data_15991_sparta save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 15991 _Entry.PDB_ID 2K9M _Entry.NMR_STAR_version 3.0.9.100 save_ save_delta_chem_shifts_single _Entity_delta_chem_shifts.Sf_category delta_chem_shifts _Entity_delta_chem_shifts.Sf_framecode delta_chem_shifts_single _Entity_delta_chem_shifts.Conformer_type "single" _Entity_delta_chem_shifts.Conformer_count 20 _Entity_delta_chem_shifts.Best_conformer 1 _Entity_delta_chem_shifts.ID 1 loop_ _Delta_CS.Assigned_chem_shift_list_ID _Delta_CS.Atom_chem_shift_ID _Delta_CS.Assembly_atom_ID _Delta_CS.Conformer_ID _Delta_CS.Entity_assembly_ID _Delta_CS.Entity_ID _Delta_CS.PDB_asym_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.Sparta_CS_value _Delta_CS.Delta_CS_value _Delta_CS.Entity_delta_chem_shifts_ID 1 826 . 1 1 1 A 70 70 GLY H H 70 9.295 8.305 0.990 1 1 829 . 1 1 1 A 70 70 GLY CA C 70 46.552 58.928 -12.376 1 1 830 . 1 1 1 A 70 70 GLY N N 70 108.643 117.750 -9.107 1 1 832 . 1 1 1 A 71 71 VAL HA H 71 3.538 4.869 -1.331 1 1 840 . 1 1 1 A 71 71 VAL CA C 71 65.623 62.843 2.780 1 1 841 . 1 1 1 A 71 71 VAL CB C 71 30.251 32.019 -1.768 1 1 844 . 1 1 1 A 71 71 VAL N N 71 110.808 136.753 -25.945 1 1 845 . 1 1 1 A 72 72 CYS H H 72 8.022 8.951 -0.929 1 1 846 . 1 1 1 A 72 72 CYS HA H 72 3.469 4.924 -1.455 1 1 849 . 1 1 1 A 72 72 CYS CA C 72 62.733 57.376 5.357 1 1 850 . 1 1 1 A 72 72 CYS CB C 72 27.163 64.462 -37.299 1 1 851 . 1 1 1 A 72 72 CYS N N 72 109.483 119.126 -9.643 1 1 852 . 1 1 1 A 73 73 SER H H 73 7.996 8.176 -0.180 1 1 853 . 1 1 1 A 73 73 SER HA H 73 4.439 4.087 0.352 1 1 856 . 1 1 1 A 73 73 SER CA C 73 62.145 59.296 2.849 1 1 857 . 1 1 1 A 73 73 SER CB C 73 66.013 29.539 36.474 1 1 858 . 1 1 1 A 73 73 SER N N 73 118.630 122.267 -3.637 1 1 859 . 1 1 1 A 74 74 LYS H H 74 10.186 7.888 2.298 1 1 860 . 1 1 1 A 74 74 LYS HA H 74 4.172 3.954 0.218 1 1 867 . 1 1 1 A 74 74 LYS CA C 74 59.848 58.414 1.434 1 1 868 . 1 1 1 A 74 74 LYS CB C 74 34.278 41.441 -7.163 1 1 870 . 1 1 1 A 74 74 LYS N N 74 123.341 119.766 3.575 1 1 871 . 1 1 1 A 75 75 ASP H H 75 7.542 8.260 -0.718 1 1 872 . 1 1 1 A 75 75 ASP HA H 75 3.538 4.113 -0.575 1 1 875 . 1 1 1 A 75 75 ASP CA C 75 52.472 59.244 -6.772 1 1 876 . 1 1 1 A 75 75 ASP CB C 75 42.360 29.244 13.116 1 1 877 . 1 1 1 A 75 75 ASP N N 75 112.035 119.518 -7.483 1 1 878 . 1 1 1 A 76 76 VAL H H 76 8.128 7.962 0.166 1 1 879 . 1 1 1 A 76 76 VAL HA H 76 4.106 4.017 0.089 1 1 887 . 1 1 1 A 76 76 VAL CA C 76 65.179 58.985 6.194 1 1 888 . 1 1 1 A 76 76 VAL CB C 76 32.174 29.316 2.858 1 1 891 . 1 1 1 A 76 76 VAL N N 76 117.992 119.940 -1.948 1 1 892 . 1 1 1 A 77 77 TRP H H 77 6.869 8.045 -1.176 1 1 893 . 1 1 1 A 77 77 TRP HA H 77 4.509 4.117 0.392 1 1 899 . 1 1 1 A 77 77 TRP CA C 77 59.207 57.702 1.505 1 1 900 . 1 1 1 A 77 77 TRP CB C 77 28.941 41.593 -12.652 1 1 901 . 1 1 1 A 77 77 TRP N N 77 123.077 121.377 1.700 1 1 903 . 1 1 1 A 78 78 GLU H H 78 8.593 8.321 0.272 1 1 904 . 1 1 1 A 78 78 GLU HA H 78 4.318 3.914 0.404 1 1 909 . 1 1 1 A 78 78 GLU CA C 78 60.038 59.154 0.884 1 1 910 . 1 1 1 A 78 78 GLU CB C 78 31.178 28.324 2.854 1 1 912 . 1 1 1 A 78 78 GLU N N 78 121.505 118.344 3.161 1 1 913 . 1 1 1 A 79 79 PHE H H 79 8.071 8.075 -0.004 1 1 914 . 1 1 1 A 79 79 PHE HA H 79 4.986 4.064 0.922 1 1 919 . 1 1 1 A 79 79 PHE CA C 79 58.749 58.786 -0.037 1 1 920 . 1 1 1 A 79 79 PHE CB C 79 39.732 28.929 10.803 1 1 921 . 1 1 1 A 79 79 PHE N N 79 118.384 118.148 0.236 1 1 922 . 1 1 1 A 80 80 LEU H H 80 9.309 7.939 1.370 1 1 923 . 1 1 1 A 80 80 LEU HA H 80 3.970 4.441 -0.471 1 1 933 . 1 1 1 A 80 80 LEU CA C 80 59.307 56.418 2.889 1 1 934 . 1 1 1 A 80 80 LEU CB C 80 43.257 38.151 5.106 1 1 937 . 1 1 1 A 80 80 LEU N N 80 122.915 118.375 4.540 1 1 938 . 1 1 1 A 81 81 GLU H H 81 8.282 8.029 0.253 1 1 939 . 1 1 1 A 81 81 GLU HA H 81 3.832 3.595 0.237 1 1 944 . 1 1 1 A 81 81 GLU CA C 81 62.069 65.130 -3.061 1 1 945 . 1 1 1 A 81 81 GLU CB C 81 30.249 38.152 -7.903 1 1 947 . 1 1 1 A 81 81 GLU N N 81 119.345 120.323 -0.978 1 1 948 . 1 1 1 A 82 82 LEU H H 82 8.236 7.953 0.283 1 1 949 . 