 . 1 1 26 26 PHE CB C 225 36.590 36.590 39.524 -2.934 18000 3350 1 15 . 1 1 26 26 PHE H H 225 9.220 9.220 8.489 0.731 18000 3351 1 15 . 1 1 27 27 ASN N N 226 115.010 115.010 123.524 -8.514 18000 3352 1 15 . 1 1 27 27 ASN HA H 226 4.470 4.470 4.946 -0.476 18000 3353 1 15 . 1 1 27 27 ASN C C 226 176.630 176.630 172.698 3.932 18000 3354 1 15 . 1 1 27 27 ASN CA C 226 54.160 54.160 51.215 2.946 18000 3355 1 15 . 1 1 27 27 ASN CB C 226 35.800 35.800 41.871 -6.071 18000 3356 1 15 . 1 1 27 27 ASN H H 226 8.210 8.210 7.862 0.348 18000 3357 1 15 . 1 1 28 28 VAL N N 227 115.120 115.120 119.046 -3.926 18000 3358 1 15 . 1 1 28 28 VAL HA H 227 4.300 4.300 4.470 -0.170 18000 3359 1 15 . 1 1 28 28 VAL C C 227 174.960 174.960 173.917 1.043 18000 3360 1 15 . 1 1 28 28 VAL CA C 227 61.320 61.320 59.078 2.242 18000 3361 1 15 . 1 1 28 28 VAL CB C 227 30.670 30.670 32.429 -1.759 18000 3362 1 15 . 1 1 28 28 VAL H H 227 7.430 7.430 7.985 -0.555 18000 3363 1 15 . 1 1 29 29 MET HA H 228 4.000 4.000 4.425 -0.425 18000 3364 1 15 . 1 1 29 29 MET C C 228 176.270 176.270 176.034 0.236 18000 3365 1 15 . 1 1 29 29 MET CA C 228 54.030 54.030 54.945 -0.915 18000 3366 1 15 . 1 1 29 29 MET CB C 228 31.510 31.510 33.066 -1.556 18000 3367 1 15 . 1 1 30 30 LEU N N 229 122.180 122.180 123.922 -1.742 18000 3368 1 15 . 1 1 30 30 LEU HA H 229 3.150 3.150 4.007 -0.857 18000 3369 1 15 . 1 1 30 30 LEU C C 229 176.070 176.070 177.478 -1.408 18000 3370 1 15 . 1 1 30 30 LEU CA C 229 55.860 55.860 57.841 -1.981 18000 3371 1 15 . 1 1 30 30 LEU CB C 229 36.340 36.340 41.829 -5.489 18000 3372 1 15 . 1 1 30 30 LEU H H 229 7.890 7.890 8.557 -0.667 18000 3373 1 15 . 1 1 31 31 GLY N N 230 118.390 118.390 107.006 11.384 18000 3374 1 15 . 1 1 31 31 GLY HA H 230 4.090 4.090 4.218 -0.128 18000 3375 1 15 . 1 1 31 31 GLY C C 230 173.070 173.070 175.034 -1.964 18000 3376 1 15 . 1 1 31 31 GLY CA C 230 43.150 43.150 46.136 -2.986 18000 3377 1 15 . 1 1 31 31 GLY CB C 230 26.780 26.780 28.748 -1.968 18000 3378 1 15 . 1 1 31 31 GLY H H 230 8.350 8.350 8.586 -0.236 18000 3379 1 15 . 1 1 32 32 THR N N 231 124.790 124.790 112.569 12.221 18000 3380 1 15 . 1 1 32 32 THR HA H 231 4.280 4.280 4.525 -0.245 18000 3381 1 15 . 1 1 32 32 THR C C 231 173.260 173.260 175.360 -2.100 18000 3382 1 15 . 1 1 32 32 THR CA C 231 60.030 60.030 62.939 -2.909 18000 3383 1 15 . 1 1 32 32 THR CB C 231 68.540 68.540 70.687 -2.147 18000 3384 1 15 . 1 1 32 32 THR H H 231 7.040 7.040 7.743 -0.703 18000 3385 1 15 . 1 1 33 33 GLN N N 232 114.740 114.740 118.723 -3.983 18000 3386 1 15 . 1 1 33 33 GLN HA H 232 5.090 5.090 4.443 0.647 18000 3387 1 15 . 1 1 33 33 GLN C C 232 175.790 175.790 174.478 1.312 18000 3388 1 15 . 1 1 33 33 GLN CA C 232 53.650 53.650 55.988 -2.338 18000 3389 1 15 . 1 1 33 33 GLN CB C 232 30.520 30.520 29.534 0.986 18000 3390 1 15 . 1 1 33 33 GLN H H 232 8.110 8.110 8.229 -0.119 18000 3391 1 15 . 1 1 34 34 LEU N N 233 112.480 112.480 130.085 -17.605 18000 3392 1 15 . 1 1 34 34 LEU HA H 233 4.460 4.460 4.379 0.081 18000 3393 1 15 . 1 1 34 34 LEU C C 233 172.610 172.610 177.701 -5.091 18000 3394 1 15 . 1 1 34 34 LEU CA C 233 52.460 52.460 53.152 -0.692 18000 3395 1 15 . 1 1 34 34 LEU CB C 233 39.140 39.140 40.546 -1.406 18000 3396 1 15 . 1 1 34 34 LEU H H 233 6.980 6.980 8.949 -1.969 18000 3397 1 15 . 1 1 35 35 LEU N N 234 115.860 115.860 121.820 -5.960 18000 3398 1 15 . 1 1 35 35 LEU HA H 234 4.510 4.510 4.333 0.177 18000 3399 1 15 . 1 1 35 35 LEU C C 234 178.330 178.330 177.352 0.978 18000 3400 1 15 . 1 1 35 35 LEU CA C 234 51.900 51.900 56.201 -4.301 18000 3401 1 15 . 1 1 35 35 LEU CB C 234 40.950 40.950 41.831 -0.881 18000 3402 1 15 . 1 1 35 35 LEU H H 234 7.560 7.560 8.444 -0.884 18000 3403 1 15 . 1 1 36 36 TYR N N 235 125.850 125.850 119.282 6.568 18000 3404 1 15 . 1 1 36 36 TYR HA H 235 4.790 4.790 4.603 0.187 18000 3405 1 15 . 1 1 36 36 TYR C C 235 176.260 176.260 175.556 0.704 18000 3406 1 15 . 1 1 36 36 TYR CA C 235 57.750 57.750 56.601 1.149 18000 3407 1 15 . 1 1 36 36 TYR CB C 235 37.100 37.100 37.683 -0.583 18000 3408 1 15 . 1 1 36 36 TYR H H 235 9.750 9.750 7.831 1.919 18000 3409 1 15 . 1 1 37 37 LYS N N 236 123.880 123.880 121.742 2.138 18000 3410 1 15 . 1 1 37 37 LYS HA H 236 3.930 3.930 4.322 -0.392 18000 3411 1 15 . 1 1 37 37 LYS C C 236 178.280 178.280 175.615 2.665 18000 3412 1 15 . 1 1 37 37 LYS CA C 236 59.210 59.210 56.982 2.228 18000 3413 1 15 . 1 1 37 37 LYS CB C 236 30.430 30.430 33.068 -2.638 18000 3414 1 15 . 1 1 37 37 LYS H H 236 9.340 9.340 8.150 1.190 18000 3415 1 15 . 1 1 38 38 PHE N N 237 117.150 117.150 123.092 -5.942 18000 3416 1 15 . 1 1 38 38 PHE HA H 237 4.460 4.460 4.934 -0.474 18000 3417 1 15 . 1 1 38 38 PHE C C 237 173.930 173.930 174.302 -0.372 18000 3418 1 15 . 1 1 38 38 PHE CA C 237 58.510 58.510 56.198 2.312 18000 3419 1 15 . 1 1 38 38 PHE CB C 237 38.370 38.370 40.384 -2.014 18000 3420 1 15 . 1 1 38 38 PHE H H 237 9.120 9.120 8.887 0.233 18000 3421 1 15 . 1 1 39 39 GLU HA H 238 4.160 4.160 4.774 -0.614 18000 3422 1 15 . 1 1 39 39 GLU C C 238 175.650 175.650 175.813 -0.163 18000 3423 1 15 . 1 1 39 39 GLU CA C 238 55.070 55.070 55.959 -0.889 18000 3424 1 15 . 1 1 39 39 GLU CB C 238 31.540 31.540 31.777 -0.237 18000 3425 1 15 . 1 1 40 40 ARG N N 239 120.330 120.330 118.437 1.893 18000 3426 1 15 . 1 1 40 40 ARG HA H 239 4.250 4.250 4.473 -0.223 18000 3427 1 15 . 1 1 40 40 ARG C C 239 174.490 174.490 175.258 -0.768 18000 3428 1 15 . 1 1 40 40 ARG CA C 239 60.410 60.410 56.053 4.357 18000 3429 1 15 . 1 1 40 40 ARG H H 239 7.980 7.980 8.805 -0.825 18000 3430 1 15 . 1 1 41 41 PRO N N 240 115.390 115.390 116.150 -0.760 18000 3431 1 15 . 1 1 41 41 PRO HA H 240 4.360 4.360 4.330 0.030 18000 3432 1 15 . 1 1 41 41 PRO C C 240 176.330 176.330 177.426 -1.096 18000 3433 1 15 . 1 1 41 41 PRO CA C 240 64.400 64.400 62.856 1.544 18000 3434 1 15 . 1 1 41 41 PRO CB C 240 62.240 62.240 62.784 -0.544 18000 3435 1 15 . 1 1 41 41 PRO H H 240 8.090 8.090 8.819 -0.729 18000 3436 1 16 . 1 1 2 2 ARG N N 201 119.330 119.330 123.002 -3.672 18000 3437 1 16 . 1 1 2 2 ARG HA H 201 3.560 3.560 4.604 -1.044 18000 3438 1 16 . 1 1 2 2 ARG C C 201 176.850 176.850 174.766 2.084 18000 3439 1 16 . 1 1 2 2 ARG CA C 201 55.340 55.340 55.829 -0.489 18000 3440 1 16 . 1 1 2 2 ARG CB C 201 27.020 27.020 31.802 -4.782 18000 3441 1 16 . 1 1 2 2 ARG H H 201 8.370 8.370 7.898 0.472 18000 3442 1 16 . 1 1 3 3 LYS N N 202 118.540 118.540 126.361 -7.821 18000 3443 1 16 . 1 1 3 3 LYS HA H 202 4.010 4.010 4.444 -0.434 18000 3444 1 16 . 1 1 3 3 LYS C C 202 176.090 176.090 175.496 0.594 18000 3445 1 16 . 1 1 3 3 LYS CA C 202 56.960 56.960 56.455 0.505 18000 3446 1 16 . 1 1 3 3 LYS CB C 202 30.590 30.590 32.983 -2.393 18000 3447 1 16 . 1 1 3 3 LYS H H 202 7.940 7.940 8.088 -0.148 18000 3448 1 16 . 1 1 4 4 SER N N 203 113.880 113.880 122.167 -8.287 18000 3449 1 16 . 1 1 4 4 SER HA H 203 4.320 4.320 4.836 -0.516 18000 3450 1 16 . 1 1 4 4 SER C C 203 172.900 172.900 172.208 0.692 18000 3451 1 16 . 1 1 4 4 SER CA C 203 57.870 57.870 56.883 0.987 18000 3452 1 16 . 1 1 4 4 SER CB C 203 61.700 61.700 63.472 -1.772 18000 3453 1 16 . 1 1 4 4 SER H H 203 7.700 7.700 8.819 -1.119 18000 3454 1 16 . 1 1 5 5 ARG HA H 204 4.240 4.240 4.607 -0.367 18000 3455 1 16 . 1 1 5 5 ARG C C 204 174.810 174.810 174.934 -0.124 18000 3456 1 16 . 1 1 5 5 ARG CA C 204 54.270 54.270 55.209 -0.939 18000 3457 1 16 . 1 1 5 5 ARG CB C 204 28.700 28.700 30.923 -2.223 18000 3458 1 16 . 1 1 6 6 GLY N N 205 125.950 125.950 106.642 19.308 18000 3459 1 16 . 1 1 6 6 GLY HA H 205 4.400 4.400 4.288 0.112 18000 3460 1 16 . 1 1 6 6 GLY C C 205 171.910 171.910 174.519 -2.609 18000 3461 1 16 . 1 1 6 6 GLY CA C 205 43.570 43.570 45.319 -1.749 18000 3462 1 16 . 1 1 6 6 GLY CB C 205 28.340 28.340 28.162 0.178 18000 3463 1 16 . 1 1 6 6 GLY H H 205 7.930 7.930 8.216 -0.286 18000 3464 1 16 . 1 1 7 7 ASN N N 206 118.380 118.380 116.931 1.449 18000 3465 1 16 . 1 1 7 7 ASN HA H 206 4.760 4.760 4.623 0.137 18000 3466 1 16 . 1 1 7 7 ASN C C 206 173.810 173.810 176.830 -3.020 18000 3467 1 16 . 1 1 7 7 ASN CA C 206 51.430 51.430 54.882 -3.451 18000 3468 1 16 . 1 1 7 7 ASN CB C 206 37.090 37.090 38.401 -1.311 18000 3469 1 16 . 1 1 7 7 ASN H H 206 8.330 8.330 8.350 -0.020 18000 3470 1 16 . 1 1 8 8 THR N N 207 119.850 119.850 120.694 -0.844 18000 3471 1 16 . 1 1 8 8 THR HA H 207 4.270 4.270 4.231 0.039 18000 3472 1 16 . 1 1 8 8 THR C C 207 172.560 172.560 176.390 -3.830 18000 3473 1 16 . 1 1 8 8 THR CA C 207 60.420 60.420 65.299 -4.879 18000 3474 1 16 . 1 1 8 8 THR CB C 207 67.750 67.750 67.549 0.201 18000 3475 1 16 . 1 1 8 8 THR H H 207 7.830 7.830 8.744 -0.914 18000 3476 1 16 . 1 1 9 9 ASP N N 208 121.180 121.180 118.446 2.734 18000 3477 1 16 . 1 1 9 9 ASP HA H 208 4.550 4.550 4.600 -0.050 18000 3478 1 16 . 1 1 9 9 ASP C C 208 174.170 174.170 176.692 -2.522 18000 3479 1 16 . 1 1 9 9 ASP CA C 208 52.670 52.670 58.457 -5.787 18000 3480 1 16 . 1 1 9 9 ASP CB C 208 39.120 39.120 37.975 1.145 18000 3481 1 16 . 1 1 9 9 ASP H H 208 8.350 8.350 8.887 -0.537 18000 3482 1 16 . 1 1 10 10 ASN HA H 209 4.600 4.600 4.492 0.108 18000 3483 1 16 . 1 1 10 10 ASN C C 209 173.670 173.670 177.386 -3.716 18000 3484 1 16 . 1 1 10 10 ASN CA C 209 52.110 52.110 56.061 -3.951 18000 3485 1 16 . 1 1 10 10 ASN CB C 209 36.730 36.730 37.961 -1.230 18000 3486 1 16 . 1 1 11 11 LYS N N 210 120.380 120.380 117.753 2.627 18000 3487 1 16 . 1 1 11 11 LYS HA H 210 4.270 4.270 3.969 0.301 18000 3488 1 16 . 1 1 11 11 LYS C C 210 174.910 174.910 178.918 -4.008 18000 3489 1 16 . 1 1 11 11 LYS CA C 210 54.900 54.900 60.196 -5.296 18000 3490 1 16 . 1 1 11 11 LYS CB C 210 30.670 30.670 31.926 -1.256 18000 3491 1 16 . 1 1 11 11 LYS H H 210 8.210 8.210 8.184 0.026 18000 3492 1 16 . 1 1 12 12 GLU N N 211 120.740 120.740 119.815 0.925 18000 3493 1 16 . 1 1 12 12 GLU HA H 211 4.070 4.070 4.026 0.044 18000 3494 1 16 . 1 1 12 12 GLU C C 211 174.810 174.810 179.537 -4.727 18000 3495 1 16 . 1 1 12 12 GLU CA C 211 55.940 55.940 59.886 -3.946 18000 3496 1 16 . 1 1 12 12 GLU CB C 211 27.700 27.700 29.156 -1.456 18000 3497 1 16 . 1 1 12 12 GLU H H 211 8.380 8.380 8.830 -0.450 18000 3498 1 16 . 1 1 13 13 TYR N N 212 119.430 119.430 119.129 0.301 18000 3499 1 16 . 1 1 13 13 TYR HA H 212 4.380 4.380 4.248 0.132 18000 3500 1 16 . 1 1 13 13 TYR C C 212 174.830 174.830 178.280 -3.450 18000 3501 1 16 . 1 1 13 13 TYR CA C 212 57.420 57.420 61.098 -3.678 18000 3502 1 16 . 1 1 13 13 TYR CB C 212 36.530 36.530 38.137 -1.607 18000 3503 1 16 . 1 1 13 13 TYR H H 212 7.940 7.940 7.870 0.070 18000 3504 1 16 . 1 1 14 14 ALA N N 213 121.810 121.810 119.923 1.887 18000 3505 1 16 . 1 1 14 14 ALA HA H 213 4.260 4.260 3.921 0.339 18000 3506 1 16 . 1 1 14 14 ALA C C 213 176.630 176.630 180.089 -3.459 18000 3507 1 16 . 1 1 14 14 ALA CA C 213 51.990 51.990 55.344 -3.354 18000 3508 1 16 . 1 1 14 14 ALA CB C 213 16.450 16.450 18.618 -2.168 18000 3509 1 16 . 1 1 14 14 ALA H H 213 7.920 7.920 8.253 -0.333 18000 3510 1 16 . 1 1 15 15 VAL N N 214 121.430 121.430 119.561 1.869 18000 3511 1 16 . 1 1 15 15 VAL HA H 214 3.470 3.470 3.569 -0.099 18000 3512 1 16 . 1 1 15 15 VAL C C 214 174.980 174.980 177.826 -2.846 18000 3513 1 16 . 1 1 15 15 VAL CA C 214 64.190 64.190 66.398 -2.208 18000 3514 1 16 . 1 1 15 15 VAL CB C 214 29.820 29.820 31.276 -1.456 18000 3515 1 16 . 1 1 15 15 VAL H H 214 8.680 8.680 8.769 -0.089 18000 3516 1 16 . 1 1 16 16 ASN N N 215 117.460 117.460 118.279 -0.819 18000 3517 1 16 . 1 1 16 16 ASN HA H 215 4.300 4.300 4.435 -0.135 18000 3518 1 16 . 1 1 16 16 ASN C C 215 176.320 176.320 177.415 -1.095 18000 3519 1 16 . 1 1 16 16 ASN CA C 215 54.190 54.190 55.924 -1.734 18000 3520 1 16 . 1 1 16 16 ASN CB C 215 35.360 35.360 37.668 -2.308 18000 3521 1 16 . 1 1 16 16 ASN H H 215 8.190 8.190 8.443 -0.253 18000 3522 1 16 . 1 1 17 17 GLU N N 216 119.430 119.430 117.695 1.735 18000 3523 1 16 . 1 1 17 17 GLU HA H 216 4.000 4.000 4.141 -0.141 18000 3524 1 16 . 1 1 17 17 GLU C C 216 177.240 177.240 178.053 -0.813 18000 3525 1 16 . 1 1 17 17 GLU CA C 216 57.180 57.180 58.863 -1.683 18000 3526 1 16 . 1 1 17 17 GLU CB C 216 28.400 28.400 29.191 -0.791 18000 3527 1 16 . 1 1 17 17 GLU H H 216 7.730 7.730 8.454 -0.724 18000 3528 1 16 . 1 1 18 18 VAL N N 217 120.690 120.690 117.421 3.269 18000 3529 1 16 . 1 1 18 18 VAL HA H 217 3.530 3.530 3.938 -0.408 18000 3530 1 16 . 1 1 18 18 VAL C C 217 174.990 174.990 178.789 -3.799 18000 3531 1 16 . 1 1 18 18 VAL CA C 217 64.310 64.310 64.644 -0.334 18000 3532 1 16 . 1 1 18 18 VAL CB C 217 29.640 29.640 31.522 -1.882 18000 3533 1 16 . 1 1 18 18 VAL H H 217 7.820 7.820 7.957 -0.137 18000 3534 1 16 . 1 1 19 19 VAL N N 218 117.010 117.010 116.622 0.388 18000 3535 1 16 . 1 1 19 19 VAL HA H 218 3.500 3.500 3.799 -0.299 18000 3536 1 16 . 1 1 19 19 VAL C C 218 175.200 175.200 177.105 -1.905 18000 3537 1 16 . 1 1 19 19 VAL CA C 218 64.960 64.960 65.737 -0.777 18000 3538 1 16 . 1 1 19 19 VAL CB C 218 29.710 29.710 31.844 -2.134 18000 3539 1 16 . 1 1 19 19 VAL H H 218 8.260 8.260 8.006 0.254 18000 3540 1 16 . 1 1 20 20 ALA N N 219 120.360 120.360 117.391 2.969 18000 3541 1 16 . 1 1 20 20 ALA HA H 219 3.930 3.930 4.275 -0.345 18000 3542 1 16 . 1 1 20 20 ALA C C 219 178.310 178.310 177.584 0.726 18000 3543 1 16 . 1 1 20 20 ALA CA C 219 53.040 53.040 51.694 1.347 18000 3544 1 16 . 