1 1 1 A 82 82 LEU HA H 82 4.187 4.414 -0.227 1 1 959 . 1 1 1 A 82 82 LEU CA C 82 58.348 58.510 -0.162 1 1 960 . 1 1 1 A 82 82 LEU CB C 82 42.827 32.010 10.817 1 1 963 . 1 1 1 A 82 82 LEU N N 82 120.013 119.385 0.628 1 1 964 . 1 1 1 A 83 83 GLN H H 83 7.949 7.930 0.019 1 1 965 . 1 1 1 A 83 83 GLN HA H 83 3.812 3.952 -0.140 1 1 968 . 1 1 1 A 83 83 GLN CA C 83 60.248 58.104 2.144 1 1 969 . 1 1 1 A 83 83 GLN CB C 83 33.537 41.508 -7.971 1 1 970 . 1 1 1 A 83 83 GLN N N 83 116.443 120.400 -3.957 1 1 971 . 1 1 1 A 84 84 ILE H H 84 8.407 8.746 -0.339 1 1 972 . 1 1 1 A 84 84 ILE HA H 84 3.644 4.104 -0.460 1 1 982 . 1 1 1 A 84 84 ILE CA C 84 67.288 58.754 8.534 1 1 983 . 1 1 1 A 84 84 ILE CB C 84 38.305 29.102 9.203 1 1 987 . 1 1 1 A 84 84 ILE N N 84 120.422 117.987 2.435 1 1 988 . 1 1 1 A 85 85 GLU H H 85 7.741 8.210 -0.469 1 1 989 . 1 1 1 A 85 85 GLU HA H 85 3.811 4.938 -1.127 1 1 994 . 1 1 1 A 85 85 GLU CA C 85 59.862 53.080 6.782 1 1 995 . 1 1 1 A 85 85 GLU CB C 85 30.360 45.961 -15.601 1 1 997 . 1 1 1 A 85 85 GLU N N 85 115.705 116.672 -0.967 1 1 998 . 1 1 1 A 86 86 GLU H H 86 7.818 8.720 -0.902 1 1 999 . 1 1 1 A 86 86 GLU HA H 86 4.274 4.728 -0.454 1 1 1004 . 1 1 1 A 86 86 GLU CA C 86 58.068 55.840 2.228 1 1 1005 . 1 1 1 A 86 86 GLU CB C 86 31.424 33.497 -2.073 1 1 1007 . 1 1 1 A 86 86 GLU N N 86 114.297 118.628 -4.331 1 1 1008 . 1 1 1 A 87 87 ILE H H 87 8.753 8.437 0.316 1 1 1019 . 1 1 1 A 87 87 ILE CA C 87 62.660 44.688 17.972 1 1 1024 . 1 1 1 A 87 87 ILE N N 87 118.890 110.211 8.679 1 1 1025 . 1 1 1 A 88 88 TYR H H 88 8.059 8.863 -0.804 1 1 1026 . 1 1 1 A 88 88 TYR HA H 88 5.447 4.167 1.280 1 1 1033 . 1 1 1 A 88 88 TYR CA C 88 55.285 58.206 -2.921 1 1 1034 . 1 1 1 A 88 88 TYR CB C 88 40.687 32.300 8.387 1 1 1035 . 1 1 1 A 88 88 TYR N N 88 119.252 125.550 -6.298 1 1 1036 . 1 1 1 A 89 89 PRO HA H 89 4.410 3.977 0.433 1 1 1043 . 1 1 1 A 89 89 PRO CA C 89 66.374 59.512 6.862 1 1 1044 . 1 1 1 A 89 89 PRO CB C 89 31.377 29.114 2.263 1 1 1047 . 1 1 1 A 90 90 GLU H H 90 9.234 8.297 0.937 1 1 1048 . 1 1 1 A 90 90 GLU HA H 90 4.379 4.013 0.366 1 1 1053 . 1 1 1 A 90 90 GLU CA C 90 59.098 58.685 0.413 1 1 1054 . 1 1 1 A 90 90 GLU CB C 90 29.461 28.315 1.146 1 1 1056 . 1 1 1 A 90 90 GLU N N 90 117.574 118.075 -0.501 1 1 1057 . 1 1 1 A 91 91 GLU H H 91 7.966 7.991 -0.025 1 1 1058 . 1 1 1 A 91 91 GLU HA H 91 4.890 4.044 0.846 1 1 1063 . 1 1 1 A 91 91 GLU CA C 91 55.324 59.213 -3.889 1 1 1064 . 1 1 1 A 91 91 GLU CB C 91 31.590 29.561 2.029 1 1 1066 . 1 1 1 A 91 91 GLU N N 91 119.310 119.857 -0.547 1 1 1067 . 1 1 1 A 92 92 GLU H H 92 7.263 8.013 -0.750 1 1 1068 . 1 1 1 A 92 92 GLU HA H 92 3.789 3.980 -0.191 1 1 1073 . 1 1 1 A 92 92 GLU CA C 92 60.628 57.944 2.684 1 1 1074 . 1 1 1 A 92 92 GLU CB C 92 30.531 41.561 -11.030 1 1 1076 . 1 1 1 A 92 92 GLU N N 92 121.332 120.200 1.132 1 1 1077 . 1 1 1 A 93 93 GLU H H 93 8.646 7.953 0.693 1 1 1078 . 1 1 1 A 93 93 GLU HA H 93 4.127 4.088 0.039 1 1 1083 . 1 1 1 A 93 93 GLU CA C 93 60.528 55.413 5.115 1 1 1084 . 1 1 1 A 93 93 GLU CB C 93 29.744 18.247 11.497 1 1 1086 . 1 1 1 A 93 93 GLU N N 93 118.207 121.370 -3.163 1 1 1087 . 1 1 1 A 94 94 ILE H H 94 7.766 8.272 -0.506 1 1 1088 . 1 1 1 A 94 94 ILE HA H 94 3.976 3.920 0.056 1 1 1098 . 1 1 1 A 94 94 ILE CA C 94 64.361 58.152 6.209 1 1 1099 . 1 1 1 A 94 94 ILE CB C 94 38.921 41.383 -2.462 1 1 1103 . 1 1 1 A 94 94 ILE N N 94 119.072 118.146 0.926 1 1 1104 . 1 1 1 A 95 95 LEU H H 95 8.340 8.085 0.255 1 1 1105 . 1 1 1 A 95 95 LEU HA H 95 4.300 4.132 0.168 1 1 1115 . 1 1 1 A 95 95 LEU CA C 95 57.905 59.502 -1.597 1 1 1116 . 1 1 1 A 95 95 LEU CB C 95 42.144 29.229 12.915 1 1 1119 . 1 1 1 A 95 95 LEU N N 95 121.325 117.787 3.538 1 1 1120 . 1 1 1 A 96 96 LYS H H 96 8.899 7.984 0.915 1 1 1121 . 1 1 1 A 96 96 LYS HA H 96 4.075 4.032 0.043 1 1 1126 . 1 1 1 A 96 96 LYS CA C 96 61.707 57.913 3.794 1 1 1127 . 1 1 1 A 96 96 LYS CB C 96 32.910 41.708 -8.798 1 1 1128 . 1 1 1 A 96 96 LYS N N 96 120.018 122.091 -2.073 1 1 1129 . 1 1 1 A 97 97 LYS H H 97 7.808 8.004 -0.196 1 1 1130 . 1 1 1 A 97 97 LYS HA H 97 4.045 4.304 -0.259 1 1 1139 . 1 1 1 A 97 97 LYS CA C 97 60.198 56.147 4.051 1 1 1140 . 1 1 1 A 97 97 LYS CB C 97 32.600 41.256 -8.656 1 1 1143 . 1 1 1 A 97 97 LYS N N 97 121.016 115.603 5.413 1 1 1144 . 1 1 1 A 98 98 ALA H H 98 7.814 8.269 -0.455 1 1 1145 . 1 1 1 A 98 98 ALA HA H 98 4.320 4.735 -0.415 1 1 1149 . 1 1 1 A 98 98 ALA CA C 98 55.260 54.647 0.613 1 1 1150 . 1 1 1 A 98 98 ALA CB C 98 19.468 39.422 -19.954 1 1 1151 . 1 1 1 A 98 98 ALA N N 98 122.102 116.757 5.345 1 1 1152 . 1 1 1 A 99 99 LEU H H 99 8.212 7.824 0.388 1 1 1153 . 1 1 1 A 99 99 LEU HA H 99 4.187 4.743 -0.556 1 1 1160 . 1 1 1 A 99 99 LEU CA C 99 58.398 56.291 2.107 1 1 1161 . 1 1 1 A 99 99 LEU CB C 99 42.720 36.644 6.076 1 1 1164 . 1 1 1 A 99 99 LEU N N 99 118.467 115.605 2.862 1 1 1165 . 1 1 1 A 100 100 ARG H H 100 7.738 7.513 0.225 1 1 1166 . 1 1 1 A 100 100 ARG HA H 100 3.894 5.221 -1.327 1 1 1173 . 1 1 1 A 100 100 ARG CA C 100 60.135 52.797 7.338 1 1 1174 . 1 1 1 A 100 100 ARG CB C 100 30.187 45.363 -15.176 1 1 1177 . 1 1 1 A 100 100 ARG N N 100 119.100 117.771 1.329 1 1 1178 . 1 1 1 A 101 101 ASP H H 101 8.186 7.952 0.234 1 1 1179 . 1 1 1 A 101 101 ASP HA H 101 4.424 4.796 -0.372 1 1 1182 . 1 1 1 A 101 101 ASP CA C 101 57.902 51.156 6.746 1 1 1183 . 1 1 1 A 101 101 ASP CB C 101 40.033 40.888 -0.855 1 1 1184 . 1 1 1 A 101 101 ASP N N 101 121.899 119.127 2.772 1 1 1185 . 1 1 1 A 102 102 LEU H H 102 8.730 8.523 0.207 1 1 1186 . 1 1 1 A 102 102 LEU HA H 102 4.373 4.343 0.030 1 1 1195 . 1 1 1 A 102 102 LEU CA C 102 58.218 56.533 1.685 1 1 1196 . 1 1 1 A 102 102 LEU CB C 102 42.839 29.951 12.888 1 1 1199 . 1 1 1 A 102 102 LEU N N 102 124.505 122.798 1.707 1 1 1200 . 1 1 1 A 103 103 LYS HA H 103 3.726 4.432 -0.706 1 1 1209 . 1 1 1 A 103 103 LYS CA C 103 59.760 56.109 3.651 1 1 1210 . 1 1 1 A 103 103 LYS CB C 103 32.822 33.615 -0.793 1 1 1214 . 1 1 1 A 104 104 ARG H H 104 7.409 8.333 -0.924 1 1 1222 . 1 1 1 A 104 104 ARG CA C 104 56.298 45.221 11.077 1 1 1226 . 1 1 1 A 104 104 ARG N N 104 115.912 106.413 9.499 1 1 1227 . 1 1 1 A 105 105 GLY H H 105 8.046 7.545 0.501 1 1 1230 . 1 1 1 A 105 105 GLY CA C 105 46.309 55.405 -9.096 1 1 1231 . 1 1 1 A 105 105 GLY N N 105 108.860 115.314 -6.454 1 1 1232 . 1 1 1 A 106 106 LYS H H 106 8.033 8.509 -0.476 1 1 1233 . 1 1 1 A 106 106 LYS HA H 106 4.394 4.303 0.091 1 1 1242 . 1 1 1 A 106 106 LYS CA C 106 55.822 55.278 0.544 1 1 1243 . 1 1 1 A 106 106 LYS CB C 106 33.449 42.630 -9.181 1 1 1246 . 1 1 1 A 106 106 LYS N N 106 121.082 118.307 2.775 1 1 1247 . 1 1 1 A 107 107 LYS H H 107 8.271 8.452 -0.181 1 1 1248 . 1 1 1 A 107 107 LYS HA H 107 4.329 4.411 -0.082 1 1 1255 . 1 1 1 A 107 107 LYS CA C 107 56.673 59.074 -2.401 1 1 1256 . 1 1 1 A 107 107 LYS CB C 107 33.341 64.210 -30.869 1 1 1258 . 1 1 1 A 107 107 LYS N N 107 121.869 114.577 7.292 1 1 1259 . 1 1 1 A 108 108 LEU H H 108 8.481 7.370 1.111 1 1 1260 . 1 1 1 A 108 108 LEU HA H 108 4.637 5.019 -0.382 1 1 1269 . 1 1 1 A 108 108 LEU CA C 108 53.819 54.583 -0.764 1 1 1270 . 1 1 1 A 108 108 LEU CB C 108 45.135 35.373 9.762 1 1 1272 . 1 1 1 A 108 108 LEU N N 108 124.360 117.319 7.041 1 1 1273 . 1 1 1 A 109 109 LYS H H 109 8.657 8.949 -0.292 1 1 1274 . 1 1 1 A 109 109 LYS HA H 109 4.565 4.578 -0.013 1 1 1283 . 1 1 1 A 109 109 LYS CA C 109 55.511 58.499 -2.988 1 1 1284 . 1 1 1 A 109 109 LYS CB C 109 32.029 64.120 -32.091 1 1 1287 . 1 1 1 A 109 109 LYS N N 109 123.165 117.422 5.743 1 1 1288 . 1 1 1 A 110 110 PRO HA H 110 4.232 3.590 0.642 1 1 1295 . 1 1 1 A 110 110 PRO CA C 110 66.732 66.641 0.091 1 1 1296 . 1 1 1 A 110 110 PRO CB C 110 32.481 31.565 0.916 1 1 1299 . 1 1 1 A 111 111 GLU HA H 111 4.221 3.872 0.349 1 1 1304 . 1 1 1 A 111 111 GLU CA C 111 59.819 59.827 -0.008 1 1 1305 . 1 1 1 A 111 111 GLU CB C 111 29.250 29.132 0.118 1 1 1307 . 1 1 1 A 112 112 ILE H H 112 7.233 8.232 -0.999 1 1 1308 . 1 1 1 A 112 112 ILE HA H 112 3.848 4.069 -0.221 1 1 1318 . 1 1 1 A 112 112 ILE CA C 112 62.635 59.161 3.474 1 1 1319 . 1 1 1 A 112 112 ILE CB C 112 37.159 29.279 7.880 1 1 1323 . 1 1 1 A 112 112 ILE N N 112 120.783 118.137 2.646 1 1 1324 . 1 1 1 A 113 113 LYS H H 113 8.268 7.877 0.391 1 1 1325 . 