1 1 20 20 ALA CB C 219 16.280 16.280 18.867 -2.587 18000 3545 1 16 . 1 1 20 20 ALA H H 219 7.490 7.490 7.358 0.132 18000 3546 1 16 . 1 1 21 21 GLY N N 220 124.250 124.250 108.586 15.664 18000 3547 1 16 . 1 1 21 21 GLY HA H 220 4.250 4.250 4.393 -0.143 18000 3548 1 16 . 1 1 21 21 GLY C C 220 172.880 172.880 174.649 -1.769 18000 3549 1 16 . 1 1 21 21 GLY CA C 220 44.130 44.130 43.864 0.266 18000 3550 1 16 . 1 1 21 21 GLY CB C 220 29.290 29.290 29.143 0.147 18000 3551 1 16 . 1 1 21 21 GLY H H 220 7.640 7.640 7.479 0.161 18000 3552 1 16 . 1 1 22 22 ILE N N 221 119.940 119.940 125.540 -5.600 18000 3553 1 16 . 1 1 22 22 ILE HA H 221 3.290 3.290 4.310 -1.020 18000 3554 1 16 . 1 1 22 22 ILE C C 221 175.100 175.100 174.718 0.382 18000 3555 1 16 . 1 1 22 22 ILE CA C 221 64.070 64.070 60.144 3.926 18000 3556 1 16 . 1 1 22 22 ILE CB C 221 35.260 35.260 38.163 -2.903 18000 3557 1 16 . 1 1 22 22 ILE H H 221 8.130 8.130 8.115 0.015 18000 3558 1 16 . 1 1 23 23 LYS HA H 222 3.430 3.430 4.403 -0.973 18000 3559 1 16 . 1 1 23 23 LYS C C 222 175.280 175.280 175.669 -0.389 18000 3560 1 16 . 1 1 23 23 LYS CA C 222 59.270 59.270 56.629 2.641 18000 3561 1 16 . 1 1 23 23 LYS CB C 222 30.670 30.670 31.492 -0.822 18000 3562 1 16 . 1 1 24 24 GLU N N 223 116.150 116.150 121.653 -5.503 18000 3563 1 16 . 1 1 24 24 GLU HA H 223 4.150 4.150 4.251 -0.101 18000 3564 1 16 . 1 1 24 24 GLU C C 223 177.330 177.330 176.385 0.945 18000 3565 1 16 . 1 1 24 24 GLU CA C 223 57.180 57.180 56.449 0.731 18000 3566 1 16 . 1 1 24 24 GLU CB C 223 27.670 27.670 30.452 -2.782 18000 3567 1 16 . 1 1 24 24 GLU H H 223 7.830 7.830 8.573 -0.743 18000 3568 1 16 . 1 1 25 25 TYR N N 224 119.760 119.760 119.441 0.319 18000 3569 1 16 . 1 1 25 25 TYR HA H 224 4.480 4.480 4.664 -0.184 18000 3570 1 16 . 1 1 25 25 TYR C C 224 175.680 175.680 173.976 1.704 18000 3571 1 16 . 1 1 25 25 TYR CA C 224 57.520 57.520 57.498 0.022 18000 3572 1 16 . 1 1 25 25 TYR CB C 224 36.940 36.940 41.396 -4.456 18000 3573 1 16 . 1 1 25 25 TYR H H 224 8.630 8.630 7.864 0.766 18000 3574 1 16 . 1 1 26 26 PHE N N 225 120.090 120.090 124.834 -4.744 18000 3575 1 16 . 1 1 26 26 PHE HA H 225 3.410 3.410 4.450 -1.040 18000 3576 1 16 . 1 1 26 26 PHE C C 225 173.930 173.930 174.617 -0.687 18000 3577 1 16 . 1 1 26 26 PHE CA C 225 61.600 61.600 58.872 2.728 18000 3578 1 16 . 1 1 26 26 PHE CB C 225 36.590 36.590 39.191 -2.602 18000 3579 1 16 . 1 1 26 26 PHE H H 225 9.220 9.220 8.720 0.500 18000 3580 1 16 . 1 1 27 27 ASN N N 226 115.010 115.010 124.063 -9.053 18000 3581 1 16 . 1 1 27 27 ASN HA H 226 4.470 4.470 4.715 -0.245 18000 3582 1 16 . 1 1 27 27 ASN C C 226 176.630 176.630 173.705 2.925 18000 3583 1 16 . 1 1 27 27 ASN CA C 226 54.160 54.160 51.357 2.803 18000 3584 1 16 . 1 1 27 27 ASN CB C 226 35.800 35.800 41.627 -5.827 18000 3585 1 16 . 1 1 27 27 ASN H H 226 8.210 8.210 8.354 -0.144 18000 3586 1 16 . 1 1 28 28 VAL N N 227 115.120 115.120 121.608 -6.488 18000 3587 1 16 . 1 1 28 28 VAL HA H 227 4.300 4.300 4.346 -0.046 18000 3588 1 16 . 1 1 28 28 VAL C C 227 174.960 174.960 174.169 0.791 18000 3589 1 16 . 1 1 28 28 VAL CA C 227 61.320 61.320 59.470 1.850 18000 3590 1 16 . 1 1 28 28 VAL CB C 227 30.670 30.670 31.629 -0.959 18000 3591 1 16 . 1 1 28 28 VAL H H 227 7.430 7.430 7.945 -0.515 18000 3592 1 16 . 1 1 29 29 MET HA H 228 4.000 4.000 4.384 -0.384 18000 3593 1 16 . 1 1 29 29 MET C C 228 176.270 176.270 175.911 0.359 18000 3594 1 16 . 1 1 29 29 MET CA C 228 54.030 54.030 55.009 -0.979 18000 3595 1 16 . 1 1 29 29 MET CB C 228 31.510 31.510 33.389 -1.879 18000 3596 1 16 . 1 1 30 30 LEU N N 229 122.180 122.180 122.608 -0.428 18000 3597 1 16 . 1 1 30 30 LEU HA H 229 3.150 3.150 4.012 -0.862 18000 3598 1 16 . 1 1 30 30 LEU C C 229 176.070 176.070 177.371 -1.301 18000 3599 1 16 . 1 1 30 30 LEU CA C 229 55.860 55.860 57.360 -1.500 18000 3600 1 16 . 1 1 30 30 LEU CB C 229 36.340 36.340 42.255 -5.915 18000 3601 1 16 . 1 1 30 30 LEU H H 229 7.890 7.890 8.486 -0.596 18000 3602 1 16 . 1 1 31 31 GLY N N 230 118.390 118.390 105.201 13.189 18000 3603 1 16 . 1 1 31 31 GLY HA H 230 4.090 4.090 4.154 -0.064 18000 3604 1 16 . 1 1 31 31 GLY C C 230 173.070 173.070 175.186 -2.116 18000 3605 1 16 . 1 1 31 31 GLY CA C 230 43.150 43.150 46.595 -3.445 18000 3606 1 16 . 1 1 31 31 GLY CB C 230 26.780 26.780 29.026 -2.246 18000 3607 1 16 . 1 1 31 31 GLY H H 230 8.350 8.350 8.481 -0.131 18000 3608 1 16 . 1 1 32 32 THR N N 231 124.790 124.790 113.344 11.446 18000 3609 1 16 . 1 1 32 32 THR HA H 231 4.280 4.280 4.359 -0.079 18000 3610 1 16 . 1 1 32 32 THR C C 231 173.260 173.260 176.337 -3.077 18000 3611 1 16 . 1 1 32 32 THR CA C 231 60.030 60.030 64.317 -4.287 18000 3612 1 16 . 1 1 32 32 THR CB C 231 68.540 68.540 70.172 -1.632 18000 3613 1 16 . 1 1 32 32 THR H H 231 7.040 7.040 7.416 -0.376 18000 3614 1 16 . 1 1 33 33 GLN N N 232 114.740 114.740 115.796 -1.056 18000 3615 1 16 . 1 1 33 33 GLN HA H 232 5.090 5.090 4.329 0.761 18000 3616 1 16 . 1 1 33 33 GLN C C 232 175.790 175.790 175.636 0.154 18000 3617 1 16 . 1 1 33 33 GLN CA C 232 53.650 53.650 55.575 -1.925 18000 3618 1 16 . 1 1 33 33 GLN CB C 232 30.520 30.520 30.610 -0.090 18000 3619 1 16 . 1 1 33 33 GLN H H 232 8.110 8.110 8.159 -0.049 18000 3620 1 16 . 1 1 34 34 LEU N N 233 112.480 112.480 124.418 -11.938 18000 3621 1 16 . 1 1 34 34 LEU HA H 233 4.460 4.460 4.024 0.436 18000 3622 1 16 . 1 1 34 34 LEU C C 233 172.610 172.610 177.527 -4.917 18000 3623 1 16 . 1 1 34 34 LEU CA C 233 52.460 52.460 55.489 -3.029 18000 3624 1 16 . 1 1 34 34 LEU CB C 233 39.140 39.140 42.230 -3.090 18000 3625 1 16 . 1 1 34 34 LEU H H 233 6.980 6.980 8.145 -1.165 18000 3626 1 16 . 1 1 35 35 LEU N N 234 115.860 115.860 127.412 -11.552 18000 3627 1 16 . 1 1 35 35 LEU HA H 234 4.510 4.510 4.400 0.110 18000 3628 1 16 . 1 1 35 35 LEU C C 234 178.330 178.330 177.266 1.064 18000 3629 1 16 . 1 1 35 35 LEU CA C 234 51.900 51.900 56.707 -4.807 18000 3630 1 16 . 1 1 35 35 LEU CB C 234 40.950 40.950 41.843 -0.893 18000 3631 1 16 . 1 1 35 35 LEU H H 234 7.560 7.560 8.518 -0.958 18000 3632 1 16 . 1 1 36 36 TYR N N 235 125.850 125.850 117.453 8.397 18000 3633 1 16 . 1 1 36 36 TYR HA H 235 4.790 4.790 4.459 0.331 18000 3634 1 16 . 1 1 36 36 TYR C C 235 176.260 176.260 175.701 0.559 18000 3635 1 16 . 1 1 36 36 TYR CA C 235 57.750 57.750 57.128 0.622 18000 3636 1 16 . 1 1 36 36 TYR CB C 235 37.100 37.100 38.197 -1.097 18000 3637 1 16 . 1 1 36 36 TYR H H 235 9.750 9.750 7.710 2.040 18000 3638 1 16 . 1 1 37 37 LYS N N 236 123.880 123.880 120.459 3.421 18000 3639 1 16 . 1 1 37 37 LYS HA H 236 3.930 3.930 3.949 -0.019 18000 3640 1 16 . 1 1 37 37 LYS C C 236 178.280 178.280 174.198 4.082 18000 3641 1 16 . 1 1 37 37 LYS CA C 236 59.210 59.210 57.129 2.081 18000 3642 1 16 . 1 1 37 37 LYS CB C 236 30.430 30.430 32.009 -1.579 18000 3643 1 16 . 1 1 37 37 LYS H H 236 9.340 9.340 7.344 1.996 18000 3644 1 16 . 1 1 38 38 PHE N N 237 117.150 117.150 114.604 2.546 18000 3645 1 16 . 1 1 38 38 PHE HA H 237 4.460 4.460 5.113 -0.653 18000 3646 1 16 . 1 1 38 38 PHE C C 237 173.930 173.930 173.499 0.431 18000 3647 1 16 . 1 1 38 38 PHE CA C 237 58.510 58.510 55.383 3.127 18000 3648 1 16 . 1 1 38 38 PHE CB C 237 38.370 38.370 40.280 -1.910 18000 3649 1 16 . 1 1 38 38 PHE H H 237 9.120 9.120 7.990 1.130 18000 3650 1 16 . 1 1 39 39 GLU HA H 238 4.160 4.160 4.462 -0.302 18000 3651 1 16 . 1 1 39 39 GLU C C 238 175.650 175.650 176.239 -0.589 18000 3652 1 16 . 1 1 39 39 GLU CA C 238 55.070 55.070 56.636 -1.566 18000 3653 1 16 . 1 1 39 39 GLU CB C 238 31.540 31.540 28.910 2.630 18000 3654 1 16 . 1 1 40 40 ARG N N 239 120.330 120.330 123.277 -2.947 18000 3655 1 16 . 1 1 40 40 ARG HA H 239 4.250 4.250 4.186 0.064 18000 3656 1 16 . 1 1 40 40 ARG C C 239 174.490 174.490 175.244 -0.754 18000 3657 1 16 . 1 1 40 40 ARG CA C 239 60.410 60.410 55.891 4.519 18000 3658 1 16 . 1 1 40 40 ARG H H 239 7.980 7.980 8.372 -0.392 18000 3659 1 16 . 1 1 41 41 PRO N N 240 115.390 115.390 116.121 -0.731 18000 3660 1 16 . 1 1 41 41 PRO HA H 240 4.360 4.360 4.686 -0.326 18000 3661 1 16 . 1 1 41 41 PRO C C 240 176.330 176.330 176.309 0.021 18000 3662 1 16 . 1 1 41 41 PRO CA C 240 64.400 64.400 63.197 1.203 18000 3663 1 16 . 1 1 41 41 PRO CB C 240 62.240 62.240 63.717 -1.477 18000 3664 1 16 . 1 1 41 41 PRO H H 240 8.090 8.090 8.085 0.005 18000 3665 1 17 . 1 1 2 2 ARG N N 201 119.330 119.330 121.659 -2.329 18000 3666 1 17 . 1 1 2 2 ARG HA H 201 3.560 3.560 4.585 -1.025 18000 3667 1 17 . 1 1 2 2 ARG C C 201 176.850 176.850 175.051 1.799 18000 3668 1 17 . 1 1 2 2 ARG CA C 201 55.340 55.340 55.863 -0.523 18000 3669 1 17 . 1 1 2 2 ARG CB C 201 27.020 27.020 31.323 -4.303 18000 3670 1 17 . 1 1 2 2 ARG H H 201 8.370 8.370 8.164 0.206 18000 3671 1 17 . 1 1 3 3 LYS N N 202 118.540 118.540 124.568 -6.028 18000 3672 1 17 . 1 1 3 3 LYS HA H 202 4.010 4.010 4.368 -0.358 18000 3673 1 17 . 1 1 3 3 LYS C C 202 176.090 176.090 175.501 0.589 18000 3674 1 17 . 1 1 3 3 LYS CA C 202 56.960 56.960 56.469 0.491 18000 3675 1 17 . 1 1 3 3 LYS CB C 202 30.590 30.590 32.779 -2.189 18000 3676 1 17 . 1 1 3 3 LYS H H 202 7.940 7.940 8.126 -0.186 18000 3677 1 17 . 1 1 4 4 SER N N 203 113.880 113.880 115.496 -1.616 18000 3678 1 17 . 1 1 4 4 SER HA H 203 4.320 4.320 4.806 -0.486 18000 3679 1 17 . 1 1 4 4 SER C C 203 172.900 172.900 172.061 0.839 18000 3680 1 17 . 1 1 4 4 SER CA C 203 57.870 57.870 55.485 2.385 18000 3681 1 17 . 1 1 4 4 SER CB C 203 61.700 61.700 63.151 -1.451 18000 3682 1 17 . 1 1 4 4 SER H H 203 7.700 7.700 7.444 0.256 18000 3683 1 17 . 1 1 5 5 ARG HA H 204 4.240 4.240 4.065 0.175 18000 3684 1 17 . 1 1 5 5 ARG C C 204 174.810 174.810 175.298 -0.488 18000 3685 1 17 . 1 1 5 5 ARG CA C 204 54.270 54.270 56.980 -2.710 18000 3686 1 17 . 1 1 5 5 ARG CB C 204 28.700 28.700 30.663 -1.963 18000 3687 1 17 . 1 1 6 6 GLY N N 205 125.950 125.950 104.212 21.738 18000 3688 1 17 . 1 1 6 6 GLY HA H 205 4.400 4.400 4.139 0.261 18000 3689 1 17 . 1 1 6 6 GLY C C 205 171.910 171.910 174.693 -2.783 18000 3690 1 17 . 1 1 6 6 GLY CA C 205 43.570 43.570 45.625 -2.055 18000 3691 1 17 . 1 1 6 6 GLY CB C 205 28.340 28.340 28.805 -0.465 18000 3692 1 17 . 1 1 6 6 GLY H H 205 7.930 7.930 7.909 0.021 18000 3693 1 17 . 1 1 7 7 ASN N N 206 118.380 118.380 122.135 -3.755 18000 3694 1 17 . 1 1 7 7 ASN HA H 206 4.760 4.760 4.677 0.083 18000 3695 1 17 . 1 1 7 7 ASN C C 206 173.810 173.810 177.047 -3.237 18000 3696 1 17 . 1 1 7 7 ASN CA C 206 51.430 51.430 54.190 -2.760 18000 3697 1 17 . 1 1 7 7 ASN CB C 206 37.090 37.090 38.307 -1.217 18000 3698 1 17 . 1 1 7 7 ASN H H 206 8.330 8.330 8.691 -0.361 18000 3699 1 17 . 1 1 8 8 THR N N 207 119.850 119.850 120.543 -0.693 18000 3700 1 17 . 1 1 8 8 THR HA H 207 4.270 4.270 4.031 0.239 18000 3701 1 17 . 1 1 8 8 THR C C 207 172.560 172.560 176.444 -3.884 18000 3702 1 17 . 1 1 8 8 THR CA C 207 60.420 60.420 65.442 -5.022 18000 3703 1 17 . 1 1 8 8 THR CB C 207 67.750 67.750 68.127 -0.377 18000 3704 1 17 . 1 1 8 8 THR H H 207 7.830 7.830 8.668 -0.838 18000 3705 1 17 . 1 1 9 9 ASP N N 208 121.180 121.180 117.320 3.860 18000 3706 1 17 . 1 1 9 9 ASP HA H 208 4.550 4.550 4.677 -0.127 18000 3707 1 17 . 1 1 9 9 ASP C C 208 174.170 174.170 176.475 -2.305 18000 3708 1 17 . 1 1 9 9 ASP CA C 208 52.670 52.670 58.211 -5.541 18000 3709 1 17 . 1 1 9 9 ASP CB C 208 39.120 39.120 38.056 1.064 18000 3710 1 17 . 1 1 9 9 ASP H H 208 8.350 8.350 8.764 -0.414 18000 3711 1 17 . 1 1 10 10 ASN HA H 209 4.600 4.600 4.465 0.135 18000 3712 1 17 . 1 1 10 10 ASN C C 209 173.670 173.670 177.504 -3.834 18000 3713 1 17 . 1 1 10 10 ASN CA C 209 52.110 52.110 56.200 -4.090 18000 3714 1 17 . 1 1 10 10 ASN CB C 209 36.730 36.730 37.997 -1.267 18000 3715 1 17 . 1 1 11 11 LYS N N 210 120.380 120.380 116.876 3.504 18000 3716 1 17 . 1 1 11 11 LYS HA H 210 4.270 4.270 4.029 0.241 18000 3717 1 17 . 1 1 11 11 LYS C C 210 174.910 174.910 178.846 -3.936 18000 3718 1 17 . 1 1 11 11 LYS CA C 210 54.900 54.900 60.400 -5.500 18000 3719 1 17 . 1 1 11 11 LYS CB C 210 30.670 30.670 32.189 -1.519 18000 3720 1 17 . 1 1 11 11 LYS H H 210 8.210 8.210 8.696 -0.486 18000 3721 1 17 . 1 1 12 12 GLU N N 211 120.740 120.740 120.442 0.298 18000 3722 1 17 . 1 1 12 12 GLU HA H 211 4.070 4.070 4.039 0.031 18000 3723 1 17 . 1 1 12 12 GLU C C 211 174.810 174.810 179.476 -4.666 18000 3724 1 17 . 1 1 12 12 GLU CA C 211 55.940 55.940 59.873 -3.933 18000 3725 1 17 . 1 1 12 12 GLU CB C 211 27.700 27.700 29.283 -1.583 18000 3726 1 17 . 1 1 12 12 GLU H H 211 8.380 8.380 7.939 0.441 18000 3727 1 17 . 1 1 13 13 TYR N N 212 119.430 119.430 118.527 0.903 18000 3728 1 17 . 1 1 13 13 TYR HA H 212 4.380 4.380 4.262 0.118 18000 3729 1 17 . 1 1 13 13 TYR C C 212 174.830 174.830 178.568 -3.738 18000 3730 1 17 . 1 1 13 13 TYR CA C 212 57.420 57.420 60.764 -3.344 18000 3731 1 17 . 1 1 13 13 TYR CB C 212 36.530 36.530 38.072 -1.542 18000 3732 1 17 . 1 1 13 13 TYR H H 212 7.940 7.940 8.546 -0.606 18000 3733 1 17 . 1 1 14 14 ALA N N 213 121.810 121.810 121.007 0.803 18000 3734 1 17 . 1 1 14 14 ALA HA H 213 4.260 4.260 4.041 0.219 18000 3735 1 17 . 1 1 14 14 ALA C C 213 176.630 176.630 179.432 -2.802 18000 3736 1 17 . 1 1 14 14 ALA CA C 213 51.990 51.990 55.246 -3.256 18000 3737 1 17 . 1 1 14 14 ALA CB C 213 16.450 16.450 18.703 -2.253 18000 3738 1 17 . 