1 1 1 A 113 113 LYS HA H 113 3.849 3.648 0.201 1 1 1328 . 1 1 1 A 113 113 LYS CA C 113 60.248 65.076 -4.828 1 1 1329 . 1 1 1 A 113 113 LYS CB C 113 32.668 37.498 -4.830 1 1 1330 . 1 1 1 A 113 113 LYS N N 113 121.680 121.693 -0.013 1 1 1331 . 1 1 1 A 114 114 GLY H H 114 8.460 8.240 0.220 1 1 1334 . 1 1 1 A 114 114 GLY CA C 114 47.600 61.155 -13.555 1 1 1335 . 1 1 1 A 114 114 GLY N N 114 105.413 116.669 -11.256 1 1 1336 . 1 1 1 A 115 115 LYS H H 115 7.352 7.891 -0.539 1 1 1337 . 1 1 1 A 115 115 LYS HA H 115 4.189 4.440 -0.251 1 1 1346 . 1 1 1 A 115 115 LYS CA C 115 59.689 57.282 2.407 1 1 1347 . 1 1 1 A 115 115 LYS CB C 115 33.428 40.719 -7.291 1 1 1351 . 1 1 1 A 115 115 LYS N N 115 121.599 121.370 0.229 1 1 1352 . 1 1 1 A 116 116 LEU H H 116 8.046 7.945 0.101 1 1 1353 . 1 1 1 A 116 116 LEU HA H 116 4.153 3.866 0.287 1 1 1363 . 1 1 1 A 116 116 LEU CA C 116 57.698 64.856 -7.158 1 1 1364 . 1 1 1 A 116 116 LEU CB C 116 42.070 31.586 10.484 1 1 1366 . 1 1 1 A 116 116 LEU N N 116 118.827 118.992 -0.165 1 1 1367 . 1 1 1 A 117 117 SER H H 117 8.321 7.537 0.784 1 1 1368 . 1 1 1 A 117 117 SER HA H 117 4.334 4.201 0.133 1 1 1371 . 1 1 1 A 117 117 SER CA C 117 61.467 54.312 7.155 1 1 1372 . 1 1 1 A 117 117 SER CB C 117 63.613 42.086 21.527 1 1 1373 . 1 1 1 A 117 117 SER N N 117 114.829 116.477 -1.648 1 1 1374 . 1 1 1 A 118 118 ARG H H 118 7.001 7.816 -0.815 1 1 1375 . 1 1 1 A 118 118 ARG HA H 118 4.403 3.857 0.546 1 1 1382 . 1 1 1 A 118 118 ARG CA C 118 56.734 57.037 -0.303 1 1 1383 . 1 1 1 A 118 118 ARG CB C 118 31.115 27.271 3.844 1 1 1385 . 1 1 1 A 118 118 ARG N N 118 118.114 114.256 3.858 1 1 1386 . 1 1 1 A 119 119 LEU H H 119 7.365 8.263 -0.898 1 1 1387 . 1 1 1 A 119 119 LEU HA H 119 4.253 4.882 -0.629 1 1 1397 . 1 1 1 A 119 119 LEU CA C 119 54.639 57.746 -3.107 1 1 1398 . 1 1 1 A 119 119 LEU CB C 119 41.700 31.238 10.462 1 1 1401 . 1 1 1 A 119 119 LEU N N 119 119.181 117.438 1.743 1 1 1402 . 1 1 1 A 120 120 ARG H H 120 8.766 8.681 0.085 1 1 1403 . 1 1 1 A 120 120 ARG HA H 120 4.374 4.510 -0.136 1 1 1410 . 1 1 1 A 120 120 ARG CA C 120 56.426 59.451 -3.025 1 1 1411 . 1 1 1 A 120 120 ARG CB C 120 32.414 63.869 -31.455 1 1 1414 . 1 1 1 A 120 120 ARG N N 120 122.099 120.432 1.667 1 1 1415 . 1 1 1 A 121 121 LEU H H 121 8.312 8.832 -0.520 1 1 1416 . 1 1 1 A 121 121 LEU HA H 121 4.407 3.702 0.705 1 1 1426 . 1 1 1 A 121 121 LEU CA C 121 56.028 65.832 -9.804 1 1 1427 . 1 1 1 A 121 121 LEU CB C 121 43.122 31.549 11.573 1 1 1430 . 1 1 1 A 121 121 LEU N N 121 118.761 123.246 -4.485 1 1 1431 . 1 1 1 A 122 122 PHE H H 122 7.143 8.422 -1.279 1 1 1432 . 1 1 1 A 122 122 PHE HA H 122 5.201 4.094 1.107 1 1 1439 . 1 1 1 A 122 122 PHE CA C 122 53.047 59.144 -6.097 1 1 1440 . 1 1 1 A 122 122 PHE CB C 122 40.844 29.466 11.378 1 1 1441 . 1 1 1 A 122 122 PHE N N 122 112.750 120.912 -8.162 1 1 1442 . 1 1 1 A 123 123 PRO HA H 123 3.908 4.008 -0.100 1 1 1449 . 1 1 1 A 123 123 PRO CA C 123 65.478 59.172 6.306 1 1 1450 . 1 1 1 A 123 123 PRO CB C 123 33.248 29.276 3.972 1 1 1452 . 1 1 1 A 124 124 LEU H H 124 7.208 8.365 -1.157 1 1 1453 . 1 1 1 A 124 124 LEU HA H 124 4.673 4.068 0.605 1 1 1463 . 1 1 1 A 124 124 LEU CA C 124 53.307 57.574 -4.267 1 1 1464 . 1 1 1 A 124 124 LEU CB C 124 42.853 41.929 0.924 1 1 1468 . 1 1 1 A 124 124 LEU N N 124 113.875 121.746 -7.871 1 1 1469 . 1 1 1 A 125 125 SER H H 125 8.990 8.250 0.740 1 1 1470 . 1 1 1 A 125 125 SER HA H 125 4.533 4.001 0.532 1 1 1473 . 1 1 1 A 125 125 SER CA C 125 59.198 59.611 -0.413 1 1 1474 . 1 1 1 A 125 125 SER CB C 125 64.578 29.303 35.275 1 1 1475 . 1 1 1 A 125 125 SER N N 125 117.894 119.890 -1.996 1 1 1476 . 1 1 1 A 126 126 SER H H 126 8.618 7.826 0.792 1 1 1477 . 1 1 1 A 126 126 SER HA H 126 4.614 3.996 0.618 1 1 1480 . 1 1 1 A 126 126 SER CA C 126 58.730 59.627 -0.897 1 1 1481 . 1 1 1 A 126 126 SER CB C 126 64.367 32.347 32.020 1 1 1482 . 1 1 1 A 126 126 SER N N 126 118.602 119.194 -0.592 1 1 1483 . 1 1 1 A 127 127 SER HA H 127 4.530 3.784 0.746 1 1 1486 . 1 1 1 A 127 127 SER CA C 127 58.954 65.693 -6.739 1 1 1487 . 