1 1 14 14 ALA H H 213 7.920 7.920 8.020 -0.100 18000 3739 1 17 . 1 1 15 15 VAL N N 214 121.430 121.430 119.109 2.321 18000 3740 1 17 . 1 1 15 15 VAL HA H 214 3.470 3.470 3.564 -0.094 18000 3741 1 17 . 1 1 15 15 VAL C C 214 174.980 174.980 177.761 -2.781 18000 3742 1 17 . 1 1 15 15 VAL CA C 214 64.190 64.190 66.404 -2.214 18000 3743 1 17 . 1 1 15 15 VAL CB C 214 29.820 29.820 31.206 -1.386 18000 3744 1 17 . 1 1 15 15 VAL H H 214 8.680 8.680 8.448 0.232 18000 3745 1 17 . 1 1 16 16 ASN N N 215 117.460 117.460 118.177 -0.717 18000 3746 1 17 . 1 1 16 16 ASN HA H 215 4.300 4.300 4.435 -0.135 18000 3747 1 17 . 1 1 16 16 ASN C C 215 176.320 176.320 177.195 -0.875 18000 3748 1 17 . 1 1 16 16 ASN CA C 215 54.190 54.190 55.869 -1.679 18000 3749 1 17 . 1 1 16 16 ASN CB C 215 35.360 35.360 37.633 -2.273 18000 3750 1 17 . 1 1 16 16 ASN H H 215 8.190 8.190 8.265 -0.075 18000 3751 1 17 . 1 1 17 17 GLU N N 216 119.430 119.430 117.768 1.662 18000 3752 1 17 . 1 1 17 17 GLU HA H 216 4.000 4.000 4.145 -0.145 18000 3753 1 17 . 1 1 17 17 GLU C C 216 177.240 177.240 178.955 -1.715 18000 3754 1 17 . 1 1 17 17 GLU CA C 216 57.180 57.180 58.818 -1.638 18000 3755 1 17 . 1 1 17 17 GLU CB C 216 28.400 28.400 29.099 -0.699 18000 3756 1 17 . 1 1 17 17 GLU H H 216 7.730 7.730 8.038 -0.308 18000 3757 1 17 . 1 1 18 18 VAL N N 217 120.690 120.690 119.086 1.604 18000 3758 1 17 . 1 1 18 18 VAL HA H 217 3.530 3.530 3.891 -0.361 18000 3759 1 17 . 1 1 18 18 VAL C C 217 174.990 174.990 178.378 -3.388 18000 3760 1 17 . 1 1 18 18 VAL CA C 217 64.310 64.310 64.983 -0.673 18000 3761 1 17 . 1 1 18 18 VAL CB C 217 29.640 29.640 31.207 -1.567 18000 3762 1 17 . 1 1 18 18 VAL H H 217 7.820 7.820 7.951 -0.131 18000 3763 1 17 . 1 1 19 19 VAL N N 218 117.010 117.010 114.681 2.329 18000 3764 1 17 . 1 1 19 19 VAL HA H 218 3.500 3.500 3.879 -0.379 18000 3765 1 17 . 1 1 19 19 VAL C C 218 175.200 175.200 176.551 -1.351 18000 3766 1 17 . 1 1 19 19 VAL CA C 218 64.960 64.960 64.971 -0.011 18000 3767 1 17 . 1 1 19 19 VAL CB C 218 29.710 29.710 31.628 -1.918 18000 3768 1 17 . 1 1 19 19 VAL H H 218 8.260 8.260 7.663 0.597 18000 3769 1 17 . 1 1 20 20 ALA N N 219 120.360 120.360 118.166 2.194 18000 3770 1 17 . 1 1 20 20 ALA HA H 219 3.930 3.930 4.367 -0.437 18000 3771 1 17 . 1 1 20 20 ALA C C 219 178.310 178.310 177.589 0.721 18000 3772 1 17 . 1 1 20 20 ALA CA C 219 53.040 53.040 51.369 1.671 18000 3773 1 17 . 1 1 20 20 ALA CB C 219 16.280 16.280 19.296 -3.016 18000 3774 1 17 . 1 1 20 20 ALA H H 219 7.490 7.490 7.328 0.162 18000 3775 1 17 . 1 1 21 21 GLY N N 220 124.250 124.250 108.983 15.267 18000 3776 1 17 . 1 1 21 21 GLY HA H 220 4.250 4.250 4.420 -0.170 18000 3777 1 17 . 1 1 21 21 GLY C C 220 172.880 172.880 174.809 -1.929 18000 3778 1 17 . 1 1 21 21 GLY CA C 220 44.130 44.130 43.685 0.445 18000 3779 1 17 . 1 1 21 21 GLY CB C 220 29.290 29.290 28.704 0.586 18000 3780 1 17 . 1 1 21 21 GLY H H 220 7.640 7.640 7.589 0.051 18000 3781 1 17 . 1 1 22 22 ILE N N 221 119.940 119.940 125.711 -5.771 18000 3782 1 17 . 1 1 22 22 ILE HA H 221 3.290 3.290 4.217 -0.927 18000 3783 1 17 . 1 1 22 22 ILE C C 221 175.100 175.100 174.608 0.492 18000 3784 1 17 . 1 1 22 22 ILE CA C 221 64.070 64.070 60.071 3.999 18000 3785 1 17 . 1 1 22 22 ILE CB C 221 35.260 35.260 37.602 -2.342 18000 3786 1 17 . 1 1 22 22 ILE H H 221 8.130 8.130 7.938 0.192 18000 3787 1 17 . 1 1 23 23 LYS HA H 222 3.430 3.430 4.374 -0.944 18000 3788 1 17 . 1 1 23 23 LYS C C 222 175.280 175.280 175.150 0.130 18000 3789 1 17 . 1 1 23 23 LYS CA C 222 59.270 59.270 56.632 2.638 18000 3790 1 17 . 1 1 23 23 LYS CB C 222 30.670 30.670 31.036 -0.366 18000 3791 1 17 . 1 1 24 24 GLU N N 223 116.150 116.150 120.347 -4.197 18000 3792 1 17 . 1 1 24 24 GLU HA H 223 4.150 4.150 4.555 -0.405 18000 3793 1 17 . 1 1 24 24 GLU C C 223 177.330 177.330 176.255 1.075 18000 3794 1 17 . 1 1 24 24 GLU CA C 223 57.180 57.180 54.961 2.219 18000 3795 1 17 . 1 1 24 24 GLU CB C 223 27.670 27.670 31.376 -3.706 18000 3796 1 17 . 1 1 24 24 GLU H H 223 7.830 7.830 8.159 -0.329 18000 3797 1 17 . 1 1 25 25 TYR N N 224 119.760 119.760 124.486 -4.726 18000 3798 1 17 . 1 1 25 25 TYR HA H 224 4.480 4.480 4.425 0.055 18000 3799 1 17 . 1 1 25 25 TYR C C 224 175.680 175.680 175.469 0.211 18000 3800 1 17 . 1 1 25 25 TYR CA C 224 57.520 57.520 58.438 -0.918 18000 3801 1 17 . 1 1 25 25 TYR CB C 224 36.940 36.940 39.067 -2.127 18000 3802 1 17 . 1 1 25 25 TYR H H 224 8.630 8.630 8.535 0.095 18000 3803 1 17 . 1 1 26 26 PHE N N 225 120.090 120.090 127.612 -7.522 18000 3804 1 17 . 1 1 26 26 PHE HA H 225 3.410 3.410 4.339 -0.929 18000 3805 1 17 . 1 1 26 26 PHE C C 225 173.930 173.930 175.084 -1.154 18000 3806 1 17 . 1 1 26 26 PHE CA C 225 61.600 61.600 59.071 2.529 18000 3807 1 17 . 1 1 26 26 PHE CB C 225 36.590 36.590 39.317 -2.727 18000 3808 1 17 . 1 1 26 26 PHE H H 225 9.220 9.220 8.602 0.618 18000 3809 1 17 . 1 1 27 27 ASN N N 226 115.010 115.010 124.566 -9.556 18000 3810 1 17 . 1 1 27 27 ASN HA H 226 4.470 4.470 4.809 -0.339 18000 3811 1 17 . 1 1 27 27 ASN C C 226 176.630 176.630 173.637 2.993 18000 3812 1 17 . 1 1 27 27 ASN CA C 226 54.160 54.160 51.462 2.698 18000 3813 1 17 . 1 1 27 27 ASN CB C 226 35.800 35.800 41.578 -5.778 18000 3814 1 17 . 1 1 27 27 ASN H H 226 8.210 8.210 8.185 0.025 18000 3815 1 17 . 1 1 28 28 VAL N N 227 115.120 115.120 121.605 -6.485 18000 3816 1 17 . 1 1 28 28 VAL HA H 227 4.300 4.300 4.288 0.012 18000 3817 1 17 . 1 1 28 28 VAL C C 227 174.960 174.960 173.972 0.988 18000 3818 1 17 . 1 1 28 28 VAL CA C 227 61.320 61.320 59.473 1.847 18000 3819 1 17 . 1 1 28 28 VAL CB C 227 30.670 30.670 32.169 -1.499 18000 3820 1 17 . 1 1 28 28 VAL H H 227 7.430 7.430 8.231 -0.801 18000 3821 1 17 . 1 1 29 29 MET HA H 228 4.000 4.000 4.489 -0.489 18000 3822 1 17 . 1 1 29 29 MET C C 228 176.270 176.270 175.828 0.442 18000 3823 1 17 . 1 1 29 29 MET CA C 228 54.030 54.030 54.991 -0.961 18000 3824 1 17 . 1 1 29 29 MET CB C 228 31.510 31.510 33.485 -1.975 18000 3825 1 17 . 1 1 30 30 LEU N N 229 122.180 122.180 123.928 -1.748 18000 3826 1 17 . 1 1 30 30 LEU HA H 229 3.150 3.150 4.120 -0.970 18000 3827 1 17 . 1 1 30 30 LEU C C 229 176.070 176.070 176.967 -0.897 18000 3828 1 17 . 1 1 30 30 LEU CA C 229 55.860 55.860 56.957 -1.097 18000 3829 1 17 . 1 1 30 30 LEU CB C 229 36.340 36.340 41.357 -5.017 18000 3830 1 17 . 1 1 30 30 LEU H H 229 7.890 7.890 8.541 -0.651 18000 3831 1 17 . 1 1 31 31 GLY N N 230 118.390 118.390 106.283 12.107 18000 3832 1 17 . 1 1 31 31 GLY HA H 230 4.090 4.090 4.231 -0.141 18000 3833 1 17 . 1 1 31 31 GLY C C 230 173.070 173.070 174.913 -1.843 18000 3834 1 17 . 1 1 31 31 GLY CA C 230 43.150 43.150 46.541 -3.391 18000 3835 1 17 . 1 1 31 31 GLY CB C 230 26.780 26.780 29.060 -2.280 18000 3836 1 17 . 1 1 31 31 GLY H H 230 8.350 8.350 8.769 -0.419 18000 3837 1 17 . 1 1 32 32 THR N N 231 124.790 124.790 113.477 11.313 18000 3838 1 17 . 1 1 32 32 THR HA H 231 4.280 4.280 4.419 -0.139 18000 3839 1 17 . 1 1 32 32 THR C C 231 173.260 173.260 175.983 -2.723 18000 3840 1 17 . 1 1 32 32 THR CA C 231 60.030 60.030 63.510 -3.479 18000 3841 1 17 . 1 1 32 32 THR CB C 231 68.540 68.540 69.931 -1.391 18000 3842 1 17 . 1 1 32 32 THR H H 231 7.040 7.040 7.883 -0.843 18000 3843 1 17 . 1 1 33 33 GLN N N 232 114.740 114.740 115.596 -0.856 18000 3844 1 17 . 1 1 33 33 GLN HA H 232 5.090 5.090 4.409 0.681 18000 3845 1 17 . 1 1 33 33 GLN C C 232 175.790 175.790 175.426 0.364 18000 3846 1 17 . 1 1 33 33 GLN CA C 232 53.650 53.650 55.871 -2.221 18000 3847 1 17 . 1 1 33 33 GLN CB C 232 30.520 30.520 30.217 0.303 18000 3848 1 17 . 1 1 33 33 GLN H H 232 8.110 8.110 8.360 -0.250 18000 3849 1 17 . 1 1 34 34 LEU N N 233 112.480 112.480 121.082 -8.602 18000 3850 1 17 . 1 1 34 34 LEU HA H 233 4.460 4.460 4.257 0.203 18000 3851 1 17 . 1 1 34 34 LEU C C 233 172.610 172.610 175.961 -3.351 18000 3852 1 17 . 1 1 34 34 LEU CA C 233 52.460 52.460 55.385 -2.925 18000 3853 1 17 . 1 1 34 34 LEU CB C 233 39.140 39.140 42.896 -3.756 18000 3854 1 17 . 1 1 34 34 LEU H H 233 6.980 6.980 8.499 -1.519 18000 3855 1 17 . 1 1 35 35 LEU N N 234 115.860 115.860 120.791 -4.931 18000 3856 1 17 . 1 1 35 35 LEU HA H 234 4.510 4.510 3.932 0.578 18000 3857 1 17 . 1 1 35 35 LEU C C 234 178.330 178.330 176.760 1.570 18000 3858 1 17 . 1 1 35 35 LEU CA C 234 51.900 51.900 57.107 -5.207 18000 3859 1 17 . 1 1 35 35 LEU CB C 234 40.950 40.950 40.478 0.472 18000 3860 1 17 . 1 1 35 35 LEU H H 234 7.560 7.560 7.792 -0.232 18000 3861 1 17 . 1 1 36 36 TYR N N 235 125.850 125.850 124.909 0.941 18000 3862 1 17 . 1 1 36 36 TYR HA H 235 4.790 4.790 4.599 0.191 18000 3863 1 17 . 1 1 36 36 TYR C C 235 176.260 176.260 173.726 2.534 18000 3864 1 17 . 1 1 36 36 TYR CA C 235 57.750 57.750 58.568 -0.818 18000 3865 1 17 . 1 1 36 36 TYR CB C 235 37.100 37.100 38.715 -1.615 18000 3866 1 17 . 1 1 36 36 TYR H H 235 9.750 9.750 8.306 1.444 18000 3867 1 17 . 1 1 37 37 LYS N N 236 123.880 123.880 126.683 -2.803 18000 3868 1 17 . 1 1 37 37 LYS HA H 236 3.930 3.930 4.740 -0.810 18000 3869 1 17 . 1 1 37 37 LYS C C 236 178.280 178.280 175.493 2.787 18000 3870 1 17 . 1 1 37 37 LYS CA C 236 59.210 59.210 55.665 3.545 18000 3871 1 17 . 1 1 37 37 LYS CB C 236 30.430 30.430 34.226 -3.796 18000 3872 1 17 . 1 1 37 37 LYS H H 236 9.340 9.340 8.426 0.914 18000 3873 1 17 . 1 1 38 38 PHE N N 237 117.150 117.150 125.072 -7.922 18000 3874 1 17 . 1 1 38 38 PHE HA H 237 4.460 4.460 4.702 -0.242 18000 3875 1 17 . 1 1 38 38 PHE C C 237 173.930 173.930 175.420 -1.490 18000 3876 1 17 . 1 1 38 38 PHE CA C 237 58.510 58.510 56.673 1.837 18000 3877 1 17 . 1 1 38 38 PHE CB C 237 38.370 38.370 39.145 -0.776 18000 3878 1 17 . 1 1 38 38 PHE H H 237 9.120 9.120 8.515 0.605 18000 3879 1 17 . 1 1 39 39 GLU HA H 238 4.160 4.160 4.337 -0.177 18000 3880 1 17 . 1 1 39 39 GLU C C 238 175.650 175.650 176.636 -0.986 18000 3881 1 17 . 1 1 39 39 GLU CA C 238 55.070 55.070 56.564 -1.494 18000 3882 1 17 . 1 1 39 39 GLU CB C 238 31.540 31.540 30.454 1.086 18000 3883 1 17 . 1 1 40 40 ARG N N 239 120.330 120.330 121.210 -0.880 18000 3884 1 17 . 1 1 40 40 ARG HA H 239 4.250 4.250 4.152 0.098 18000 3885 1 17 . 1 1 40 40 ARG C C 239 174.490 174.490 175.265 -0.775 18000 3886 1 17 . 1 1 40 40 ARG CA C 239 60.410 60.410 55.542 4.868 18000 3887 1 17 . 1 1 40 40 ARG H H 239 7.980 7.980 8.209 -0.229 18000 3888 1 17 . 1 1 41 41 PRO N N 240 115.390 115.390 115.935 -0.545 18000 3889 1 17 . 1 1 41 41 PRO HA H 240 4.360 4.360 4.654 -0.294 18000 3890 1 17 . 1 1 41 41 PRO C C 240 176.330 176.330 175.986 0.344 18000 3891 1 17 . 1 1 41 41 PRO CA C 240 64.400 64.400 62.636 1.764 18000 3892 1 17 . 1 1 41 41 PRO CB C 240 62.240 62.240 64.463 -2.223 18000 3893 1 17 . 1 1 41 41 PRO H H 240 8.090 8.090 8.279 -0.189 18000 3894 1 18 . 1 1 2 2 ARG N N 201 119.330 119.330 120.351 -1.021 18000 3895 1 18 . 1 1 2 2 ARG HA H 201 3.560 3.560 4.745 -1.185 18000 3896 1 18 . 1 1 2 2 ARG C C 201 176.850 176.850 173.782 3.068 18000 3897 1 18 . 1 1 2 2 ARG CA C 201 55.340 55.340 54.494 0.846 18000 3898 1 18 . 1 1 2 2 ARG CB C 201 27.020 27.020 31.725 -4.705 18000 3899 1 18 . 1 1 2 2 ARG H H 201 8.370 8.370 7.838 0.532 18000 3900 1 18 . 1 1 3 3 LYS N N 202 118.540 118.540 123.910 -5.370 18000 3901 1 18 . 1 1 3 3 LYS HA H 202 4.010 4.010 4.425 -0.415 18000 3902 1 18 . 1 1 3 3 LYS C C 202 176.090 176.090 175.421 0.669 18000 3903 1 18 . 1 1 3 3 LYS CA C 202 56.960 56.960 55.481 1.478 18000 3904 1 18 . 1 1 3 3 LYS CB C 202 30.590 30.590 34.652 -4.062 18000 3905 1 18 . 1 1 3 3 LYS H H 202 7.940 7.940 8.412 -0.472 18000 3906 1 18 . 1 1 4 4 SER N N 203 113.880 113.880 123.191 -9.311 18000 3907 1 18 . 1 1 4 4 SER HA H 203 4.320 4.320 4.816 -0.496 18000 3908 1 18 . 1 1 4 4 SER C C 203 172.900 172.900 172.818 0.082 18000 3909 1 18 . 1 1 4 4 SER CA C 203 57.870 57.870 56.241 1.629 18000 3910 1 18 . 1 1 4 4 SER CB C 203 61.700 61.700 63.587 -1.887 18000 3911 1 18 . 1 1 4 4 SER H H 203 7.700 7.700 8.395 -0.695 18000 3912 1 18 . 1 1 5 5 ARG HA H 204 4.240 4.240 4.360 -0.120 18000 3913 1 18 . 1 1 5 5 ARG C C 204 174.810 174.810 174.262 0.548 18000 3914 1 18 . 1 1 5 5 ARG CA C 204 54.270 54.270 55.985 -1.715 18000 3915 1 18 . 1 1 5 5 ARG CB C 204 28.700 28.700 31.073 -2.373 18000 3916 1 18 . 1 1 6 6 GLY N N 205 125.950 125.950 109.467 16.483 18000 3917 1 18 . 1 1 6 6 GLY HA H 205 4.400 4.400 4.483 -0.083 18000 3918 1 18 . 1 1 6 6 GLY C C 205 171.910 171.910 174.398 -2.488 18000 3919 1 18 . 1 1 6 6 GLY CA C 205 43.570 43.570 44.306 -0.736 18000 3920 1 18 . 1 1 6 6 GLY CB C 205 28.340 28.340 30.796 -2.455 18000 3921 1 18 . 1 1 6 6 GLY H H 205 7.930 7.930 8.308 -0.378 18000 3922 1 18 . 1 1 7 7 ASN N N 206 118.380 118.380 122.900 -4.520 18000 3923 1 18 . 1 1 7 7 ASN HA H 206 4.760 4.760 4.620 0.140 18000 3924 1 18 . 1 1 7 7 ASN C C 206 173.810 173.810 177.186 -3.376 18000 3925 1 18 . 1 1 7 7 ASN CA C 206 51.430 51.430 53.849 -2.419 18000 3926 1 18 . 1 1 7 7 ASN CB C 206 37.090 37.090 37.360 -0.270 18000 3927 1 18 . 1 1 7 7 ASN H H 206 8.330 8.330 8.876 -0.546 18000 3928 1 18 . 1 1 8 8 THR N N 207 119.850 119.850 120.720 -0.870 18000 3929 1 18 . 1 1 8 8 THR HA H 207 4.270 4.270 4.081 0.189 18000 3930 1 18 . 1 1 8 8 THR C C 207 172.560 172.560 176.382 -3.822 18000 3931 1 18 . 1 1 8 8 THR CA C 207 60.420 60.420 65.424 -5.004 18000 3932 1 18 . 1 1 8 8 THR CB C 207 67.750 67.750 68.250 -0.500 18000 3933 1 18 . 