1 1 1 A 127 127 SER CB C 127 64.379 31.533 32.846 1 1 1488 . 1 1 1 A 128 128 ALA H H 128 8.345 8.213 0.132 1 1 1489 . 1 1 1 A 128 128 ALA HA H 128 4.432 3.964 0.468 1 1 1493 . 1 1 1 A 128 128 ALA CA C 128 52.963 59.113 -6.150 1 1 1494 . 1 1 1 A 128 128 ALA CB C 128 19.924 29.674 -9.750 1 1 1495 . 1 1 1 A 128 128 ALA N N 128 126.185 122.133 4.052 1 1 1496 . 1 1 1 A 129 129 GLU H H 129 8.329 8.021 0.308 1 1 1497 . 1 1 1 A 129 129 GLU HA H 129 4.353 4.085 0.268 1 1 1502 . 1 1 1 A 129 129 GLU CA C 129 57.111 58.667 -1.556 1 1 1503 . 1 1 1 A 129 129 GLU CB C 129 30.949 28.498 2.451 1 1 1504 . 1 1 1 A 129 129 GLU N N 129 120.842 118.641 2.201 1 1 1505 . 1 1 1 A 130 130 LYS H H 130 7.947 7.987 -0.040 1 1 1506 . 1 1 1 A 130 130 LYS HA H 130 3.835 4.055 -0.220 1 1 1515 . 1 1 1 A 130 130 LYS CA C 130 57.756 59.720 -1.964 1 1 1516 . 1 1 1 A 130 130 LYS CB C 130 33.156 32.103 1.053 1 1 826 . 2 1 1 A 70 70 GLY H H 70 9.295 8.406 0.889 1 1 829 . 2 1 1 A 70 70 GLY CA C 70 46.552 59.868 -13.316 1 1 830 . 2 1 1 A 70 70 GLY N N 70 108.643 117.151 -8.508 1 1 832 . 2 1 1 A 71 71 VAL HA H 71 3.538 4.794 -1.256 1 1 840 . 2 1 1 A 71 71 VAL CA C 71 65.623 62.758 2.865 1 1 841 . 2 1 1 A 71 71 VAL CB C 71 30.251 31.972 -1.721 1 1 844 . 2 1 1 A 71 71 VAL N N 71 110.808 136.445 -25.637 1 1 845 . 2 1 1 A 72 72 CYS H H 72 8.022 8.340 -0.318 1 1 846 . 2 1 1 A 72 72 CYS HA H 72 3.469 4.790 -1.321 1 1 849 . 2 1 1 A 72 72 CYS CA C 72 62.733 57.702 5.031 1 1 850 . 2 1 1 A 72 72 CYS CB C 72 27.163 63.776 -36.613 1 1 851 . 2 1 1 A 72 72 CYS N N 72 109.483 114.033 -4.550 1 1 852 . 2 1 1 A 73 73 SER H H 73 7.996 8.347 -0.351 1 1 853 . 2 1 1 A 73 73 SER HA H 73 4.439 4.135 0.304 1 1 856 . 2 1 1 A 73 73 SER CA C 73 62.145 59.373 2.772 1 1 857 . 2 1 1 A 73 73 SER CB C 73 66.013 29.322 36.691 1 1 858 . 2 1 1 A 73 73 SER N N 73 118.630 122.868 -4.238 1 1 859 . 2 1 1 A 74 74 LYS H H 74 10.186 7.970 2.216 1 1 860 . 2 1 1 A 74 74 LYS HA H 74 4.172 3.991 0.181 1 1 867 . 2 1 1 A 74 74 LYS CA C 74 59.848 58.401 1.447 1 1 868 . 2 1 1 A 74 74 LYS CB C 74 34.278 41.466 -7.188 1 1 870 . 2 1 1 A 74 74 LYS N N 74 123.341 117.509 5.832 1 1 871 . 2 1 1 A 75 75 ASP H H 75 7.542 8.245 -0.703 1 1 872 . 2 1 1 A 75 75 ASP HA H 75 3.538 3.941 -0.403 1 1 875 . 2 1 1 A 75 75 ASP CA C 75 52.472 59.870 -7.398 1 1 876 . 2 1 1 A 75 75 ASP CB C 75 42.360 29.296 13.064 1 1 877 . 2 1 1 A 75 75 ASP N N 75 112.035 119.686 -7.651 1 1 878 . 2 1 1 A 76 76 VAL H H 76 8.128 8.358 -0.230 1 1 879 . 2 1 1 A 76 76 VAL HA H 76 4.106 4.035 0.071 1 1 887 . 2 1 1 A 76 76 VAL CA C 76 65.179 59.178 6.001 1 1 888 . 2 1 1 A 76 76 VAL CB C 76 32.174 29.029 3.145 1 1 891 . 2 1 1 A 76 76 VAL N N 76 117.992 120.579 -2.587 1 1 892 . 2 1 1 A 77 77 TRP H H 77 6.869 7.971 -1.102 1 1 893 . 2 1 1 A 77 77 TRP HA H 77 4.509 4.105 0.404 1 1 899 . 2 1 1 A 77 77 TRP CA C 77 59.207 57.806 1.401 1 1 900 . 2 1 1 A 77 77 TRP CB C 77 28.941 41.508 -12.567 1 1 901 . 2 1 1 A 77 77 TRP N N 77 123.077 121.484 1.593 1 1 903 . 2 1 1 A 78 78 GLU H H 78 8.593 8.270 0.323 1 1 904 . 2 1 1 A 78 78 GLU HA H 78 4.318 3.904 0.414 1 1 909 . 2 1 1 A 78 78 GLU CA C 78 60.038 59.219 0.819 1 1 910 . 2 1 1 A 78 78 GLU CB C 78 31.178 28.399 2.779 1 1 912 . 2 1 1 A 78 78 GLU N N 78 121.505 117.863 3.642 1 1 913 . 2 1 1 A 79 79 PHE H H 79 8.071 8.162 -0.091 1 1 914 . 2 1 1 A 79 79 PHE HA H 79 4.986 4.079 0.907 1 1 919 . 2 1 1 A 79 79 PHE CA C 79 58.749 58.670 0.079 1 1 920 . 2 1 1 A 79 79 PHE CB C 79 39.732 28.948 10.784 1 1 921 . 2 1 1 A 79 79 PHE N N 79 118.384 118.129 0.255 1 1 922 . 2 1 1 A 80 80 LEU H H 80 9.309 7.897 1.412 1 1 923 . 2 1 1 A 80 80 LEU HA H 80 3.970 4.447 -0.477 1 1 933 . 2 1 1 A 80 80 LEU CA C 80 59.307 56.458 2.849 1 1 934 . 2 1 1 A 80 80 LEU CB C 80 43.257 38.230 5.027 1 1 937 . 2 1 1 A 80 80 LEU N N 80 122.915 118.366 4.549 1 1 938 . 2 1 1 A 81 81 GLU H H 81 8.282 7.968 0.314 1 1 939 . 2 1 1 A 81 81 GLU HA H 81 3.832 3.601 0.231 1 1 944 . 2 1 1 A 81 81 GLU CA C 81 62.069 65.001 -2.932 1 1 945 . 2 1 1 A 81 81 GLU CB C 81 30.249 38.182 -7.933 1 1 947 . 2 1 1 A 81 81 GLU N N 81 119.345 120.346 -1.001 1 1 948 . 2 1 1 A 82 82 LEU H H 82 8.236 7.935 0.301 1 1 949 . 2 1 1 A 82 82 LEU HA H 82 4.187 4.452 -0.265 1 1 959 . 2 1 1 A 82 82 LEU CA C 82 58.348 58.631 -0.283 1 1 960 . 2 1 1 A 82 82 LEU CB C 82 42.827 32.140 10.687 1 1 963 . 2 1 1 A 82 82 LEU N N 82 120.013 119.436 0.577 1 1 964 . 2 1 1 A 83 83 GLN H H 83 7.949 8.117 -0.168 1 1 965 . 2 1 1 A 83 83 GLN HA H 83 3.812 3.857 -0.045 1 1 968 . 2 1 1 A 83 83 GLN CA C 83 60.248 58.123 2.125 1 1 969 . 2 1 1 A 83 83 GLN CB C 83 33.537 41.464 -7.927 1 1 970 . 2 1 1 A 83 83 GLN N N 83 116.443 120.606 -4.163 1 1 971 . 2 1 1 A 84 84 ILE H H 84 8.407 8.323 0.084 1 1 972 . 2 1 1 A 84 84 ILE HA H 84 3.644 4.109 -0.465 1 1 982 . 2 1 1 A 84 84 ILE CA C 84 67.288 58.974 8.314 1 1 983 . 2 1 1 A 84 84 ILE CB C 84 38.305 29.124 9.181 1 1 987 . 2 1 1 A 84 84 ILE N N 84 120.422 117.887 2.535 1 1 988 . 2 1 1 A 85 85 GLU H H 85 7.741 8.011 -0.270 1 1 989 . 2 1 1 A 85 85 GLU HA H 85 3.811 5.033 -1.222 1 1 994 . 2 1 1 A 85 85 GLU CA C 85 59.862 52.546 7.316 1 1 995 . 2 1 1 A 85 85 GLU CB C 85 30.360 45.838 -15.478 1 1 997 . 2 1 1 A 85 85 GLU N N 85 115.705 117.213 -1.508 1 1 998 . 2 1 1 A 86 86 GLU H H 86 7.818 8.739 -0.921 1 1 999 . 2 1 1 A 86 86 GLU HA H 86 4.274 4.688 -0.414 1 1 1004 . 2 1 1 A 86 86 GLU CA C 86 58.068 55.898 2.170 1 1 1005 . 2 1 1 A 86 86 GLU CB C 86 31.424 33.233 -1.809 1 1 1007 . 2 1 1 A 86 86 GLU N N 86 114.297 118.570 -4.273 1 1 1008 . 2 1 1 A 87 87 ILE H H 87 8.753 8.442 0.311 1 1 1019 . 2 1 1 A 87 87 ILE CA C 87 62.660 44.638 18.022 1 1 1024 . 2 1 1 A 87 87 ILE N N 87 118.890 110.102 8.788 1 1 1025 . 2 1 1 A 88 88 TYR H H 88 8.059 8.864 -0.805 1 1 1026 . 2 1 1 A 88 88 TYR HA H 88 5.447 4.173 1.274 1 1 1033 . 2 1 1 A 88 88 TYR CA C 88 55.285 58.117 -2.832 1 1 1034 . 2 1 1 A 88 88 TYR CB C 88 40.687 32.335 8.352 1 1 1035 . 2 1 1 A 88 88 TYR N N 88 119.252 125.575 -6.323 1 1 1036 . 2 1 1 A 89 89 PRO HA H 89 4.410 3.983 0.427 1 1 1043 . 2 1 1 A 89 89 PRO CA C 89 66.374 59.522 6.852 1 1 1044 . 2 1 1 A 89 89 PRO CB C 89 31.377 29.123 2.254 1 1 1047 . 2 1 1 A 90 90 GLU H H 90 9.234 8.262 0.972 1 1 1048 . 2 1 1 A 90 90 GLU HA H 90 4.379 4.016 0.363 1 1 1053 . 2 1 1 A 90 90 GLU CA C 90 59.098 58.662 0.436 1 1 1054 . 2 1 1 A 90 90 GLU CB C 90 29.461 28.485 0.976 1 1 1056 . 2 1 1 A 90 90 GLU N N 90 117.574 118.003 -0.429 1 1 1057 . 2 1 1 A 91 91 GLU H H 91 7.966 7.990 -0.024 1 1 1058 . 2 1 1 A 91 91 GLU HA H 91 4.890 4.015 0.875 1 1 1063 . 2 1 1 A 91 91 GLU CA C 91 55.324 59.220 -3.896 1 1 1064 . 2 1 1 A 91 91 GLU CB C 91 31.590 29.564 2.026 1 1 1066 . 2 1 1 A 91 91 GLU N N 91 119.310 119.836 -0.526 1 1 1067 . 2 1 1 A 92 92 GLU H H 92 7.263 8.022 -0.759 1 1 1068 . 2 1 1 A 92 92 GLU HA H 92 3.789 3.980 -0.191 1 1 1073 . 2 1 1 A 92 92 GLU CA C 92 60.628 57.945 2.683 1 1 1074 . 2 1 1 A 92 92 GLU CB C 92 30.531 41.600 -11.069 1 1 1076 . 2 1 1 A 92 92 GLU N N 92 121.332 120.187 1.145 1 1 1077 . 2 1 1 A 93 93 GLU H H 93 8.646 7.966 0.680 1 1 1078 . 2 1 1 A 93 93 GLU HA H 93 4.127 4.097 0.030 1 1 1083 . 2 1 1 A 93 93 GLU CA C 93 60.528 55.410 5.118 1 1 1084 . 2 1 1 A 93 93 GLU CB C 93 29.744 18.339 11.405 1 1 1086 . 2 1 1 A 93 93 GLU N N 93 118.207 121.473 -3.266 1 1 1087 . 2 1 1 A 94 94 ILE H H 94 7.766 8.300 -0.534 1 1 1088 . 2 1 1 A 94 94 ILE HA H 94 3.976 3.922 0.054 1 1 1098 . 2 1 1 A 94 94 ILE CA C 94 64.361 58.151 6.210 1 1 1099 . 2 1 1 A 94 94 ILE CB C 94 38.921 41.475 -2.554 1 1 1103 . 2 1 1 A 94 94 ILE N N 94 119.072 118.105 0.967 1 1 1104 . 2 1 1 A 95 95 LEU H H 95 8.340 8.064 0.276 1 1 1105 . 2 1 1 A 95 95 LEU HA H 95 4.300 4.165 0.135 1 1 1115 . 2 1 1 A 95 95 LEU CA C 95 57.905 59.524 -1.619 1 1 1116 . 2 1 1 A 95 95 LEU CB C 95 42.144 29.242 12.902 1 1 1119 . 2 1 1 A 95 95 LEU N N 95 121.325 117.929 3.396 1 1 1120 . 2 1 1 A 96 96 LYS H H 96 8.899 8.011 0.888 1 1 1121 . 2 1 1 A 96 96 LYS HA H 96 4.075 4.039 0.036 1 1 1126 . 2 1 1 A 96 96 LYS CA C 96 61.707 57.850 3.857 1 1 1127 . 2 1 1 A 96 96 LYS CB C 96 32.910 41.673 -8.763 1 1 1128 . 2 1 1 A 96 96 LYS N N 96 120.018 122.095 -2.077 1 1 1129 . 