1 1 8 8 THR H H 207 7.830 7.830 8.631 -0.801 18000 3934 1 18 . 1 1 9 9 ASP N N 208 121.180 121.180 117.471 3.709 18000 3935 1 18 . 1 1 9 9 ASP HA H 208 4.550 4.550 4.652 -0.102 18000 3936 1 18 . 1 1 9 9 ASP C C 208 174.170 174.170 176.323 -2.153 18000 3937 1 18 . 1 1 9 9 ASP CA C 208 52.670 52.670 57.964 -5.294 18000 3938 1 18 . 1 1 9 9 ASP CB C 208 39.120 39.120 38.011 1.109 18000 3939 1 18 . 1 1 9 9 ASP H H 208 8.350 8.350 8.673 -0.323 18000 3940 1 18 . 1 1 10 10 ASN HA H 209 4.600 4.600 4.444 0.156 18000 3941 1 18 . 1 1 10 10 ASN C C 209 173.670 173.670 177.525 -3.855 18000 3942 1 18 . 1 1 10 10 ASN CA C 209 52.110 52.110 56.222 -4.112 18000 3943 1 18 . 1 1 10 10 ASN CB C 209 36.730 36.730 37.925 -1.195 18000 3944 1 18 . 1 1 11 11 LYS N N 210 120.380 120.380 117.240 3.140 18000 3945 1 18 . 1 1 11 11 LYS HA H 210 4.270 4.270 3.989 0.281 18000 3946 1 18 . 1 1 11 11 LYS C C 210 174.910 174.910 178.943 -4.033 18000 3947 1 18 . 1 1 11 11 LYS CA C 210 54.900 54.900 59.735 -4.835 18000 3948 1 18 . 1 1 11 11 LYS CB C 210 30.670 30.670 31.814 -1.144 18000 3949 1 18 . 1 1 11 11 LYS H H 210 8.210 8.210 8.680 -0.470 18000 3950 1 18 . 1 1 12 12 GLU N N 211 120.740 120.740 119.904 0.836 18000 3951 1 18 . 1 1 12 12 GLU HA H 211 4.070 4.070 4.045 0.025 18000 3952 1 18 . 1 1 12 12 GLU C C 211 174.810 174.810 179.627 -4.817 18000 3953 1 18 . 1 1 12 12 GLU CA C 211 55.940 55.940 59.681 -3.741 18000 3954 1 18 . 1 1 12 12 GLU CB C 211 27.700 27.700 29.198 -1.498 18000 3955 1 18 . 1 1 12 12 GLU H H 211 8.380 8.380 7.942 0.438 18000 3956 1 18 . 1 1 13 13 TYR N N 212 119.430 119.430 119.078 0.352 18000 3957 1 18 . 1 1 13 13 TYR HA H 212 4.380 4.380 4.246 0.134 18000 3958 1 18 . 1 1 13 13 TYR C C 212 174.830 174.830 178.489 -3.659 18000 3959 1 18 . 1 1 13 13 TYR CA C 212 57.420 57.420 60.944 -3.523 18000 3960 1 18 . 1 1 13 13 TYR CB C 212 36.530 36.530 38.142 -1.612 18000 3961 1 18 . 1 1 13 13 TYR H H 212 7.940 7.940 8.461 -0.521 18000 3962 1 18 . 1 1 14 14 ALA N N 213 121.810 121.810 120.584 1.226 18000 3963 1 18 . 1 1 14 14 ALA HA H 213 4.260 4.260 4.056 0.204 18000 3964 1 18 . 1 1 14 14 ALA C C 213 176.630 176.630 179.614 -2.984 18000 3965 1 18 . 1 1 14 14 ALA CA C 213 51.990 51.990 55.307 -3.317 18000 3966 1 18 . 1 1 14 14 ALA CB C 213 16.450 16.450 18.833 -2.383 18000 3967 1 18 . 1 1 14 14 ALA H H 213 7.920 7.920 8.230 -0.310 18000 3968 1 18 . 1 1 15 15 VAL N N 214 121.430 121.430 119.398 2.032 18000 3969 1 18 . 1 1 15 15 VAL HA H 214 3.470 3.470 3.536 -0.066 18000 3970 1 18 . 1 1 15 15 VAL C C 214 174.980 174.980 177.744 -2.764 18000 3971 1 18 . 1 1 15 15 VAL CA C 214 64.190 64.190 66.629 -2.439 18000 3972 1 18 . 1 1 15 15 VAL CB C 214 29.820 29.820 31.270 -1.450 18000 3973 1 18 . 1 1 15 15 VAL H H 214 8.680 8.680 8.742 -0.062 18000 3974 1 18 . 1 1 16 16 ASN N N 215 117.460 117.460 117.950 -0.490 18000 3975 1 18 . 1 1 16 16 ASN HA H 215 4.300 4.300 4.434 -0.134 18000 3976 1 18 . 1 1 16 16 ASN C C 215 176.320 176.320 177.312 -0.992 18000 3977 1 18 . 1 1 16 16 ASN CA C 215 54.190 54.190 55.848 -1.658 18000 3978 1 18 . 1 1 16 16 ASN CB C 215 35.360 35.360 37.630 -2.270 18000 3979 1 18 . 1 1 16 16 ASN H H 215 8.190 8.190 8.342 -0.152 18000 3980 1 18 . 1 1 17 17 GLU N N 216 119.430 119.430 117.723 1.707 18000 3981 1 18 . 1 1 17 17 GLU HA H 216 4.000 4.000 4.110 -0.110 18000 3982 1 18 . 1 1 17 17 GLU C C 216 177.240 177.240 178.141 -0.901 18000 3983 1 18 . 1 1 17 17 GLU CA C 216 57.180 57.180 58.983 -1.803 18000 3984 1 18 . 1 1 17 17 GLU CB C 216 28.400 28.400 29.214 -0.814 18000 3985 1 18 . 1 1 17 17 GLU H H 216 7.730 7.730 8.181 -0.451 18000 3986 1 18 . 1 1 18 18 VAL N N 217 120.690 120.690 117.568 3.122 18000 3987 1 18 . 1 1 18 18 VAL HA H 217 3.530 3.530 3.892 -0.362 18000 3988 1 18 . 1 1 18 18 VAL C C 217 174.990 174.990 178.668 -3.678 18000 3989 1 18 . 1 1 18 18 VAL CA C 217 64.310 64.310 64.942 -0.632 18000 3990 1 18 . 1 1 18 18 VAL CB C 217 29.640 29.640 31.154 -1.514 18000 3991 1 18 . 1 1 18 18 VAL H H 217 7.820 7.820 8.054 -0.234 18000 3992 1 18 . 1 1 19 19 VAL N N 218 117.010 117.010 114.551 2.459 18000 3993 1 18 . 1 1 19 19 VAL HA H 218 3.500 3.500 3.881 -0.381 18000 3994 1 18 . 1 1 19 19 VAL C C 218 175.200 175.200 176.407 -1.207 18000 3995 1 18 . 1 1 19 19 VAL CA C 218 64.960 64.960 64.853 0.107 18000 3996 1 18 . 1 1 19 19 VAL CB C 218 29.710 29.710 31.828 -2.118 18000 3997 1 18 . 1 1 19 19 VAL H H 218 8.260 8.260 7.733 0.527 18000 3998 1 18 . 1 1 20 20 ALA N N 219 120.360 120.360 118.682 1.678 18000 3999 1 18 . 1 1 20 20 ALA HA H 219 3.930 3.930 4.401 -0.471 18000 4000 1 18 . 1 1 20 20 ALA C C 219 178.310 178.310 177.206 1.104 18000 4001 1 18 . 1 1 20 20 ALA CA C 219 53.040 53.040 50.696 2.344 18000 4002 1 18 . 1 1 20 20 ALA CB C 219 16.280 16.280 18.691 -2.411 18000 4003 1 18 . 1 1 20 20 ALA H H 219 7.490 7.490 7.338 0.152 18000 4004 1 18 . 1 1 21 21 GLY N N 220 124.250 124.250 108.525 15.725 18000 4005 1 18 . 1 1 21 21 GLY HA H 220 4.250 4.250 4.460 -0.210 18000 4006 1 18 . 1 1 21 21 GLY C C 220 172.880 172.880 174.782 -1.902 18000 4007 1 18 . 1 1 21 21 GLY CA C 220 44.130 44.130 43.903 0.227 18000 4008 1 18 . 1 1 21 21 GLY CB C 220 29.290 29.290 29.237 0.053 18000 4009 1 18 . 1 1 21 21 GLY H H 220 7.640 7.640 7.362 0.278 18000 4010 1 18 . 1 1 22 22 ILE N N 221 119.940 119.940 126.287 -6.347 18000 4011 1 18 . 1 1 22 22 ILE HA H 221 3.290 3.290 4.277 -0.987 18000 4012 1 18 . 1 1 22 22 ILE C C 221 175.100 175.100 174.554 0.546 18000 4013 1 18 . 1 1 22 22 ILE CA C 221 64.070 64.070 60.471 3.599 18000 4014 1 18 . 1 1 22 22 ILE CB C 221 35.260 35.260 37.683 -2.423 18000 4015 1 18 . 1 1 22 22 ILE H H 221 8.130 8.130 8.120 0.010 18000 4016 1 18 . 1 1 23 23 LYS HA H 222 3.430 3.430 4.407 -0.977 18000 4017 1 18 . 1 1 23 23 LYS C C 222 175.280 175.280 175.512 -0.232 18000 4018 1 18 . 1 1 23 23 LYS CA C 222 59.270 59.270 56.819 2.451 18000 4019 1 18 . 1 1 23 23 LYS CB C 222 30.670 30.670 31.076 -0.406 18000 4020 1 18 . 1 1 24 24 GLU N N 223 116.150 116.150 119.082 -2.932 18000 4021 1 18 . 1 1 24 24 GLU HA H 223 4.150 4.150 4.295 -0.145 18000 4022 1 18 . 1 1 24 24 GLU C C 223 177.330 177.330 176.127 1.203 18000 4023 1 18 . 1 1 24 24 GLU CA C 223 57.180 57.180 55.305 1.875 18000 4024 1 18 . 1 1 24 24 GLU CB C 223 27.670 27.670 30.190 -2.520 18000 4025 1 18 . 1 1 24 24 GLU H H 223 7.830 7.830 8.216 -0.386 18000 4026 1 18 . 1 1 25 25 TYR N N 224 119.760 119.760 119.773 -0.013 18000 4027 1 18 . 1 1 25 25 TYR HA H 224 4.480 4.480 4.382 0.098 18000 4028 1 18 . 1 1 25 25 TYR C C 224 175.680 175.680 174.259 1.421 18000 4029 1 18 . 1 1 25 25 TYR CA C 224 57.520 57.520 58.187 -0.667 18000 4030 1 18 . 1 1 25 25 TYR CB C 224 36.940 36.940 39.417 -2.477 18000 4031 1 18 . 1 1 25 25 TYR H H 224 8.630 8.630 7.908 0.722 18000 4032 1 18 . 1 1 26 26 PHE N N 225 120.090 120.090 124.400 -4.310 18000 4033 1 18 . 1 1 26 26 PHE HA H 225 3.410 3.410 4.606 -1.196 18000 4034 1 18 . 1 1 26 26 PHE C C 225 173.930 173.930 175.033 -1.103 18000 4035 1 18 . 1 1 26 26 PHE CA C 225 61.600 61.600 58.354 3.246 18000 4036 1 18 . 1 1 26 26 PHE CB C 225 36.590 36.590 38.820 -2.230 18000 4037 1 18 . 1 1 26 26 PHE H H 225 9.220 9.220 8.595 0.625 18000 4038 1 18 . 1 1 27 27 ASN N N 226 115.010 115.010 123.906 -8.896 18000 4039 1 18 . 1 1 27 27 ASN HA H 226 4.470 4.470 5.007 -0.537 18000 4040 1 18 . 1 1 27 27 ASN C C 226 176.630 176.630 173.044 3.586 18000 4041 1 18 . 1 1 27 27 ASN CA C 226 54.160 54.160 51.285 2.875 18000 4042 1 18 . 1 1 27 27 ASN CB C 226 35.800 35.800 41.234 -5.434 18000 4043 1 18 . 1 1 27 27 ASN H H 226 8.210 8.210 8.350 -0.140 18000 4044 1 18 . 1 1 28 28 VAL N N 227 115.120 115.120 120.255 -5.135 18000 4045 1 18 . 1 1 28 28 VAL HA H 227 4.300 4.300 4.418 -0.118 18000 4046 1 18 . 1 1 28 28 VAL C C 227 174.960 174.960 174.380 0.580 18000 4047 1 18 . 1 1 28 28 VAL CA C 227 61.320 61.320 59.446 1.874 18000 4048 1 18 . 1 1 28 28 VAL CB C 227 30.670 30.670 31.880 -1.210 18000 4049 1 18 . 1 1 28 28 VAL H H 227 7.430 7.430 8.355 -0.925 18000 4050 1 18 . 1 1 29 29 MET HA H 228 4.000 4.000 4.489 -0.489 18000 4051 1 18 . 1 1 29 29 MET C C 228 176.270 176.270 176.554 -0.284 18000 4052 1 18 . 1 1 29 29 MET CA C 228 54.030 54.030 55.050 -1.020 18000 4053 1 18 . 1 1 29 29 MET CB C 228 31.510 31.510 33.164 -1.654 18000 4054 1 18 . 1 1 30 30 LEU N N 229 122.180 122.180 122.245 -0.065 18000 4055 1 18 . 1 1 30 30 LEU HA H 229 3.150 3.150 4.012 -0.862 18000 4056 1 18 . 1 1 30 30 LEU C C 229 176.070 176.070 177.470 -1.400 18000 4057 1 18 . 1 1 30 30 LEU CA C 229 55.860 55.860 57.478 -1.619 18000 4058 1 18 . 1 1 30 30 LEU CB C 229 36.340 36.340 41.428 -5.088 18000 4059 1 18 . 1 1 30 30 LEU H H 229 7.890 7.890 8.731 -0.841 18000 4060 1 18 . 1 1 31 31 GLY N N 230 118.390 118.390 106.944 11.446 18000 4061 1 18 . 1 1 31 31 GLY HA H 230 4.090 4.090 4.186 -0.096 18000 4062 1 18 . 1 1 31 31 GLY C C 230 173.070 173.070 174.719 -1.649 18000 4063 1 18 . 1 1 31 31 GLY CA C 230 43.150 43.150 46.710 -3.560 18000 4064 1 18 . 1 1 31 31 GLY CB C 230 26.780 26.780 28.657 -1.877 18000 4065 1 18 . 1 1 31 31 GLY H H 230 8.350 8.350 8.233 0.117 18000 4066 1 18 . 1 1 32 32 THR N N 231 124.790 124.790 113.578 11.212 18000 4067 1 18 . 1 1 32 32 THR HA H 231 4.280 4.280 4.434 -0.154 18000 4068 1 18 . 1 1 32 32 THR C C 231 173.260 173.260 176.197 -2.937 18000 4069 1 18 . 1 1 32 32 THR CA C 231 60.030 60.030 63.625 -3.595 18000 4070 1 18 . 1 1 32 32 THR CB C 231 68.540 68.540 69.932 -1.392 18000 4071 1 18 . 1 1 32 32 THR H H 231 7.040 7.040 7.977 -0.937 18000 4072 1 18 . 1 1 33 33 GLN N N 232 114.740 114.740 115.869 -1.129 18000 4073 1 18 . 1 1 33 33 GLN HA H 232 5.090 5.090 4.394 0.696 18000 4074 1 18 . 1 1 33 33 GLN C C 232 175.790 175.790 175.436 0.354 18000 4075 1 18 . 1 1 33 33 GLN CA C 232 53.650 53.650 56.223 -2.573 18000 4076 1 18 . 1 1 33 33 GLN CB C 232 30.520 30.520 30.046 0.474 18000 4077 1 18 . 1 1 33 33 GLN H H 232 8.110 8.110 8.474 -0.364 18000 4078 1 18 . 1 1 34 34 LEU N N 233 112.480 112.480 119.779 -7.299 18000 4079 1 18 . 1 1 34 34 LEU HA H 233 4.460 4.460 4.355 0.105 18000 4080 1 18 . 1 1 34 34 LEU C C 233 172.610 172.610 175.548 -2.938 18000 4081 1 18 . 1 1 34 34 LEU CA C 233 52.460 52.460 55.355 -2.895 18000 4082 1 18 . 1 1 34 34 LEU CB C 233 39.140 39.140 43.765 -4.625 18000 4083 1 18 . 1 1 34 34 LEU H H 233 6.980 6.980 7.849 -0.869 18000 4084 1 18 . 1 1 35 35 LEU N N 234 115.860 115.860 121.760 -5.900 18000 4085 1 18 . 1 1 35 35 LEU HA H 234 4.510 4.510 4.141 0.369 18000 4086 1 18 . 1 1 35 35 LEU C C 234 178.330 178.330 176.294 2.036 18000 4087 1 18 . 1 1 35 35 LEU CA C 234 51.900 51.900 56.070 -4.170 18000 4088 1 18 . 1 1 35 35 LEU CB C 234 40.950 40.950 41.763 -0.813 18000 4089 1 18 . 1 1 35 35 LEU H H 234 7.560 7.560 8.150 -0.590 18000 4090 1 18 . 1 1 36 36 TYR N N 235 125.850 125.850 118.340 7.510 18000 4091 1 18 . 1 1 36 36 TYR HA H 235 4.790 4.790 4.353 0.437 18000 4092 1 18 . 1 1 36 36 TYR C C 235 176.260 176.260 176.071 0.189 18000 4093 1 18 . 1 1 36 36 TYR CA C 235 57.750 57.750 58.916 -1.166 18000 4094 1 18 . 1 1 36 36 TYR CB C 235 37.100 37.100 38.555 -1.455 18000 4095 1 18 . 1 1 36 36 TYR H H 235 9.750 9.750 8.183 1.567 18000 4096 1 18 . 1 1 37 37 LYS N N 236 123.880 123.880 122.430 1.450 18000 4097 1 18 . 1 1 37 37 LYS HA H 236 3.930 3.930 4.284 -0.354 18000 4098 1 18 . 1 1 37 37 LYS C C 236 178.280 178.280 175.355 2.925 18000 4099 1 18 . 1 1 37 37 LYS CA C 236 59.210 59.210 55.969 3.241 18000 4100 1 18 . 1 1 37 37 LYS CB C 236 30.430 30.430 32.408 -1.978 18000 4101 1 18 . 1 1 37 37 LYS H H 236 9.340 9.340 7.953 1.387 18000 4102 1 18 . 1 1 38 38 PHE N N 237 117.150 117.150 124.468 -7.318 18000 4103 1 18 . 1 1 38 38 PHE HA H 237 4.460 4.460 4.939 -0.479 18000 4104 1 18 . 1 1 38 38 PHE C C 237 173.930 173.930 174.420 -0.490 18000 4105 1 18 . 1 1 38 38 PHE CA C 237 58.510 58.510 54.616 3.894 18000 4106 1 18 . 1 1 38 38 PHE CB C 237 38.370 38.370 40.821 -2.450 18000 4107 1 18 . 1 1 38 38 PHE H H 237 9.120 9.120 8.437 0.683 18000 4108 1 18 . 1 1 39 39 GLU HA H 238 4.160 4.160 4.434 -0.274 18000 4109 1 18 . 1 1 39 39 GLU C C 238 175.650 175.650 176.704 -1.054 18000 4110 1 18 . 1 1 39 39 GLU CA C 238 55.070 55.070 56.326 -1.256 18000 4111 1 18 . 1 1 39 39 GLU CB C 238 31.540 31.540 30.669 0.871 18000 4112 1 18 . 1 1 40 40 ARG N N 239 120.330 120.330 122.562 -2.232 18000 4113 1 18 . 1 1 40 40 ARG HA H 239 4.250 4.250 4.169 0.081 18000 4114 1 18 . 1 1 40 40 ARG C C 239 174.490 174.490 175.066 -0.576 18000 4115 1 18 . 1 1 40 40 ARG CA C 239 60.410 60.410 55.849 4.561 18000 4116 1 18 . 1 1 40 40 ARG H H 239 7.980 7.980 8.628 -0.648 18000 4117 1 18 . 1 1 41 41 PRO N N 240 115.390 115.390 116.842 -1.452 18000 4118 1 18 . 1 1 41 41 PRO HA H 240 4.360 4.360 4.688 -0.328 18000 4119 1 18 . 1 1 41 41 PRO C C 240 176.330 176.330 176.305 0.025 18000 4120 1 18 . 1 1 41 41 PRO CA C 240 64.400 64.400 63.090 1.310 18000 4121 1 18 . 1 1 41 41 PRO CB C 240 62.240 62.240 64.938 -2.698 18000 4122 1 18 . 1 1 41 41 PRO H H 240 8.090 8.090 8.323 -0.233 18000 4123 1 19 . 1 1 2 2 ARG N N 201 119.330 119.330 123.448 -4.118 18000 4124 1 19 . 1 1 2 2 ARG HA H 201 3.560 3.560 4.596 -1.036 18000 4125 1 19 . 1 1 2 2 ARG C C 201 176.850 176.850 174.886 1.964 18000 4126 1 19 . 