2 1 1 A 97 97 LYS H H 97 7.808 7.969 -0.161 1 1 1130 . 2 1 1 A 97 97 LYS HA H 97 4.045 4.330 -0.285 1 1 1139 . 2 1 1 A 97 97 LYS CA C 97 60.198 56.097 4.101 1 1 1140 . 2 1 1 A 97 97 LYS CB C 97 32.600 41.280 -8.680 1 1 1143 . 2 1 1 A 97 97 LYS N N 97 121.016 115.831 5.185 1 1 1144 . 2 1 1 A 98 98 ALA H H 98 7.814 8.283 -0.469 1 1 1145 . 2 1 1 A 98 98 ALA HA H 98 4.320 4.675 -0.355 1 1 1149 . 2 1 1 A 98 98 ALA CA C 98 55.260 54.553 0.707 1 1 1150 . 2 1 1 A 98 98 ALA CB C 98 19.468 39.443 -19.975 1 1 1151 . 2 1 1 A 98 98 ALA N N 98 122.102 116.779 5.323 1 1 1152 . 2 1 1 A 99 99 LEU H H 99 8.212 7.778 0.434 1 1 1153 . 2 1 1 A 99 99 LEU HA H 99 4.187 4.783 -0.596 1 1 1160 . 2 1 1 A 99 99 LEU CA C 99 58.398 56.632 1.766 1 1 1161 . 2 1 1 A 99 99 LEU CB C 99 42.720 36.778 5.942 1 1 1164 . 2 1 1 A 99 99 LEU N N 99 118.467 115.403 3.064 1 1 1165 . 2 1 1 A 100 100 ARG H H 100 7.738 7.548 0.190 1 1 1166 . 2 1 1 A 100 100 ARG HA H 100 3.894 5.256 -1.362 1 1 1173 . 2 1 1 A 100 100 ARG CA C 100 60.135 52.782 7.353 1 1 1174 . 2 1 1 A 100 100 ARG CB C 100 30.187 45.726 -15.539 1 1 1177 . 2 1 1 A 100 100 ARG N N 100 119.100 117.878 1.222 1 1 1178 . 2 1 1 A 101 101 ASP H H 101 8.186 8.049 0.137 1 1 1179 . 2 1 1 A 101 101 ASP HA H 101 4.424 4.978 -0.554 1 1 1182 . 2 1 1 A 101 101 ASP CA C 101 57.902 51.773 6.129 1 1 1183 . 2 1 1 A 101 101 ASP CB C 101 40.033 40.661 -0.628 1 1 1184 . 2 1 1 A 101 101 ASP N N 101 121.899 116.918 4.981 1 1 1185 . 2 1 1 A 102 102 LEU H H 102 8.730 8.590 0.140 1 1 1186 . 2 1 1 A 102 102 LEU HA H 102 4.373 4.206 0.167 1 1 1195 . 2 1 1 A 102 102 LEU CA C 102 58.218 58.097 0.121 1 1 1196 . 2 1 1 A 102 102 LEU CB C 102 42.839 29.239 13.600 1 1 1199 . 2 1 1 A 102 102 LEU N N 102 124.505 121.083 3.422 1 1 1200 . 2 1 1 A 103 103 LYS HA H 103 3.726 4.321 -0.595 1 1 1209 . 2 1 1 A 103 103 LYS CA C 103 59.760 56.095 3.665 1 1 1210 . 2 1 1 A 103 103 LYS CB C 103 32.822 32.967 -0.145 1 1 1214 . 2 1 1 A 104 104 ARG H H 104 7.409 7.996 -0.587 1 1 1222 . 2 1 1 A 104 104 ARG CA C 104 56.298 45.225 11.073 1 1 1226 . 2 1 1 A 104 104 ARG N N 104 115.912 106.109 9.803 1 1 1227 . 2 1 1 A 105 105 GLY H H 105 8.046 7.699 0.347 1 1 1230 . 2 1 1 A 105 105 GLY CA C 105 46.309 55.297 -8.988 1 1 1231 . 2 1 1 A 105 105 GLY N N 105 108.860 115.845 -6.985 1 1 1232 . 2 1 1 A 106 106 LYS H H 106 8.033 8.410 -0.377 1 1 1233 . 2 1 1 A 106 106 LYS HA H 106 4.394 4.245 0.149 1 1 1242 . 2 1 1 A 106 106 LYS CA C 106 55.822 55.194 0.628 1 1 1243 . 2 1 1 A 106 106 LYS CB C 106 33.449 42.580 -9.131 1 1 1246 . 2 1 1 A 106 106 LYS N N 106 121.082 118.212 2.870 1 1 1247 . 2 1 1 A 107 107 LYS H H 107 8.271 8.645 -0.374 1 1 1248 . 2 1 1 A 107 107 LYS HA H 107 4.329 4.420 -0.091 1 1 1255 . 2 1 1 A 107 107 LYS CA C 107 56.673 59.204 -2.531 1 1 1256 . 2 1 1 A 107 107 LYS CB C 107 33.341 64.262 -30.921 1 1 1258 . 2 1 1 A 107 107 LYS N N 107 121.869 114.433 7.436 1 1 1259 . 2 1 1 A 108 108 LEU H H 108 8.481 7.471 1.010 1 1 1260 . 2 1 1 A 108 108 LEU HA H 108 4.637 4.952 -0.315 1 1 1269 . 2 1 1 A 108 108 LEU CA C 108 53.819 54.387 -0.568 1 1 1270 . 2 1 1 A 108 108 LEU CB C 108 45.135 36.035 9.100 1 1 1272 . 2 1 1 A 108 108 LEU N N 108 124.360 117.308 7.052 1 1 1273 . 2 1 1 A 109 109 LYS H H 109 8.657 8.922 -0.265 1 1 1274 . 2 1 1 A 109 109 LYS HA H 109 4.565 4.559 0.006 1 1 1283 . 2 1 1 A 109 109 LYS CA C 109 55.511 58.936 -3.425 1 1 1284 . 2 1 1 A 109 109 LYS CB C 109 32.029 64.168 -32.139 1 1 1287 . 2 1 1 A 109 109 LYS N N 109 123.165 117.807 5.358 1 1 1288 . 2 1 1 A 110 110 PRO HA H 110 4.232 3.588 0.644 1 1 1295 . 2 1 1 A 110 110 PRO CA C 110 66.732 66.692 0.040 1 1 1296 . 2 1 1 A 110 110 PRO CB C 110 32.481 31.596 0.885 1 1 1299 . 2 1 1 A 111 111 GLU HA H 111 4.221 3.927 0.294 1 1 1304 . 2 1 1 A 111 111 GLU CA C 111 59.819 59.953 -0.134 1 1 1305 . 2 1 1 A 111 111 GLU CB C 111 29.250 29.187 0.063 1 1 1307 . 2 1 1 A 112 112 ILE H H 112 7.233 8.133 -0.900 1 1 1308 . 2 1 1 A 112 112 ILE HA H 112 3.848 4.081 -0.233 1 1 1318 . 2 1 1 A 112 112 ILE CA C 112 62.635 59.189 3.446 1 1 1319 . 2 1 1 A 112 112 ILE CB C 112 37.159 29.328 7.831 1 1 1323 . 