1 1 2 2 ARG CA C 201 55.340 55.340 56.265 -0.925 18000 4127 1 19 . 1 1 2 2 ARG CB C 201 27.020 27.020 32.537 -5.517 18000 4128 1 19 . 1 1 2 2 ARG H H 201 8.370 8.370 8.294 0.076 18000 4129 1 19 . 1 1 3 3 LYS N N 202 118.540 118.540 127.621 -9.081 18000 4130 1 19 . 1 1 3 3 LYS HA H 202 4.010 4.010 4.140 -0.130 18000 4131 1 19 . 1 1 3 3 LYS C C 202 176.090 176.090 176.615 -0.525 18000 4132 1 19 . 1 1 3 3 LYS CA C 202 56.960 56.960 56.383 0.577 18000 4133 1 19 . 1 1 3 3 LYS CB C 202 30.590 30.590 32.518 -1.928 18000 4134 1 19 . 1 1 3 3 LYS H H 202 7.940 7.940 8.054 -0.114 18000 4135 1 19 . 1 1 4 4 SER N N 203 113.880 113.880 123.847 -9.967 18000 4136 1 19 . 1 1 4 4 SER HA H 203 4.320 4.320 4.689 -0.368 18000 4137 1 19 . 1 1 4 4 SER C C 203 172.900 172.900 173.205 -0.305 18000 4138 1 19 . 1 1 4 4 SER CA C 203 57.870 57.870 56.549 1.321 18000 4139 1 19 . 1 1 4 4 SER CB C 203 61.700 61.700 62.468 -0.768 18000 4140 1 19 . 1 1 4 4 SER H H 203 7.700 7.700 8.523 -0.823 18000 4141 1 19 . 1 1 5 5 ARG HA H 204 4.240 4.240 4.294 -0.054 18000 4142 1 19 . 1 1 5 5 ARG C C 204 174.810 174.810 175.039 -0.229 18000 4143 1 19 . 1 1 5 5 ARG CA C 204 54.270 54.270 55.810 -1.540 18000 4144 1 19 . 1 1 5 5 ARG CB C 204 28.700 28.700 30.923 -2.223 18000 4145 1 19 . 1 1 6 6 GLY N N 205 125.950 125.950 108.139 17.811 18000 4146 1 19 . 1 1 6 6 GLY HA H 205 4.400 4.400 4.381 0.019 18000 4147 1 19 . 1 1 6 6 GLY C C 205 171.910 171.910 174.871 -2.961 18000 4148 1 19 . 1 1 6 6 GLY CA C 205 43.570 43.570 45.018 -1.448 18000 4149 1 19 . 1 1 6 6 GLY CB C 205 28.340 28.340 29.175 -0.835 18000 4150 1 19 . 1 1 6 6 GLY H H 205 7.930 7.930 8.415 -0.485 18000 4151 1 19 . 1 1 7 7 ASN N N 206 118.380 118.380 122.007 -3.627 18000 4152 1 19 . 1 1 7 7 ASN HA H 206 4.760 4.760 4.741 0.019 18000 4153 1 19 . 1 1 7 7 ASN C C 206 173.810 173.810 177.562 -3.752 18000 4154 1 19 . 1 1 7 7 ASN CA C 206 51.430 51.430 54.218 -2.788 18000 4155 1 19 . 1 1 7 7 ASN CB C 206 37.090 37.090 38.491 -1.401 18000 4156 1 19 . 1 1 7 7 ASN H H 206 8.330 8.330 8.805 -0.475 18000 4157 1 19 . 1 1 8 8 THR N N 207 119.850 119.850 121.395 -1.545 18000 4158 1 19 . 1 1 8 8 THR HA H 207 4.270 4.270 4.212 0.058 18000 4159 1 19 . 1 1 8 8 THR C C 207 172.560 172.560 176.776 -4.216 18000 4160 1 19 . 1 1 8 8 THR CA C 207 60.420 60.420 65.365 -4.945 18000 4161 1 19 . 1 1 8 8 THR CB C 207 67.750 67.750 68.186 -0.436 18000 4162 1 19 . 1 1 8 8 THR H H 207 7.830 7.830 8.458 -0.628 18000 4163 1 19 . 1 1 9 9 ASP N N 208 121.180 121.180 118.421 2.759 18000 4164 1 19 . 1 1 9 9 ASP HA H 208 4.550 4.550 4.822 -0.272 18000 4165 1 19 . 1 1 9 9 ASP C C 208 174.170 174.170 175.859 -1.689 18000 4166 1 19 . 1 1 9 9 ASP CA C 208 52.670 52.670 58.573 -5.903 18000 4167 1 19 . 1 1 9 9 ASP CB C 208 39.120 39.120 38.255 0.865 18000 4168 1 19 . 1 1 9 9 ASP H H 208 8.350 8.350 8.787 -0.437 18000 4169 1 19 . 1 1 10 10 ASN HA H 209 4.600 4.600 4.459 0.141 18000 4170 1 19 . 1 1 10 10 ASN C C 209 173.670 173.670 177.437 -3.767 18000 4171 1 19 . 1 1 10 10 ASN CA C 209 52.110 52.110 56.195 -4.085 18000 4172 1 19 . 1 1 10 10 ASN CB C 209 36.730 36.730 37.932 -1.202 18000 4173 1 19 . 1 1 11 11 LYS N N 210 120.380 120.380 117.635 2.745 18000 4174 1 19 . 1 1 11 11 LYS HA H 210 4.270 4.270 3.996 0.274 18000 4175 1 19 . 1 1 11 11 LYS C C 210 174.910 174.910 178.827 -3.917 18000 4176 1 19 . 1 1 11 11 LYS CA C 210 54.900 54.900 60.090 -5.190 18000 4177 1 19 . 1 1 11 11 LYS CB C 210 30.670 30.670 32.099 -1.429 18000 4178 1 19 . 1 1 11 11 LYS H H 210 8.210 8.210 8.397 -0.187 18000 4179 1 19 . 1 1 12 12 GLU N N 211 120.740 120.740 120.704 0.036 18000 4180 1 19 . 1 1 12 12 GLU HA H 211 4.070 4.070 3.993 0.077 18000 4181 1 19 . 1 1 12 12 GLU C C 211 174.810 174.810 179.335 -4.525 18000 4182 1 19 . 1 1 12 12 GLU CA C 211 55.940 55.940 60.004 -4.064 18000 4183 1 19 . 1 1 12 12 GLU CB C 211 27.700 27.700 29.559 -1.859 18000 4184 1 19 . 1 1 12 12 GLU H H 211 8.380 8.380 8.567 -0.187 18000 4185 1 19 . 1 1 13 13 TYR N N 212 119.430 119.430 118.862 0.568 18000 4186 1 19 . 1 1 13 13 TYR HA H 212 4.380 4.380 4.221 0.159 18000 4187 1 19 . 1 1 13 13 TYR C C 212 174.830 174.830 178.398 -3.568 18000 4188 1 19 . 1 1 13 13 TYR CA C 212 57.420 57.420 61.010 -3.590 18000 4189 1 19 . 1 1 13 13 TYR CB C 212 36.530 36.530 38.023 -1.494 18000 4190 1 19 . 1 1 13 13 TYR H H 212 7.940 7.940 8.583 -0.643 18000 4191 1 19 . 1 1 14 14 ALA N N 213 121.810 121.810 120.653 1.157 18000 4192 1 19 . 1 1 14 14 ALA HA H 213 4.260 4.260 4.023 0.237 18000 4193 1 19 . 1 1 14 14 ALA C C 213 176.630 176.630 179.651 -3.021 18000 4194 1 19 . 1 1 14 14 ALA CA C 213 51.990 51.990 55.343 -3.353 18000 4195 1 19 . 1 1 14 14 ALA CB C 213 16.450 16.450 18.831 -2.381 18000 4196 1 19 . 1 1 14 14 ALA H H 213 7.920 7.920 8.143 -0.223 18000 4197 1 19 . 1 1 15 15 VAL N N 214 121.430 121.430 119.147 2.283 18000 4198 1 19 . 1 1 15 15 VAL HA H 214 3.470 3.470 3.565 -0.095 18000 4199 1 19 . 1 1 15 15 VAL C C 214 174.980 174.980 177.710 -2.730 18000 4200 1 19 . 1 1 15 15 VAL CA C 214 64.190 64.190 66.362 -2.172 18000 4201 1 19 . 1 1 15 15 VAL CB C 214 29.820 29.820 31.303 -1.484 18000 4202 1 19 . 1 1 15 15 VAL H H 214 8.680 8.680 8.578 0.102 18000 4203 1 19 . 1 1 16 16 ASN N N 215 117.460 117.460 118.408 -0.948 18000 4204 1 19 . 1 1 16 16 ASN HA H 215 4.300 4.300 4.447 -0.147 18000 4205 1 19 . 1 1 16 16 ASN C C 215 176.320 176.320 176.819 -0.499 18000 4206 1 19 . 1 1 16 16 ASN CA C 215 54.190 54.190 55.872 -1.682 18000 4207 1 19 . 1 1 16 16 ASN CB C 215 35.360 35.360 37.816 -2.455 18000 4208 1 19 . 1 1 16 16 ASN H H 215 8.190 8.190 8.460 -0.270 18000 4209 1 19 . 1 1 17 17 GLU N N 216 119.430 119.430 116.968 2.462 18000 4210 1 19 . 1 1 17 17 GLU HA H 216 4.000 4.000 4.227 -0.227 18000 4211 1 19 . 1 1 17 17 GLU C C 216 177.240 177.240 178.882 -1.642 18000 4212 1 19 . 1 1 17 17 GLU CA C 216 57.180 57.180 58.534 -1.354 18000 4213 1 19 . 1 1 17 17 GLU CB C 216 28.400 28.400 29.481 -1.081 18000 4214 1 19 . 1 1 17 17 GLU H H 216 7.730 7.730 8.081 -0.351 18000 4215 1 19 . 1 1 18 18 VAL N N 217 120.690 120.690 119.200 1.490 18000 4216 1 19 . 1 1 18 18 VAL HA H 217 3.530 3.530 3.922 -0.392 18000 4217 1 19 . 1 1 18 18 VAL C C 217 174.990 174.990 178.334 -3.344 18000 4218 1 19 . 1 1 18 18 VAL CA C 217 64.310 64.310 64.938 -0.628 18000 4219 1 19 . 1 1 18 18 VAL CB C 217 29.640 29.640 31.178 -1.538 18000 4220 1 19 . 1 1 18 18 VAL H H 217 7.820 7.820 7.898 -0.078 18000 4221 1 19 . 1 1 19 19 VAL N N 218 117.010 117.010 114.951 2.059 18000 4222 1 19 . 1 1 19 19 VAL HA H 218 3.500 3.500 3.898 -0.398 18000 4223 1 19 . 1 1 19 19 VAL C C 218 175.200 175.200 176.513 -1.313 18000 4224 1 19 . 1 1 19 19 VAL CA C 218 64.960 64.960 64.807 0.153 18000 4225 1 19 . 1 1 19 19 VAL CB C 218 29.710 29.710 31.623 -1.913 18000 4226 1 19 . 1 1 19 19 VAL H H 218 8.260 8.260 7.665 0.595 18000 4227 1 19 . 1 1 20 20 ALA N N 219 120.360 120.360 118.206 2.154 18000 4228 1 19 . 1 1 20 20 ALA HA H 219 3.930 3.930 4.348 -0.418 18000 4229 1 19 . 1 1 20 20 ALA C C 219 178.310 178.310 177.647 0.663 18000 4230 1 19 . 1 1 20 20 ALA CA C 219 53.040 53.040 51.297 1.743 18000 4231 1 19 . 1 1 20 20 ALA CB C 219 16.280 16.280 19.047 -2.767 18000 4232 1 19 . 1 1 20 20 ALA H H 219 7.490 7.490 7.340 0.150 18000 4233 1 19 . 1 1 21 21 GLY N N 220 124.250 124.250 109.018 15.232 18000 4234 1 19 . 1 1 21 21 GLY HA H 220 4.250 4.250 4.357 -0.107 18000 4235 1 19 . 1 1 21 21 GLY C C 220 172.880 172.880 174.806 -1.926 18000 4236 1 19 . 1 1 21 21 GLY CA C 220 44.130 44.130 44.196 -0.066 18000 4237 1 19 . 1 1 21 21 GLY CB C 220 29.290 29.290 28.893 0.397 18000 4238 1 19 . 1 1 21 21 GLY H H 220 7.640 7.640 7.512 0.128 18000 4239 1 19 . 1 1 22 22 ILE N N 221 119.940 119.940 126.287 -6.347 18000 4240 1 19 . 1 1 22 22 ILE HA H 221 3.290 3.290 4.324 -1.034 18000 4241 1 19 . 1 1 22 22 ILE C C 221 175.100 175.100 174.367 0.733 18000 4242 1 19 . 1 1 22 22 ILE CA C 221 64.070 64.070 60.139 3.931 18000 4243 1 19 . 1 1 22 22 ILE CB C 221 35.260 35.260 38.258 -2.998 18000 4244 1 19 . 1 1 22 22 ILE H H 221 8.130 8.130 7.990 0.140 18000 4245 1 19 . 1 1 23 23 LYS HA H 222 3.430 3.430 4.406 -0.976 18000 4246 1 19 . 1 1 23 23 LYS C C 222 175.280 175.280 175.384 -0.104 18000 4247 1 19 . 1 1 23 23 LYS CA C 222 59.270 59.270 56.831 2.439 18000 4248 1 19 . 1 1 23 23 LYS CB C 222 30.670 30.670 31.717 -1.047 18000 4249 1 19 . 1 1 24 24 GLU N N 223 116.150 116.150 120.754 -4.604 18000 4250 1 19 . 1 1 24 24 GLU HA H 223 4.150 4.150 4.304 -0.154 18000 4251 1 19 . 1 1 24 24 GLU C C 223 177.330 177.330 175.933 1.397 18000 4252 1 19 . 1 1 24 24 GLU CA C 223 57.180 57.180 55.621 1.559 18000 4253 1 19 . 1 1 24 24 GLU CB C 223 27.670 27.670 30.007 -2.337 18000 4254 1 19 . 1 1 24 24 GLU H H 223 7.830 7.830 8.269 -0.439 18000 4255 1 19 . 1 1 25 25 TYR N N 224 119.760 119.760 119.557 0.203 18000 4256 1 19 . 1 1 25 25 TYR HA H 224 4.480 4.480 4.346 0.134 18000 4257 1 19 . 1 1 25 25 TYR C C 224 175.680 175.680 174.082 1.598 18000 4258 1 19 . 1 1 25 25 TYR CA C 224 57.520 57.520 58.067 -0.547 18000 4259 1 19 . 1 1 25 25 TYR CB C 224 36.940 36.940 38.823 -1.883 18000 4260 1 19 . 1 1 25 25 TYR H H 224 8.630 8.630 7.991 0.639 18000 4261 1 19 . 1 1 26 26 PHE N N 225 120.090 120.090 123.918 -3.828 18000 4262 1 19 . 1 1 26 26 PHE HA H 225 3.410 3.410 4.392 -0.982 18000 4263 1 19 . 1 1 26 26 PHE C C 225 173.930 173.930 174.837 -0.907 18000 4264 1 19 . 1 1 26 26 PHE CA C 225 61.600 61.600 59.101 2.499 18000 4265 1 19 . 1 1 26 26 PHE CB C 225 36.590 36.590 38.851 -2.261 18000 4266 1 19 . 1 1 26 26 PHE H H 225 9.220 9.220 8.622 0.598 18000 4267 1 19 . 1 1 27 27 ASN N N 226 115.010 115.010 124.245 -9.235 18000 4268 1 19 . 1 1 27 27 ASN HA H 226 4.470 4.470 4.829 -0.359 18000 4269 1 19 . 1 1 27 27 ASN C C 226 176.630 176.630 173.752 2.878 18000 4270 1 19 . 1 1 27 27 ASN CA C 226 54.160 54.160 51.347 2.813 18000 4271 1 19 . 1 1 27 27 ASN CB C 226 35.800 35.800 41.566 -5.766 18000 4272 1 19 . 1 1 27 27 ASN H H 226 8.210 8.210 8.226 -0.016 18000 4273 1 19 . 1 1 28 28 VAL N N 227 115.120 115.120 122.006 -6.886 18000 4274 1 19 . 1 1 28 28 VAL HA H 227 4.300 4.300 4.377 -0.077 18000 4275 1 19 . 1 1 28 28 VAL C C 227 174.960 174.960 173.888 1.072 18000 4276 1 19 . 1 1 28 28 VAL CA C 227 61.320 61.320 59.500 1.820 18000 4277 1 19 . 1 1 28 28 VAL CB C 227 30.670 30.670 32.422 -1.752 18000 4278 1 19 . 1 1 28 28 VAL H H 227 7.430 7.430 8.121 -0.691 18000 4279 1 19 . 1 1 29 29 MET HA H 228 4.000 4.000 4.406 -0.406 18000 4280 1 19 . 1 1 29 29 MET C C 228 176.270 176.270 176.329 -0.059 18000 4281 1 19 . 1 1 29 29 MET CA C 228 54.030 54.030 55.573 -1.543 18000 4282 1 19 . 1 1 29 29 MET CB C 228 31.510 31.510 33.605 -2.095 18000 4283 1 19 . 1 1 30 30 LEU N N 229 122.180 122.180 121.041 1.139 18000 4284 1 19 . 1 1 30 30 LEU HA H 229 3.150 3.150 4.070 -0.920 18000 4285 1 19 . 1 1 30 30 LEU C C 229 176.070 176.070 177.131 -1.061 18000 4286 1 19 . 1 1 30 30 LEU CA C 229 55.860 55.860 57.067 -1.207 18000 4287 1 19 . 1 1 30 30 LEU CB C 229 36.340 36.340 41.985 -5.645 18000 4288 1 19 . 1 1 30 30 LEU H H 229 7.890 7.890 8.465 -0.575 18000 4289 1 19 . 1 1 31 31 GLY N N 230 118.390 118.390 104.839 13.551 18000 4290 1 19 . 1 1 31 31 GLY HA H 230 4.090 4.090 4.189 -0.099 18000 4291 1 19 . 1 1 31 31 GLY C C 230 173.070 173.070 174.867 -1.797 18000 4292 1 19 . 1 1 31 31 GLY CA C 230 43.150 43.150 45.870 -2.720 18000 4293 1 19 . 1 1 31 31 GLY CB C 230 26.780 26.780 29.086 -2.306 18000 4294 1 19 . 1 1 31 31 GLY H H 230 8.350 8.350 8.397 -0.047 18000 4295 1 19 . 1 1 32 32 THR N N 231 124.790 124.790 112.564 12.226 18000 4296 1 19 . 1 1 32 32 THR HA H 231 4.280 4.280 4.457 -0.177 18000 4297 1 19 . 1 1 32 32 THR C C 231 173.260 173.260 176.363 -3.103 18000 4298 1 19 . 1 1 32 32 THR CA C 231 60.030 60.030 63.521 -3.491 18000 4299 1 19 . 1 1 32 32 THR CB C 231 68.540 68.540 70.216 -1.676 18000 4300 1 19 . 1 1 32 32 THR H H 231 7.040 7.040 7.702 -0.662 18000 4301 1 19 . 1 1 33 33 GLN N N 232 114.740 114.740 116.579 -1.839 18000 4302 1 19 . 1 1 33 33 GLN HA H 232 5.090 5.090 4.344 0.746 18000 4303 1 19 . 1 1 33 33 GLN C C 232 175.790 175.790 175.440 0.350 18000 4304 1 19 . 1 1 33 33 GLN CA C 232 53.650 53.650 56.518 -2.868 18000 4305 1 19 . 1 1 33 33 GLN CB C 232 30.520 30.520 30.731 -0.211 18000 4306 1 19 . 1 1 33 33 GLN H H 232 8.110 8.110 7.932 0.178 18000 4307 1 19 . 1 1 34 34 LEU N N 233 112.480 112.480 124.349 -11.869 18000 4308 1 19 . 1 1 34 34 LEU HA H 233 4.460 4.460 3.958 0.502 18000 4309 1 19 . 1 1 34 34 LEU C C 233 172.610 172.610 175.759 -3.149 18000 4310 1 19 . 1 1 34 34 LEU CA C 233 52.460 52.460 55.791 -3.331 18000 4311 1 19 . 1 1 34 34 LEU CB C 233 39.140 39.140 41.586 -2.446 18000 4312 1 19 . 1 1 34 34 LEU H H 233 6.980 6.980 8.030 -1.050 18000 4313 1 19 . 1 1 35 35 LEU N N 234 115.860 115.860 126.089 -10.229 18000 4314 1 19 . 1 1 35 35 LEU HA H 234 4.510 4.510 4.467 0.043 18000 4315 1 19 . 1 1 35 35 LEU C C 234 178.330 178.330 176.306 2.024 18000 4316 1 19 . 1 1 35 35 LEU CA C 234 51.900 51.900 54.703 -2.803 18000 4317 1 19 . 1 1 35 35 LEU CB C 234 40.950 40.950 42.240 -1.290 18000 4318 1 19 . 1 1 35 35 LEU H H 234 7.560 7.560 8.032 -0.472 18000 4319 1 19 . 1 1 36 36 TYR N N 235 125.850 125.850 126.407 -0.557 18000 4320 1 19 . 1 1 36 36 TYR HA H 235 4.790 4.790 4.711 0.079 18000 4321 1 19 . 1 1 36 36 TYR C C 235 176.260 176.260 175.112 1.148 18000 4322 1 19 . 1 1 36 36 TYR CA C 235 57.750 57.750 57.094 0.656 18000 4323 1 19 . 1 1 36 36 TYR CB C 235 37.100 37.100 40.335 -3.235 18000 4324 1 19 . 1 1 36 36 TYR H H 235 9.750 9.750 8.219 1.531 18000 4325 1 19 . 1 1 37 37 LYS N N 236 123.880 123.880 127.975 -4.095 18000 4326 1 19 . 1 1 37 37 LYS HA H 236 3.930 3.930 4.514 -0.584 18000 4327 1 19 . 1 1 37 37 LYS C C 236 178.280 178.280 176.176 2.104 18000 4328 1 19 . 1 1 37 37 LYS CA C 236 59.210 59.210 55.850 3.360 18000 4329 1 19 . 1 1 37 37 LYS CB C 236 30.430 30.430 32.789 -2.359 18000 4330 1 19 . 1 1 37 37 LYS H H 236 9.340 9.340 8.386 0.954 18000 4331 1 19 . 1 1 38 38 PHE N N 237 117.150 117.150 124.942 -7.792 18000 4332 1 19 . 1 1 38 38 PHE HA H 237 4.460 4.460 4.875 -0.415 18000 4333 1 19 . 1 1 38 38 PHE C C 237 173.930 173.930 173.708 0.222 18000 4334 1 19 . 1 1 38 38 PHE CA C 237 58.510 58.510 55.453 3.057 18000 4335 1 19 . 1 1 38 38 PHE CB C 237 38.370 38.370 39.224 -0.854 18000 4336 1 19 . 1 1 38 38 PHE H H 237 9.120 9.120 8.486 0.634 18000 4337 1 19 . 1 1 39 39 GLU HA H 238 4.160 4.160 4.228 -0.068 18000 4338 1 19 . 1 1 39 39 GLU C C 238 175.650 175.650 176.642 -0.992 18000 4339 1 19 . 1 1 39 39 GLU CA C 238 55.070 55.070 57.057 -1.987 18000 4340 1 19 . 1 1 39 39 GLU CB C 238 31.540 31.540 29.585 1.955 18000 4341 1 19 . 1 1 40 40 ARG N N 239 120.330 120.330 124.046 -3.716 18000 4342 1 19 . 1 1 40 40 ARG HA H 239 4.250 4.250 4.111 0.139 18000 4343 1 19 . 1 1 40 40 ARG C C 239 174.490 174.490 176.542 -2.052 18000 4344 1 19 . 1 1 40 40 ARG CA C 239 60.410 60.410 56.203 4.207 18000 4345 1 19 . 1 1 40 40 ARG H H 239 7.980 7.980 8.743 -0.763 18000 4346 1 19 . 1 1 41 41 PRO N N 240 115.390 115.390 115.883 -0.493 18000 4347 1 19 . 1 1 41 41 PRO HA H 240 4.360 4.360 4.688 -0.328 18000 4348 1 19 . 1 1 41 41 PRO C C 240 176.330 176.330 177.436 -1.106 18000 4349 1 19 . 1 1 41 41 PRO CA C 240 64.400 64.400 63.350 1.050 18000 4350 1 19 . 1 1 41 41 PRO CB C 240 62.240 62.240 63.613 -1.373 18000 4351 1 19 . 1 1 41 41 PRO H H 240 8.090 8.090 8.413 -0.323 18000 4352 1 20 . 1 1 2 2 ARG N N 201 119.330 119.330 121.655 -2.325 18000 4353 1 20 . 1 1 2 2 ARG HA H 201 3.560 3.560 4.701 -1.141 18000 4354 1 20 . 1 1 2 2 ARG C C 201 176.850 176.850 175.336 1.514 18000 4355 1 20 . 1 1 2 2 ARG CA C 201 55.340 55.340 55.133 0.207 18000 4356 1 20 . 1 1 2 2 ARG CB C 201 27.020 27.020 31.437 -4.417 18000 4357 1 20 . 1 1 2 2 ARG H H 201 8.370 8.370 7.886 0.484 18000 4358 1 20 . 1 1 3 3 LYS N N 202 118.540 118.540 123.367 -4.827 18000 4359 1 20 . 1 1 3 3 LYS HA H 202 4.010 4.010 4.413 -0.403 18000 4360 1 20 . 1 1 3 3 LYS C C 202 176.090 176.090 176.051 0.039 18000 4361 1 20 . 1 1 3 3 LYS CA C 202 56.960 56.960 56.042 0.918 18000 4362 1 20 . 1 1 3 3 LYS CB C 202 30.590 30.590 33.564 -2.974 18000 4363 1 20 . 1 1 3 3 LYS H H 202 7.940 7.940 8.397 -0.457 18000 4364 1 20 . 1 1 4 4 SER N N 203 113.880 113.880 121.251 -7.371 18000 4365 1 20 . 1 1 4 4 SER HA H 203 4.320 4.320 5.006 -0.686 18000 4366 1 20 . 1 1 4 4 SER C C 203 172.900 172.900 172.648 0.252 18000 4367 1 20 . 1 1 4 4 SER CA C 203 57.870 57.870 56.006 1.864 18000 4368 1 20 . 1 1 4 4 SER CB C 203 61.700 61.700 63.466 -1.766 18000 4369 1 20 . 1 1 4 4 SER H H 203 7.700 7.700 8.410 -0.710 18000 4370 1 20 . 1 1 5 5 ARG HA H 204 4.240 4.240 4.432 -0.192 18000 4371 1 20 . 1 1 5 5 ARG C C 204 174.810 174.810 174.504 0.306 18000 4372 1 20 . 1 1 5 5 ARG CA C 204 54.270 54.270 55.745 -1.475 18000 4373 1 20 . 1 1 5 5 ARG CB C 204 28.700 28.700 30.871 -2.171 18000 4374 1 20 . 1 1 6 6 GLY N N 205 125.950 125.950 108.855 17.095 18000 4375 1 20 . 1 1 6 6 GLY HA H 205 4.400 4.400 4.476 -0.076 18000 4376 1 20 . 1 1 6 6 GLY C C 205 171.910 171.910 174.735 -2.825 18000 4377 1 20 . 1 1 6 6 GLY CA C 205 43.570 43.570 44.528 -0.958 18000 4378 1 20 . 1 1 6 6 GLY CB C 205 28.340 28.340 30.174 -1.834 18000 4379 1 20 . 1 1 6 6 GLY H H 205 7.930 7.930 8.361 -0.431 18000 4380 1 20 . 1 1 7 7 ASN N N 206 118.380 118.380 122.598 -4.218 18000 4381 1 20 . 1 1 7 7 ASN HA H 206 4.760 4.760 4.750 0.010 18000 4382 1 20 . 1 1 7 7 ASN C C 206 173.810 173.810 177.494 -3.684 18000 4383 1 20 . 1 1 7 7 ASN CA C 206 51.430 51.430 54.430 -3.000 18000 4384 1 20 . 1 1 7 7 ASN CB C 206 37.090 37.090 37.822 -0.732 18000 4385 1 20 . 1 1 7 7 ASN H H 206 8.330 8.330 8.936 -0.606 18000 4386 1 20 . 1 1 8 8 THR N N 207 119.850 119.850 121.271 -1.421 18000 4387 1 20 . 1 1 8 8 THR HA H 207 4.270 4.270 4.088 0.182 18000 4388 1 20 . 1 1 8 8 THR C C 207 172.560 172.560 176.663 -4.103 18000 4389 1 20 . 1 1 8 8 THR CA C 207 60.420 60.420 65.494 -5.074 18000 4390 1 20 . 1 1 8 8 THR CB C 207 67.750 67.750 68.255 -0.505 18000 4391 1 20 . 1 1 8 8 THR H H 207 7.830 7.830 8.622 -0.792 18000 4392 1 20 . 1 1 9 9 ASP N N 208 121.180 121.180 117.338 3.842 18000 4393 1 20 . 1 1 9 9 ASP HA H 208 4.550 4.550 4.609 -0.059 18000 4394 1 20 . 1 1 9 9 ASP C C 208 174.170 174.170 176.506 -2.336 18000 4395 1 20 . 1 1 9 9 ASP CA C 208 52.670 52.670 58.307 -5.637 18000 4396 1 20 . 1 1 9 9 ASP CB C 208 39.120 39.120 37.989 1.131 18000 4397 1 20 . 1 1 9 9 ASP H H 208 8.350 8.350 8.785 -0.435 18000 4398 1 20 . 1 1 10 10 ASN HA H 209 4.600 4.600 4.451 0.149 18000 4399 1 20 . 1 1 10 10 ASN C C 209 173.670 173.670 177.538 -3.868 18000 4400 1 20 . 1 1 10 10 ASN CA C 209 52.110 52.110 56.313 -4.204 18000 4401 1 20 . 1 1 10 10 ASN CB C 209 36.730 36.730 37.981 -1.251 18000 4402 1 20 . 1 1 11 11 LYS N N 210 120.380 120.380 117.129 3.251 18000 4403 1 20 . 1 1 11 11 LYS HA H 210 4.270 4.270 3.996 0.274 18000 4404 1 20 . 1 1 11 11 LYS C C 210 174.910 174.910 178.794 -3.884 18000 4405 1 20 . 1 1 11 11 LYS CA C 210 54.900 54.900 60.364 -5.464 18000 4406 1 20 . 1 1 11 11 LYS CB C 210 30.670 30.670 32.159 -1.489 18000 4407 1 20 . 1 1 11 11 LYS H H 210 8.210 8.210 8.471 -0.261 18000 4408 1 20 . 1 1 12 12 GLU N N 211 120.740 120.740 120.609 0.131 18000 4409 1 20 . 1 1 12 12 GLU HA H 211 4.070 4.070 3.984 0.086 18000 4410 1 20 . 1 1 12 12 GLU C C 211 174.810 174.810 179.345 -4.535 18000 4411 1 20 . 1 1 12 12 GLU CA C 211 55.940 55.940 59.962 -4.022 18000 4412 1 20 . 1 1 12 12 GLU CB C 211 27.700 27.700 29.550 -1.850 18000 4413 1 20 . 1 1 12 12 GLU H H 211 8.380 8.380 8.162 0.218 18000 4414 1 20 . 1 1 13 13 TYR N N 212 119.430 119.430 118.951 0.479 18000 4415 1 20 . 1 1 13 13 TYR HA H 212 4.380 4.380 4.207 0.173 18000 4416 1 20 . 1 1 13 13 TYR C C 212 174.830 174.830 178.417 -3.587 18000 4417 1 20 . 1 1 13 13 TYR CA C 212 57.420 57.420 61.038 -3.618 18000 4418 1 20 . 1 1 13 13 TYR CB C 212 36.530 36.530 38.056 -1.526 18000 4419 1 20 . 1 1 13 13 TYR H H 212 7.940 7.940 8.754 -0.814 18000 4420 1 20 . 1 1 14 14 ALA N N 213 121.810 121.810 120.323 1.487 18000 4421 1 20 . 1 1 14 14 ALA HA H 213 4.260 4.260 4.002 0.258 18000 4422 1 20 . 1 1 14 14 ALA C C 213 176.630 176.630 179.677 -3.047 18000 4423 1 20 . 1 1 14 14 ALA CA C 213 51.990 51.990 55.302 -3.312 18000 4424 1 20 . 1 1 14 14 ALA CB C 213 16.450 16.450 18.799 -2.349 18000 4425 1 20 . 1 1 14 14 ALA H H 213 7.920 7.920 8.029 -0.109 18000 4426 1 20 . 1 1 15 15 VAL N N 214 121.430 121.430 119.397 2.033 18000 4427 1 20 . 1 1 15 15 VAL HA H 214 3.470 3.470 3.540 -0.070 18000 4428 1 20 . 1 1 15 15 VAL C C 214 174.980 174.980 177.731 -2.751 18000 4429 1 20 . 1 1 15 15 VAL CA C 214 64.190 64.190 66.715 -2.525 18000 4430 1 20 . 1 1 15 15 VAL CB C 214 29.820 29.820 31.377 -1.557 18000 4431 1 20 . 1 1 15 15 VAL H H 214 8.680 8.680 8.637 0.043 18000 4432 1 20 . 1 1 16 16 ASN N N 215 117.460 117.460 117.650 -0.190 18000 4433 1 20 . 1 1 16 16 ASN HA H 215 4.300 4.300 4.396 -0.096 18000 4434 1 20 . 1 1 16 16 ASN C C 215 176.320 176.320 177.030 -0.710 18000 4435 1 20 . 1 1 16 16 ASN CA C 215 54.190 54.190 55.689 -1.499 18000 4436 1 20 . 1 1 16 16 ASN CB C 215 35.360 35.360 37.690 -2.330 18000 4437 1 20 . 1 1 16 16 ASN H H 215 8.190 8.190 8.517 -0.327 18000 4438 1 20 . 1 1 17 17 GLU N N 216 119.430 119.430 117.469 1.961 18000 4439 1 20 . 1 1 17 17 GLU HA H 216 4.000 4.000 4.189 -0.189 18000 4440 1 20 . 1 1 17 17 GLU C C 216 177.240 177.240 178.193 -0.953 18000 4441 1 20 . 1 1 17 17 GLU CA C 216 57.180 57.180 58.833 -1.653 18000 4442 1 20 . 1 1 17 17 GLU CB C 216 28.400 28.400 29.209 -0.809 18000 4443 1 20 . 1 1 17 17 GLU H H 216 7.730 7.730 8.050 -0.320 18000 4444 1 20 . 1 1 18 18 VAL N N 217 120.690 120.690 118.633 2.057 18000 4445 1 20 . 1 1 18 18 VAL HA H 217 3.530 3.530 3.967 -0.437 18000 4446 1 20 . 1 1 18 18 VAL C C 217 174.990 174.990 178.661 -3.671 18000 4447 1 20 . 1 1 18 18 VAL CA C 217 64.310 64.310 64.972 -0.662 18000 4448 1 20 . 1 1 18 18 VAL CB C 217 29.640 29.640 31.211 -1.571 18000 4449 1 20 . 1 1 18 18 VAL H H 217 7.820 7.820 7.816 0.004 18000 4450 1 20 . 1 1 19 19 VAL N N 218 117.010 117.010 115.948 1.062 18000 4451 1 20 . 1 1 19 19 VAL HA H 218 3.500 3.500 3.829 -0.329 18000 4452 1 20 . 1 1 19 19 VAL C C 218 175.200 175.200 176.631 -1.431 18000 4453 1 20 . 1 1 19 19 VAL CA C 218 64.960 64.960 64.557 0.403 18000 4454 1 20 . 1 1 19 19 VAL CB C 218 29.710 29.710 31.034 -1.324 18000 4455 1 20 . 1 1 19 19 VAL H H 218 8.260 8.260 8.088 0.172 18000 4456 1 20 . 1 1 20 20 ALA N N 219 120.360 120.360 117.527 2.833 18000 4457 1 20 . 1 1 20 20 ALA HA H 219 3.930 3.930 4.277 -0.347 18000 4458 1 20 . 1 1 20 20 ALA C C 219 178.310 178.310 177.921 0.389 18000 4459 1 20 . 1 1 20 20 ALA CA C 219 53.040 53.040 51.718 1.322 18000 4460 1 20 . 1 1 20 20 ALA CB C 219 16.280 16.280 18.648 -2.368 18000 4461 1 20 . 1 1 20 20 ALA H H 219 7.490 7.490 7.312 0.178 18000 4462 1 20 . 1 1 21 21 GLY N N 220 124.250 124.250 109.017 15.233 18000 4463 1 20 . 1 1 21 21 GLY HA H 220 4.250 4.250 4.442 -0.192 18000 4464 1 20 . 1 1 21 21 GLY C C 220 172.880 172.880 174.686 -1.806 18000 4465 1 20 . 1 1 21 21 GLY CA C 220 44.130 44.130 43.661 0.469 18000 4466 1 20 . 1 1 21 21 GLY CB C 220 29.290 29.290 28.751 0.539 18000 4467 1 20 . 1 1 21 21 GLY H H 220 7.640 7.640 7.685 -0.045 18000 4468 1 20 . 1 1 22 22 ILE N N 221 119.940 119.940 125.606 -5.666 18000 4469 1 20 . 1 1 22 22 ILE HA H 221 3.290 3.290 4.235 -0.945 18000 4470 1 20 . 1 1 22 22 ILE C C 221 175.100 175.100 174.496 0.604 18000 4471 1 20 . 1 1 22 22 ILE CA C 221 64.070 64.070 60.783 3.287 18000 4472 1 20 . 1 1 22 22 ILE CB C 221 35.260 35.260 38.278 -3.018 18000 4473 1 20 . 1 1 22 22 ILE H H 221 8.130 8.130 7.799 0.331 18000 4474 1 20 . 1 1 23 23 LYS HA H 222 3.430 3.430 4.275 -0.845 18000 4475 1 20 . 1 1 23 23 LYS C C 222 175.280 175.280 175.099 0.181 18000 4476 1 20 . 1 1 23 23 LYS CA C 222 59.270 59.270 57.092 2.178 18000 4477 1 20 . 1 1 23 23 LYS CB C 222 30.670 30.670 31.528 -0.858 18000 4478 1 20 . 1 1 24 24 GLU N N 223 116.150 116.150 120.756 -4.606 18000 4479 1 20 . 1 1 24 24 GLU HA H 223 4.150 4.150 4.547 -0.397 18000 4480 1 20 . 1 1 24 24 GLU C C 223 177.330 177.330 175.527 1.803 18000 4481 1 20 . 1 1 24 24 GLU CA C 223 57.180 57.180 54.436 2.744 18000 4482 1 20 . 1 1 24 24 GLU CB C 223 27.670 27.670 31.325 -3.655 18000 4483 1 20 . 1 1 24 24 GLU H H 223 7.830 7.830 8.117 -0.287 18000 4484 1 20 . 1 1 25 25 TYR N N 224 119.760 119.760 121.951 -2.191 18000 4485 1 20 . 1 1 25 25 TYR HA H 224 4.480 4.480 4.557 -0.077 18000 4486 1 20 . 1 1 25 25 TYR C C 224 175.680 175.680 175.582 0.098 18000 4487 1 20 . 1 1 25 25 TYR CA C 224 57.520 57.520 58.031 -0.511 18000 4488 1 20 . 1 1 25 25 TYR CB C 224 36.940 36.940 39.395 -2.455 18000 4489 1 20 . 1 1 25 25 TYR H H 224 8.630 8.630 8.485 0.145 18000 4490 1 20 . 1 1 26 26 PHE N N 225 120.090 120.090 125.857 -5.767 18000 4491 1 20 . 1 1 26 26 PHE HA H 225 3.410 3.410 4.338 -0.928 18000 4492 1 20 . 1 1 26 26 PHE C C 225 173.930 173.930 174.840 -0.910 18000 4493 1 20 . 1 1 26 26 PHE CA C 225 61.600 61.600 58.669 2.930 18000 4494 1 20 . 1 1 26 26 PHE CB C 225 36.590 36.590 38.895 -2.305 18000 4495 1 20 . 1 1 26 26 PHE H H 225 9.220 9.220 8.673 0.547 18000 4496 1 20 . 1 1 27 27 ASN N N 226 115.010 115.010 125.963 -10.953 18000 4497 1 20 . 1 1 27 27 ASN HA H 226 4.470 4.470 4.711 -0.241 18000 4498 1 20 . 1 1 27 27 ASN C C 226 176.630 176.630 173.208 3.422 18000 4499 1 20 . 1 1 27 27 ASN CA C 226 54.160 54.160 51.338 2.822 18000 4500 1 20 . 1 1 27 27 ASN CB C 226 35.800 35.800 39.596 -3.796 18000 4501 1 20 . 1 1 27 27 ASN H H 226 8.210 8.210 8.121 0.089 18000 4502 1 20 . 1 1 28 28 VAL N N 227 115.120 115.120 117.373 -2.253 18000 4503 1 20 . 1 1 28 28 VAL HA H 227 4.300 4.300 4.483 -0.183 18000 4504 1 20 . 1 1 28 28 VAL C C 227 174.960 174.960 173.923 1.037 18000 4505 1 20 . 1 1 28 28 VAL CA C 227 61.320 61.320 58.444 2.876 18000 4506 1 20 . 1 1 28 28 VAL CB C 227 30.670 30.670 32.023 -1.353 18000 4507 1 20 . 1 1 28 28 VAL H H 227 7.430 7.430 7.790 -0.360 18000 4508 1 20 . 1 1 29 29 MET HA H 228 4.000 4.000 4.583 -0.584 18000 4509 1 20 . 1 1 29 29 MET C C 228 176.270 176.270 175.944 0.326 18000 4510 1 20 . 1 1 29 29 MET CA C 228 54.030 54.030 54.871 -0.841 18000 4511 1 20 . 1 1 29 29 MET CB C 228 31.510 31.510 33.627 -2.118 18000 4512 1 20 . 1 1 30 30 LEU N N 229 122.180 122.180 122.979 -0.799 18000 4513 1 20 . 1 1 30 30 LEU HA H 229 3.150 3.150 4.044 -0.894 18000 4514 1 20 . 1 1 30 30 LEU C C 229 176.070 176.070 177.906 -1.836 18000 4515 1 20 . 1 1 30 30 LEU CA C 229 55.860 55.860 56.810 -0.950 18000 4516 1 20 . 1 1 30 30 LEU CB C 229 36.340 36.340 41.894 -5.554 18000 4517 1 20 . 1 1 30 30 LEU H H 229 7.890 7.890 8.562 -0.672 18000 4518 1 20 . 1 1 31 31 GLY N N 230 118.390 118.390 106.947 11.443 18000 4519 1 20 . 1 1 31 31 GLY HA H 230 4.090 4.090 4.112 -0.022 18000 4520 1 20 . 1 1 31 31 GLY C C 230 173.070 173.070 175.436 -2.366 18000 4521 1 20 . 1 1 31 31 GLY CA C 230 43.150 43.150 47.175 -4.025 18000 4522 1 20 . 1 1 31 31 GLY CB C 230 26.780 26.780 29.365 -2.585 18000 4523 1 20 . 1 1 31 31 GLY H H 230 8.350 8.350 8.528 -0.178 18000 4524 1 20 . 1 1 32 32 THR N N 231 124.790 124.790 112.111 12.679 18000 4525 1 20 . 1 1 32 32 THR HA H 231 4.280 4.280 4.458 -0.178 18000 4526 1 20 . 1 1 32 32 THR C C 231 173.260 173.260 176.138 -2.878 18000 4527 1 20 . 1 1 32 32 THR CA C 231 60.030 60.030 63.260 -3.230 18000 4528 1 20 . 1 1 32 32 THR CB C 231 68.540 68.540 70.217 -1.677 18000 4529 1 20 . 1 1 32 32 THR H H 231 7.040 7.040 7.910 -0.870 18000 4530 1 20 . 1 1 33 33 GLN N N 232 114.740 114.740 117.762 -3.022 18000 4531 1 20 . 1 1 33 33 GLN HA H 232 5.090 5.090 4.364 0.726 18000 4532 1 20 . 1 1 33 33 GLN C C 232 175.790 175.790 175.842 -0.052 18000 4533 1 20 . 1 1 33 33 GLN CA C 232 53.650 53.650 55.799 -2.149 18000 4534 1 20 . 1 1 33 33 GLN CB C 232 30.520 30.520 30.022 0.498 18000 4535 1 20 . 1 1 33 33 GLN H H 232 8.110 8.110 8.529 -0.419 18000 4536 1 20 . 1 1 34 34 LEU N N 233 112.480 112.480 121.848 -9.368 18000 4537 1 20 . 1 1 34 34 LEU HA H 233 4.460 4.460 4.433 0.027 18000 4538 1 20 . 1 1 34 34 LEU C C 233 172.610 172.610 175.974 -3.364 18000 4539 1 20 . 1 1 34 34 LEU CA C 233 52.460 52.460 54.791 -2.331 18000 4540 1 20 . 1 1 34 34 LEU CB C 233 39.140 39.140 43.881 -4.741 18000 4541 1 20 . 1 1 34 34 LEU H H 233 6.980 6.980 8.224 -1.244 18000 4542 1 20 . 1 1 35 35 LEU N N 234 115.860 115.860 125.926 -10.066 18000 4543 1 20 . 1 1 35 35 LEU HA H 234 4.510 4.510 4.202 0.308 18000 4544 1 20 . 1 1 35 35 LEU C C 234 178.330 178.330 176.541 1.789 18000 4545 1 20 . 1 1 35 35 LEU CA C 234 51.900 51.900 56.493 -4.593 18000 4546 1 20 . 1 1 35 35 LEU CB C 234 40.950 40.950 42.297 -1.347 18000 4547 1 20 . 1 1 35 35 LEU H H 234 7.560 7.560 7.586 -0.026 18000 4548 1 20 . 1 1 36 36 TYR N N 235 125.850 125.850 124.310 1.540 18000 4549 1 20 . 1 1 36 36 TYR HA H 235 4.790 4.790 4.670 0.120 18000 4550 1 20 . 1 1 36 36 TYR C C 235 176.260 176.260 174.943 1.317 18000 4551 1 20 . 1 1 36 36 TYR CA C 235 57.750 57.750 57.203 0.547 18000 4552 1 20 . 1 1 36 36 TYR CB C 235 37.100 37.100 39.787 -2.687 18000 4553 1 20 . 1 1 36 36 TYR H H 235 9.750 9.750 8.000 1.750 18000 4554 1 20 . 1 1 37 37 LYS N N 236 123.880 123.880 123.441 0.439 18000 4555 1 20 . 1 1 37 37 LYS HA H 236 3.930 3.930 4.420 -0.490 18000 4556 1 20 . 1 1 37 37 LYS C C 236 178.280 178.280 175.529 2.751 18000 4557 1 20 . 1 1 37 37 LYS CA C 236 59.210 59.210 55.746 3.464 18000 4558 1 20 . 1 1 37 37 LYS CB C 236 30.430 30.430 33.013 -2.583 18000 4559 1 20 . 1 1 37 37 LYS H H 236 9.340 9.340 8.007 1.333 18000 4560 1 20 . 1 1 38 38 PHE N N 237 117.150 117.150 121.378 -4.228 18000 4561 1 20 . 1 1 38 38 PHE HA H 237 4.460 4.460 4.770 -0.310 18000 4562 1 20 . 1 1 38 38 PHE C C 237 173.930 173.930 174.135 -0.205 18000 4563 1 20 . 1 1 38 38 PHE CA C 237 58.510 58.510 57.643 0.867 18000 4564 1 20 . 1 1 38 38 PHE CB C 237 38.370 38.370 38.350 0.020 18000 4565 1 20 . 1 1 38 38 PHE H H 237 9.120 9.120 8.684 0.436 18000 4566 1 20 . 1 1 39 39 GLU HA H 238 4.160 4.160 4.672 -0.512 18000 4567 1 20 . 1 1 39 39 GLU C C 238 175.650 175.650 175.983 -0.333 18000 4568 1 20 . 1 1 39 39 GLU CA C 238 55.070 55.070 55.256 -0.186 18000 4569 1 20 . 1 1 39 39 GLU CB C 238 31.540 31.540 31.047 0.493 18000 4570 1 20 . 1 1 40 40 ARG N N 239 120.330 120.330 119.151 1.179 18000 4571 1 20 . 1 1 40 40 ARG HA H 239 4.250 4.250 4.511 -0.261 18000 4572 1 20 . 1 1 40 40 ARG C C 239 174.490 174.490 176.039 -1.549 18000 4573 1 20 . 1 1 40 40 ARG CA C 239 60.410 60.410 55.712 4.699 18000 4574 1 20 . 1 1 40 40 ARG H H 239 7.980 7.980 8.342 -0.362 18000 4575 1 20 . 1 1 41 41 PRO N N 240 115.390 115.390 118.255 -2.865 18000 4576 1 20 . 1 1 41 41 PRO HA H 240 4.360 4.360 4.367 -0.007 18000 4577 1 20 . 1 1 41 41 PRO C C 240 176.330 176.330 178.043 -1.713 18000 4578 1 20 . 1 1 41 41 PRO CA C 240 64.400 64.400 63.853 0.547 18000 4579 1 20 . 1 1 41 41 PRO CB C 240 62.240 62.240 63.646 -1.406 18000 4580 1 20 . 1 1 41 41 PRO H H 240 8.090 8.090 8.781 -0.691 18000 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 65 6.229 1.279 6.144 18000 2 1 1 "Average Difference" HA 82 0.432 0.180 0.395 18000 3 1 1 "Average Difference" C 79 2.156 1.366 1.678 18000 4 1 1 "Average Difference" CA 80 2.410 1.323 2.028 18000 5 1 1 "Average Difference" CB 74 2.221 1.806 1.302 18000 6 1 1 "Average Difference" HN 65 0.573 0.104 0.568 18000 7 1 2 "Average Difference" N 65 6.287 1.011 6.253 18000 8 1 2 "Average Difference" HA 82 0.417 0.150 0.392 18000 9 1 2 "Average Difference" C 79 2.269 1.493 1.720 18000 10 1 2 "Average Difference" CA 80 2.527 1.577 1.987 18000 11 1 2 "Average Difference" CB 74 2.097 1.704 1.231 18000 12 1 2 "Average Difference" HN 65 0.558 0.115 0.550 18000 13 1 3 "Average Difference" N 65 6.136 1.052 6.092 18000 14 1 3 "Average Difference" HA 82 0.407 0.173 0.371 18000 15 1 3 "Average Difference" C 79 2.288 1.632 1.614 18000 16 1 3 "Average Difference" CA 80 2.486 1.401 2.067 18000 17 1 3 "Average Difference" CB 74 2.177 1.713 1.352 18000 18 1 3 "Average Difference" HN 65 0.590 0.096 0.587 18000 19 1 4 "Average Difference" N 65 6.289 0.893 6.274 18000 20 1 4 "Average Difference" HA 82 0.440 0.200 0.394 18000 21 1 4 "Average Difference" C 79 2.271 1.470 1.742 18000 22 1 4 "Average Difference" CA 80 2.439 1.341 2.051 18000 23 1 4 "Average Difference" CB 74 2.064 1.581 1.337 18000 24 1 4 "Average Difference" HN 65 0.625 0.100 0.622 18000 25 1 5 "Average Difference" N 65 6.302 0.414 6.337 18000 26 1 5 "Average Difference" HA 82 0.463 0.190 0.425 18000 27 1 5 "Average Difference" C 79 2.299 1.499 1.755 18000 28 1 5 "Average Difference" CA 80 2.529 1.435 2.096 18000 29 1 5 "Average Difference" CB 74 2.173 1.763 1.279 18000 30 1 5 "Average Difference" HN 65 0.566 0.088 0.563 18000 31 1 6 "Average Difference" N 65 5.787 0.823 5.772 18000 32 1 6 "Average Difference" HA 82 0.402 0.166 0.368 18000 33 1 6 "Average Difference" C 79 2.217 1.518 1.627 18000 34 1 6 "Average Difference" CA 80 2.473 1.365 2.075 18000 35 1 6 "Average Difference" CB 74 2.213 1.789 1.310 18000 36 1 6 "Average Difference" HN 65 0.584 0.123 0.575 18000 37 1 7 "Average Difference" N 65 5.868 0.261 5.907 18000 38 1 7 "Average Difference" HA 82 0.415 0.136 0.394 18000 39 1 7 "Average Difference" C 79 2.132 1.358 1.654 18000 40 1 7 "Average Difference" CA 80 2.585 1.457 2.149 18000 41 1 7 "Average Difference" CB 74 2.137 1.650 1.367 18000 42 1 7 "Average Difference" HN 65 0.661 0.056 0.663 18000 43 1 8 "Average Difference" N 65 6.662 0.728 6.673 18000 44 1 8 "Average Difference" HA 82 0.412 0.155 0.384 18000 45 1 8 "Average Difference" C 79 2.276 1.628 1.601 18000 46 1 8 "Average Difference" CA 80 2.441 1.324 2.063 18000 47 1 8 "Average Difference" CB 74 2.000 1.550 1.272 18000 48 1 8 "Average Difference" HN 65 0.571 0.088 0.569 18000 49 1 9 "Average Difference" N 65 6.034 0.826 6.023 18000 50 1 9 "Average Difference" HA 82 0.442 0.219 0.387 18000 51 1 9 "Average Difference" C 79 2.169 1.432 1.639 18000 52 1 9 "Average Difference" CA 80 2.385 1.188 2.081 18000 53 1 9 "Average Difference" CB 74 2.180 1.772 1.279 18000 54 1 9 "Average Difference" HN 65 0.563 0.087 0.561 18000 55 1 10 "Average Difference" N 65 6.047 1.079 5.997 18000 56 1 10 "Average Difference" HA 82 0.432 0.194 0.388 18000 57 1 10 "Average Difference" C 79 2.288 1.573 1.672 18000 58 1 10 "Average Difference" CA 80 2.504 1.332 2.134 18000 59 1 10 "Average Difference" CB 74 2.264 1.799 1.384 18000 60 1 10 "Average Difference" HN 65 0.605 0.113 0.599 18000 61 1 11 "Average Difference" N 65 6.451 1.234 6.381 18000 62 1 11 "Average Difference" HA 82 0.411 0.174 0.374 18000 63 1 11 "Average Difference" C 79 2.282 1.563 1.673 18000 64 1 11 "Average Difference" CA 80 2.374 1.243 2.036 18000 65 1 11 "Average Difference" CB 74 2.100 1.655 1.301 18000 66 1 11 "Average Difference" HN 65 0.562 0.148 0.546 18000 67 1 12 "Average Difference" N 65 6.132 0.828 6.123 18000 68 1 12 "Average Difference" HA 82 0.405 0.163 0.373 18000 69 1 12 "Average Difference" C 79 2.247 1.529 1.656 18000 70 1 12 "Average Difference" CA 80 2.457 1.384 2.044 18000 71 1 12 "Average Difference" CB 74 2.142 1.749 1.245 18000 72 1 12 "Average Difference" HN 65 0.612 0.065 0.613 18000 73 1 13 "Average Difference" N 65 6.285 0.604 6.304 18000 74 1 13 "Average Difference" HA 82 0.472 0.131 0.456 18000 75 1 13 "Average Difference" C 79 2.172 1.423 1.651 18000 76 1 13 "Average Difference" CA 80 2.496 1.419 2.066 18000 77 1 13 "Average Difference" CB 74 1.996 1.522 1.300 18000 78 1 13 "Average Difference" HN 65 0.645 0.025 0.650 18000 79 1 14 "Average Difference" N 65 6.536 1.060 6.500 18000 80 1 14 "Average Difference" HA 82 0.428 0.167 0.397 18000 81 1 14 "Average Difference" C 79 2.225 1.504 1.650 18000 82 1 14 "Average Difference" CA 80 2.522 1.480 2.054 18000 83 1 14 "Average Difference" CB 74 2.154 1.718 1.308 18000 84 1 14 "Average Difference" HN 65 0.508 0.093 0.503 18000 85 1 15 "Average Difference" N 65 6.333 0.960 6.309 18000 86 1 15 "Average Difference" HA 82 0.421 0.196 0.376 18000 87 1 15 "Average Difference" C 79 2.211 1.461 1.671 18000 88 1 15 "Average Difference" CA 80 2.355 1.226 2.024 18000 89 1 15 "Average Difference" CB 74 2.137 1.736 1.254 18000 90 1 15 "Average Difference" HN 65 0.619 0.163 0.601 18000 91 1 16 "Average Difference" N 65 6.184 0.159 6.231 18000 92 1 16 "Average Difference" HA 82 0.436 0.177 0.401 18000 93 1 16 "Average Difference" C 79 2.216 1.425 1.709 18000 94 1 16 "Average Difference" CA 80 2.494 1.416 2.066 18000 95 1 16 "Average Difference" CB 74 2.245 1.756 1.407 18000 96 1 16 "Average Difference" HN 65 0.666 0.070 0.667 18000 97 1 17 "Average Difference" N 65 6.054 0.593 6.072 18000 98 1 17 "Average Difference" HA 82 0.441 0.174 0.407 18000 99 1 17 "Average Difference" C 79 2.143 1.403 1.631 18000 100 1 17 "Average Difference" CA 80 2.495 1.369 2.099 18000 101 1 17 "Average Difference" CB 74 2.145 1.733 1.272 18000 102 1 17 "Average Difference" HN 65 0.558 0.087 0.556 18000 103 1 18 "Average Difference" N 65 5.727 0.255 5.766 18000 104 1 18 "Average Difference" HA 82 0.454 0.199 0.410 18000 105 1 18 "Average Difference" C 79 2.155 1.352 1.688 18000 106 1 18 "Average Difference" CA 80 2.407 1.210 2.094 18000 107 1 18 "Average Difference" CB 74 2.232 1.807 1.319 18000 108 1 18 "Average Difference" HN 65 0.596 0.116 0.589 18000 109 1 19 "Average Difference" N 65 6.380 1.252 6.304 18000 110 1 19 "Average Difference" HA 82 0.426 0.183 0.387 18000 111 1 19 "Average Difference" C 79 2.195 1.488 1.624 18000 112 1 19 "Average Difference" CA 80 2.403 1.332 2.013 18000 113 1 19 "Average Difference" CB 74 2.203 1.795 1.285 18000 114 1 19 "Average Difference" HN 65 0.531 0.123 0.521 18000 115 1 20 "Average Difference" N 65 5.907 0.627 5.919 18000 116 1 20 "Average Difference" HA 82 0.437 0.212 0.385 18000 117 1 20 "Average Difference" C 79 2.213 1.492 1.645 18000 118 1 20 "Average Difference" CA 80 2.412 1.250 2.076 18000 119 1 20 "Average Difference" CB 74 2.191 1.814 1.238 18000 120 1 20 "Average Difference" HN 65 0.587 0.129 0.577 18000 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 18000 _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 ARG N N 201 240.110 240.110 244.179 -4.069 18000 2 1 . 1 1 2 2 ARG HA H 201 8.060 8.060 9.383 -1.323 18000 3 1 . 1 1 2 2 ARG C C 201 350.220 350.220 349.622 0.598 18000 4 1 . 1 1 2 2 ARG CA C 201 111.370 111.370 113.525 -2.155 18000 5 1 . 1 1 2 2 ARG CB C 201 64.050 64.050 71.125 -7.076 18000 6 1 . 1 1 2 2 ARG H H 201 16.600 16.600 16.271 0.329 18000 7 1 . 1 1 3 3 LYS N N 202 241.550 241.550 251.572 -10.022 18000 8 1 . 1 1 3 3 LYS HA H 202 7.950 7.950 8.384 -0.434 18000 9 1 . 1 1 3 3 LYS C C 202 349.530 349.530 351.080 -1.550 18000 10 1 . 1 1 3 3 LYS CA C 202 117.100 117.100 118.422 -1.322 18000 11 1 . 1 1 3 3 LYS CB C 202 61.580 61.580 65.159 -3.579 18000 12 1 . 1 1 3 3 LYS H H 202 15.890 15.890 16.346 -0.456 18000 13 1 . 1 1 4 4 SER N N 203 226.110 226.110 249.773 -23.663 18000 14 1 . 1 1 4 4 SER HA H 203 8.790 8.790 9.346 -0.555 18000 15 1 . 1 1 4 4 SER C C 203 344.960 344.960 347.001 -2.041 18000 16 1 . 1 1 4 4 SER CA C 203 110.140 110.140 109.970 0.170 18000 17 1 . 1 1 4 4 SER CB C 203 88.670 88.670 91.341 -2.671 18000 18 1 . 1 1 4 4 SER H H 203 16.050 16.050 16.633 -0.583 18000 19 1 . 1 1 5 5 ARG HA H 204 8.640 8.640 8.704 -0.064 18000 20 1 . 1 1 5 5 ARG C C 204 349.640 349.640 350.643 -1.003 18000 21 1 . 1 1 5 5 ARG CA C 204 115.820 115.820 118.909 -3.089 18000 22 1 . 1 1 5 5 ARG CB C 204 59.020 59.020 63.018 -3.998 18000 23 1 . 1 1 6 6 GLY N N 205 246.510 246.510 227.754 18.756 18000 24 1 . 1 1 6 6 GLY HA H 205 4.400 4.400 4.377 0.023 18000 25 1 . 1 1 6 6 GLY C C 205 346.460 346.460 350.261 -3.801 18000 26 1 . 1 1 6 6 GLY CA C 205 98.150 98.150 100.173 -2.023 18000 27 1 . 1 1 6 6 GLY CB C 205 28.340 28.340 29.555 -1.215 18000 28 1 . 1 1 6 6 GLY H H 205 16.700 16.700 16.521 0.179 18000 29 1 . 1 1 7 7 ASN N N 206 239.060 239.060 245.501 -6.441 18000 30 1 . 1 1 7 7 ASN HA H 206 9.110 9.110 9.053 0.057 18000 31 1 . 1 1 7 7 ASN C C 206 348.370 348.370 356.259 -7.889 18000 32 1 . 1 1 7 7 ASN CA C 206 104.510 104.510 110.799 -6.288 18000 33 1 . 1 1 7 7 ASN CB C 206 78.040 78.040 79.671 -1.631 18000 34 1 . 1 1 7 7 ASN H H 206 17.160 17.160 17.504 -0.344 18000 35 1 . 1 1 8 8 THR N N 207 119.850 119.850 120.823 -0.973 18000 36 1 . 1 1 8 8 THR HA H 207 8.550 8.550 8.303 0.247 18000 37 1 . 1 1 8 8 THR C C 207 348.660 348.660 354.968 -6.308 18000 38 1 . 1 1 8 8 THR CA C 207 117.070 117.070 124.757 -7.687 18000 39 1 . 1 1 8 8 THR CB C 207 96.370 96.370 97.704 -1.334 18000 40 1 . 1 1 8 8 THR H H 207 7.830 7.830 8.561 -0.731 18000 41 1 . 1 1 9 9 ASP N N 208 239.560 239.560 236.428 3.132 18000 42 1 . 1 1 9 9 ASP HA H 208 8.910 8.910 9.005 -0.095 18000 43 1 . 1 1 9 9 ASP C C 208 174.170 174.170 176.290 -2.120 18000 44 1 . 1 1 9 9 ASP CA C 208 110.090 110.090 118.643 -8.553 18000 45 1 . 1 1 9 9 ASP CB C 208 64.440 64.440 65.582 -1.142 18000 46 1 . 1 1 9 9 ASP H H 208 16.730 16.730 17.110 -0.379 18000 47 1 . 1 1 10 10 ASN HA H 209 8.560 8.560 8.636 -0.076 18000 48 1 . 1 1 10 10 ASN C C 209 349.360 349.360 356.703 -7.343 18000 49 1 . 1 1 10 10 ASN CA C 209 116.710 116.710 122.269 -5.559 18000 50 1 . 1 1 10 10 ASN CB C 209 66.130 66.130 69.130 -3.000 18000 51 1 . 1 1 11 11 LYS N N 210 120.380 120.380 117.472 2.908 18000 52 1 . 1 1 11 11 LYS HA H 210 8.230 8.230 8.218 0.012 18000 53 1 . 1 1 11 11 LYS C C 210 350.450 350.450 356.981 -6.531 18000 54 1 . 1 1 11 11 LYS CA C 210 116.440 116.440 122.101 -5.661 18000 55 1 . 1 1 11 11 LYS CB C 210 67.250 67.250 70.607 -3.358 18000 56 1 . 1 1 11 11 LYS H H 210 8.210 8.210 8.371 -0.161 18000 57 1 . 1 1 12 12 GLU N N 211 240.430 240.430 241.006 -0.576 18000 58 1 . 1 1 12 12 GLU HA H 211 7.970 7.970 8.053 -0.083 18000 59 1 . 1 1 12 12 GLU C C 211 353.130 353.130 358.815 -5.685 18000 60 1 . 1 1 12 12 GLU CA C 211 114.210 114.210 119.761 -5.551 18000 61 1 . 1 1 12 12 GLU CB C 211 55.550 55.550 58.675 -3.125 18000 62 1 . 1 1 12 12 GLU H H 211 16.640 16.640 16.795 -0.155 18000 63 1 . 1 1 13 13 TYR N N 212 238.460 238.460 238.900 -0.440 18000 64 1 . 1 1 13 13 TYR HA H 212 8.430 8.430 8.259 0.171 18000 65 1 . 1 1 13 13 TYR C C 212 353.070 353.070 357.733 -4.663 18000 66 1 . 1 1 13 13 TYR CA C 212 113.300 113.300 118.699 -5.399 18000 67 1 . 1 1 13 13 TYR CB C 212 76.440 76.440 79.862 -3.422 18000 68 1 . 1 1 13 13 TYR H H 212 16.060 16.060 16.592 -0.532 18000 69 1 . 1 1 14 14 ALA N N 213 121.810 121.810 120.457 1.353 18000 70 1 . 1 1 14 14 ALA HA H 213 8.150 8.150 7.993 0.157 18000 71 1 . 1 1 14 14 ALA C C 213 354.070 354.070 358.760 -4.690 18000 72 1 . 1 1 14 14 ALA CA C 213 108.000 108.000 113.484 -5.484 18000 73 1 . 1 1 14 14 ALA CB C 213 56.070 56.070 60.421 -4.351 18000 74 1 . 1 1 14 14 ALA H H 213 7.920 7.920 8.209 -0.289 18000 75 1 . 1 1 15 15 VAL N N 214 121.430 121.430 119.116 2.314 18000 76 1 . 1 1 15 15 VAL HA H 214 7.070 7.070 7.172 -0.102 18000 77 1 . 1 1 15 15 VAL C C 214 350.240 350.240 355.490 -5.250 18000 78 1 . 1 1 15 15 VAL CA C 214 128.590 128.590 131.869 -3.279 18000 79 1 . 1 1 15 15 VAL CB C 214 66.800 66.800 68.759 -1.959 18000 80 1 . 1 1 15 15 VAL H H 214 8.680 8.680 8.598 0.082 18000 81 1 . 1 1 16 16 ASN N N 215 237.830 237.830 240.509 -2.679 18000 82 1 . 1 1 16 16 ASN HA H 215 8.390 8.390 8.438 -0.048 18000 83 1 . 1 1 16 16 ASN C C 215 355.140 355.140 356.402 -1.262 18000 84 1 . 1 1 16 16 ASN CA C 215 107.500 107.500 110.720 -3.220 18000 85 1 . 1 1 16 16 ASN CB C 215 51.430 51.430 55.903 -4.473 18000 86 1 . 1 1 16 16 ASN H H 215 15.980 15.980 16.283 -0.303 18000 87 1 . 1 1 17 17 GLU N N 216 238.360 238.360 237.705 0.655 18000 88 1 . 1 1 17 17 GLU HA H 216 8.160 8.160 8.346 -0.186 18000 89 1 . 1 1 17 17 GLU C C 216 355.970 355.970 358.123 -2.153 18000 90 1 . 1 1 17 17 GLU CA C 216 109.890 109.890 113.136 -3.246 18000 91 1 . 1 1 17 17 GLU CB C 216 45.090 45.090 47.898 -2.808 18000 92 1 . 1 1 17 17 GLU H H 216 15.520 15.520 16.213 -0.693 18000 93 1 . 1 1 18 18 VAL N N 217 241.370 241.370 239.970 1.400 18000 94 1 . 1 1 18 18 VAL HA H 217 7.450 7.450 8.006 -0.556 18000 95 1 . 1 1 18 18 VAL C C 217 353.030 353.030 358.354 -5.324 18000 96 1 . 1 1 18 18 VAL CA C 217 117.270 117.270 119.561 -2.291 18000 97 1 . 1 1 18 18 VAL CB C 217 46.970 46.970 49.597 -2.627 18000 98 1 . 1 1 18 18 VAL H H 217 15.950 15.950 15.906 0.044 18000 99 1 . 1 1 19 19 VAL N N 218 231.880 231.880 231.084 0.796 18000 100 1 . 1 1 19 19 VAL HA H 218 7.710 7.710 8.061 -0.351 18000 101 1 . 1 1 19 19 VAL C C 218 350.420 350.420 353.836 -3.416 18000 102 1 . 1 1 19 19 VAL CA C 218 120.470 120.470 123.245 -2.775 18000 103 1 . 1 1 19 19 VAL CB C 218 60.320 60.320 64.247 -3.927 18000 104 1 . 1 1 19 19 VAL H H 218 16.080 16.080 15.700 0.380 18000 105 1 . 1 1 20 20 ALA N N 219 236.000 236.000 234.119 1.881 18000 106 1 . 1 1 20 20 ALA HA H 219 8.230 8.230 8.647 -0.417 18000 107 1 . 1 1 20 20 ALA C C 219 352.710 352.710 354.297 -1.587 18000 108 1 . 1 1 20 20 ALA CA C 219 107.380 107.380 107.487 -0.107 18000 109 1 . 1 1 20 20 ALA CB C 219 45.070 45.070 48.322 -3.252 18000 110 1 . 1 1 20 20 ALA H H 219 14.760 14.760 14.941 -0.181 18000 111 1 . 1 1 21 21 GLY N N 220 242.880 242.880 229.425 13.455 18000 112 1 . 1 1 21 21 GLY HA H 220 4.250 4.250 4.357 -0.107 18000 113 1 . 1 1 21 21 GLY C C 220 346.900 346.900 350.808 -3.909 18000 114 1 . 1 1 21 21 GLY CA C 220 97.320 97.320 99.243 -1.923 18000 115 1 . 1 1 21 21 GLY CB C 220 29.290 29.290 29.208 0.082 18000 116 1 . 1 1 21 21 GLY H H 220 14.760 14.760 15.004 -0.244 18000 117 1 . 1 1 22 22 ILE N N 221 242.130 242.130 249.065 -6.935 18000 118 1 . 1 1 22 22 ILE HA H 221 8.090 8.090 9.055 -0.965 18000 119 1 . 1 1 22 22 ILE C C 221 346.670 346.670 348.545 -1.875 18000 120 1 . 1 1 22 22 ILE CA C 221 114.090 114.090 112.175 1.915 18000 121 1 . 1 1 22 22 ILE CB C 221 71.070 71.070 76.078 -5.008 18000 122 1 . 1 1 22 22 ILE H H 221 16.680 16.680 16.252 0.428 18000 123 1 . 1 1 23 23 LYS HA H 222 8.080 8.080 8.818 -0.738 18000 124 1 . 1 1 23 23 LYS C C 222 349.990 349.990 351.417 -1.427 18000 125 1 . 1 1 23 23 LYS CA C 222 121.120 121.120 120.320 0.800 18000 126 1 . 1 1 23 23 LYS CB C 222 61.510 61.510 62.383 -0.873 18000 127 1 . 1 1 24 24 GLU N N 223 230.880 230.880 235.698 -4.818 18000 128 1 . 1 1 24 24 GLU HA H 223 8.690 8.690 8.803 -0.113 18000 129 1 . 1 1 24 24 GLU C C 223 348.710 348.710 350.285 -1.575 18000 130 1 . 1 1 24 24 GLU CA C 223 115.650 115.650 116.647 -0.997 18000 131 1 . 1 1 24 24 GLU CB C 223 98.300 98.300 100.603 -2.303 18000 132 1 . 1 1 24 24 GLU H H 223 16.310 16.310 16.388 -0.078 18000 133 1 . 1 1 25 25 TYR N N 224 242.120 242.120 242.828 -0.708 18000 134 1 . 1 1 25 25 TYR HA H 224 8.640 8.640 8.842 -0.202 18000 135 1 . 1 1 25 25 TYR C C 224 348.820 348.820 349.843 -1.023 18000 136 1 . 1 1 25 25 TYR CA C 224 111.430 111.430 113.744 -2.314 18000 137 1 . 1 1 25 25 TYR CB C 224 63.900 63.900 69.534 -5.634 18000 138 1 . 1 1 25 25 TYR H H 224 17.260 17.260 16.467 0.793 18000 139 1 . 1 1 26 26 PHE N N 225 233.660 233.660 251.621 -17.961 18000 140 1 . 1 1 26 26 PHE HA H 225 7.400 7.400 8.884 -1.484 18000 141 1 . 1 1 26 26 PHE C C 225 345.010 345.010 349.631 -4.621 18000 142 1 . 1 1 26 26 PHE CA C 225 120.020 120.020 117.733 2.287 18000 143 1 . 1 1 26 26 PHE CB C 225 73.280 73.280 78.419 -5.139 18000 144 1 . 1 1 26 26 PHE H H 225 16.930 16.930 17.316 -0.386 18000 145 1 . 1 1 27 27 ASN N N 226 236.550 236.550 249.557 -13.007 18000 146 1 . 1 1 27 27 ASN HA H 226 8.850 8.850 9.129 -0.279 18000 147 1 . 1 1 27 27 ASN C C 226 348.420 348.420 347.367 1.053 18000 148 1 . 1 1 27 27 ASN CA C 226 106.360 106.360 105.533 0.827 18000 149 1 . 1 1 27 27 ASN CB C 226 66.780 66.780 72.686 -5.906 18000 150 1 . 1 1 27 27 ASN H H 226 14.420 14.420 16.280 -1.860 18000 151 1 . 1 1 28 28 VAL N N 227 237.880 237.880 242.808 -4.928 18000 152 1 . 1 1 28 28 VAL HA H 227 8.450 8.450 8.884 -0.434 18000 153 1 . 1 1 28 28 VAL C C 227 348.180 348.180 349.161 -0.981 18000 154 1 . 1 1 28 28 VAL CA C 227 111.650 111.650 111.503 0.147 18000 155 1 . 1 1 28 28 VAL CB C 227 70.360 70.360 73.652 -3.292 18000 156 1 . 1 1 28 28 VAL H H 227 15.970 15.970 16.137 -0.167 18000 157 1 . 1 1 29 29 MET HA H 228 8.330 8.330 8.821 -0.491 18000 158 1 . 1 1 29 29 MET C C 228 351.650 351.650 353.254 -1.604 18000 159 1 . 1 1 29 29 MET CA C 228 114.870 114.870 118.145 -3.275 18000 160 1 . 1 1 29 29 MET CB C 228 62.150 62.150 65.941 -3.791 18000 161 1 . 1 1 30 30 LEU N N 229 244.070 244.070 242.461 1.609 18000 162 1 . 1 1 30 30 LEU HA H 229 7.390 7.390 8.421 -1.031 18000 163 1 . 1 1 30 30 LEU C C 229 350.940 350.940 354.083 -3.143 18000 164 1 . 1 1 30 30 LEU CA C 229 109.960 109.960 113.134 -3.175 18000 165 1 . 1 1 30 30 LEU CB C 229 72.880 72.880 80.052 -7.172 18000 166 1 . 1 1 30 30 LEU H H 229 16.620 16.620 17.240 -0.620 18000 167 1 . 1 1 31 31 GLY N N 230 234.830 234.830 224.320 10.510 18000 168 1 . 1 1 31 31 GLY HA H 230 4.090 4.090 4.169 -0.079 18000 169 1 . 1 1 31 31 GLY C C 230 348.260 348.260 352.063 -3.803 18000 170 1 . 1 1 31 31 GLY CA C 230 100.010 100.010 104.570 -4.559 18000 171 1 . 1 1 31 31 GLY CB C 230 26.780 26.780 29.075 -2.295 18000 172 1 . 1 1 31 31 GLY H H 230 17.480 17.480 17.046 0.434 18000 173 1 . 1 1 32 32 THR N N 231 241.680 241.680 232.125 9.555 18000 174 1 . 1 1 32 32 THR HA H 231 8.610 8.610 8.898 -0.288 18000 175 1 . 1 1 32 32 THR C C 231 348.160 348.160 354.254 -6.094 18000 176 1 . 1 1 32 32 THR CA C 231 113.560 113.560 119.598 -6.038 18000 177 1 . 1 1 32 32 THR CB C 231 109.300 109.300 113.679 -4.379 18000 178 1 . 1 1 32 32 THR H H 231 14.570 14.570 15.550 -0.980 18000 179 1 . 1 1 33 33 GLN N N 232 234.690 234.690 228.683 6.007 18000 180 1 . 1 1 33 33 GLN HA H 232 8.990 8.990 8.752 0.238 18000 181 1 . 1 1 33 33 GLN C C 232 348.790 348.790 349.558 -0.768 18000 182 1 . 1 1 33 33 GLN CA C 232 113.540 113.540 118.382 -4.842 18000 183 1 . 1 1 33 33 GLN CB C 232 97.910 97.910 100.588 -2.678 18000 184 1 . 1 1 33 33 GLN H H 232 15.320 15.320 16.375 -1.054 18000 185 1 . 1 1 34 34 LEU N N 233 232.230 232.230 245.211 -12.981 18000 186 1 . 1 1 34 34 LEU HA H 233 8.920 8.920 8.596 0.324 18000 187 1 . 1 1 34 34 LEU C C 233 345.640 345.640 351.300 -5.660 18000 188 1 . 1 1 34 34 LEU CA C 233 109.480 109.480 114.577 -5.097 18000 189 1 . 1 1 34 34 LEU CB C 233 64.810 64.810 70.025 -5.215 18000 190 1 . 1 1 34 34 LEU H H 233 14.800 14.800 16.576 -1.776 18000 191 1 . 1 1 35 35 LEU N N 234 231.150 231.150 240.235 -9.085 18000 192 1 . 1 1 35 35 LEU HA H 234 8.860 8.860 8.491 0.369 18000 193 1 . 1 1 35 35 LEU C C 234 351.080 351.080 351.406 -0.326 18000 194 1 . 1 1 35 35 LEU CA C 234 112.060 112.060 119.076 -7.016 18000 195 1 . 1 1 35 35 LEU CB C 234 108.540 108.540 110.477 -1.937 18000 196 1 . 1 1 35 35 LEU H H 234 15.620 15.620 16.019 -0.399 18000 197 1 . 1 1 36 36 TYR N N 235 241.790 241.790 238.816 2.974 18000 198 1 . 1 1 36 36 TYR HA H 235 9.060 9.060 8.903 0.157 18000 199 1 . 1 1 36 36 TYR C C 235 348.190 348.190 349.033 -0.843 18000 200 1 . 1 1 36 36 TYR CA C 235 117.730 117.730 119.322 -1.592 18000 201 1 . 1 1 36 36 TYR CB C 235 104.960 104.960 108.248 -3.288 18000 202 1 . 1 1 36 36 TYR H H 235 17.700 17.700 15.917 1.783 18000 203 1 . 1 1 37 37 LYS N N 236 237.670 237.670 252.269 -14.599 18000 204 1 . 1 1 37 37 LYS HA H 236 8.220 8.220 8.883 -0.663 18000 205 1 . 1 1 37 37 LYS C C 236 353.500 353.500 351.956 1.544 18000 206 1 . 1 1 37 37 LYS CA C 236 109.440 109.440 107.869 1.571 18000 207 1 . 1 1 37 37 LYS CB C 236 47.790 47.790 52.430 -4.640 18000 208 1 . 1 1 37 37 LYS H H 236 17.510 17.510 16.320 1.190 18000 209 1 . 1 1 38 38 PHE N N 237 240.070 240.070 244.374 -4.304 18000 210 1 . 1 1 38 38 PHE HA H 237 9.000 9.000 9.303 -0.303 18000 211 1 . 1 1 38 38 PHE C C 237 347.490 347.490 349.908 -2.418 18000 212 1 . 1 1 38 38 PHE CA C 237 109.620 109.620 109.120 0.500 18000 213 1 . 1 1 38 38 PHE CB C 237 77.960 77.960 81.543 -3.583 18000 214 1 . 1 1 38 38 PHE H H 237 17.320 17.320 16.578 0.742 18000 215 1 . 1 1 39 39 GLU HA H 238 8.530 8.530 8.817 -0.287 18000 216 1 . 1 1 39 39 GLU C C 238 351.260 351.260 353.023 -1.763 18000 217 1 . 1 1 39 39 GLU CA C 238 116.640 116.640 119.928 -3.288 18000 218 1 . 1 1 39 39 GLU CB C 238 61.750 61.750 61.695 0.055 18000 219 1 . 1 1 40 40 ARG N N 239 242.450 242.450 232.633 9.817 18000 220 1 . 1 1 40 40 ARG HA H 239 4.250 4.250 4.248 0.002 18000 221 1 . 1 1 40 40 ARG C C 239 346.800 346.800 349.431 -2.631 18000 222 1 . 1 1 40 40 ARG CA C 239 103.720 103.720 100.864 2.856 18000 223 1 . 1 1 40 40 ARG H H 239 16.460 16.460 16.570 -0.110 18000 224 1 . 1 1 41 41 PRO N N 240 115.390 115.390 116.121 -0.731 18000 225 1 . 1 1 41 41 PRO HA H 240 8.840 8.840 9.208 -0.368 18000 226 1 . 1 1 41 41 PRO C C 240 348.120 348.120 351.194 -3.074 18000 227 1 . 1 1 41 41 PRO CA C 240 120.840 120.840 122.390 -1.550 18000 228 1 . 1 1 41 41 PRO CB C 240 62.240 62.240 63.614 -1.374 18000 229 1 . 1 1 41 41 PRO H H 240 8.090 8.090 8.454 -0.364 18000 stop_ save_