2 1 1 A 112 112 ILE N N 112 120.783 118.182 2.601 1 1 1324 . 2 1 1 A 113 113 LYS H H 113 8.268 8.050 0.218 1 1 1325 . 2 1 1 A 113 113 LYS HA H 113 3.849 3.701 0.148 1 1 1328 . 2 1 1 A 113 113 LYS CA C 113 60.248 65.271 -5.023 1 1 1329 . 2 1 1 A 113 113 LYS CB C 113 32.668 37.320 -4.652 1 1 1330 . 2 1 1 A 113 113 LYS N N 113 121.680 121.872 -0.192 1 1 1331 . 2 1 1 A 114 114 GLY H H 114 8.460 8.399 0.061 1 1 1334 . 2 1 1 A 114 114 GLY CA C 114 47.600 61.489 -13.889 1 1 1335 . 2 1 1 A 114 114 GLY N N 114 105.413 115.323 -9.910 1 1 1336 . 2 1 1 A 115 115 LYS H H 115 7.352 8.160 -0.808 1 1 1337 . 2 1 1 A 115 115 LYS HA H 115 4.189 4.351 -0.162 1 1 1346 . 2 1 1 A 115 115 LYS CA C 115 59.689 57.301 2.388 1 1 1347 . 2 1 1 A 115 115 LYS CB C 115 33.428 40.296 -6.868 1 1 1351 . 2 1 1 A 115 115 LYS N N 115 121.599 122.282 -0.683 1 1 1352 . 2 1 1 A 116 116 LEU H H 116 8.046 7.741 0.305 1 1 1353 . 2 1 1 A 116 116 LEU HA H 116 4.153 3.770 0.383 1 1 1363 . 2 1 1 A 116 116 LEU CA C 116 57.698 65.480 -7.782 1 1 1364 . 2 1 1 A 116 116 LEU CB C 116 42.070 31.433 10.637 1 1 1366 . 2 1 1 A 116 116 LEU N N 116 118.827 115.858 2.969 1 1 1367 . 2 1 1 A 117 117 SER H H 117 8.321 7.495 0.826 1 1 1368 . 2 1 1 A 117 117 SER HA H 117 4.334 4.214 0.120 1 1 1371 . 2 1 1 A 117 117 SER CA C 117 61.467 54.295 7.172 1 1 1372 . 2 1 1 A 117 117 SER CB C 117 63.613 42.006 21.607 1 1 1373 . 2 1 1 A 117 117 SER N N 117 114.829 118.309 -3.480 1 1 1374 . 2 1 1 A 118 118 ARG H H 118 7.001 7.629 -0.628 1 1 1375 . 2 1 1 A 118 118 ARG HA H 118 4.403 3.859 0.544 1 1 1382 . 2 1 1 A 118 118 ARG CA C 118 56.734 57.038 -0.304 1 1 1383 . 2 1 1 A 118 118 ARG CB C 118 31.115 27.257 3.858 1 1 1385 . 2 1 1 A 118 118 ARG N N 118 118.114 114.280 3.834 1 1 1386 . 2 1 1 A 119 119 LEU H H 119 7.365 8.258 -0.893 1 1 1387 . 2 1 1 A 119 119 LEU HA H 119 4.253 4.884 -0.631 1 1 1397 . 2 1 1 A 119 119 LEU CA C 119 54.639 57.750 -3.111 1 1 1398 . 2 1 1 A 119 119 LEU CB C 119 41.700 31.455 10.245 1 1 1401 . 2 1 1 A 119 119 LEU N N 119 119.181 117.430 1.751 1 1 1402 . 2 1 1 A 120 120 ARG H H 120 8.766 8.729 0.037 1 1 1403 . 2 1 1 A 120 120 ARG HA H 120 4.374 4.456 -0.082 1 1 1410 . 2 1 1 A 120 120 ARG CA C 120 56.426 59.233 -2.807 1 1 1411 . 2 1 1 A 120 120 ARG CB C 120 32.414 63.716 -31.302 1 1 1414 . 2 1 1 A 120 120 ARG N N 120 122.099 119.894 2.205 1 1 1415 . 2 1 1 A 121 121 LEU H H 121 8.312 8.721 -0.409 1 1 1416 . 2 1 1 A 121 121 LEU HA H 121 4.407 3.561 0.846 1 1 1426 . 2 1 1 A 121 121 LEU CA C 121 56.028 66.998 -10.970 1 1 1427 . 2 1 1 A 121 121 LEU CB C 121 43.122 32.017 11.105 1 1 1430 . 2 1 1 A 121 121 LEU N N 121 118.761 123.890 -5.129 1 1 1431 . 2 1 1 A 122 122 PHE H H 122 7.143 8.368 -1.225 1 1 1432 . 2 1 1 A 122 122 PHE HA H 122 5.201 4.069 1.132 1 1 1439 . 2 1 1 A 122 122 PHE CA C 122 53.047 59.150 -6.103 1 1 1440 . 2 1 1 A 122 122 PHE CB C 122 40.844 29.364 11.480 1 1 1441 . 2 1 1 A 122 122 PHE N N 122 112.750 120.137 -7.387 1 1 1442 . 2 1 1 A 123 123 PRO HA H 123 3.908 3.992 -0.084 1 1 1449 . 2 1 1 A 123 123 PRO CA C 123 65.478 59.236 6.242 1 1 1450 . 2 1 1 A 123 123 PRO CB C 123 33.248 29.345 3.903 1 1 1452 . 2 1 1 A 124 124 LEU H H 124 7.208 7.997 -0.789 1 1 1453 . 2 1 1 A 124 124 LEU HA H 124 4.673 4.049 0.624 1 1 1463 . 2 1 1 A 124 124 LEU CA C 124 53.307 57.672 -4.365 1 1 1464 . 2 1 1 A 124 124 LEU CB C 124 42.853 41.699 1.154 1 1 1468 . 2 1 1 A 124 124 LEU N N 124 113.875 121.283 -7.408 1 1 1469 . 2 1 1 A 125 125 SER H H 125 8.990 8.079 0.911 1 1 1470 . 2 1 1 A 125 125 SER HA H 125 4.533 3.978 0.555 1 1 1473 . 2 1 1 A 125 125 SER CA C 125 59.198 59.549 -0.351 1 1 1474 . 2 1 1 A 125 125 SER CB C 125 64.578 29.259 35.319 1 1 1475 . 2 1 1 A 125 125 SER N N 125 117.894 119.949 -2.055 1 1 1476 . 2 1 1 A 126 126 SER H H 126 8.618 7.795 0.823 1 1 1477 . 2 1 1 A 126 126 SER HA H 126 4.614 3.999 0.615 1 1 1480 . 2 1 1 A 126 126 SER CA C 126 58.730 60.127 -1.397 1 1 1481 . 2 1 1 A 126 126 SER CB C 126 64.367 32.365 32.002 1 1 1482 . 2 1 1 A 126 126 SER N N 126 118.602 119.120 -0.518 1 1 1483 . 2 1 1 A 127 127 SER HA H 127 4.530 3.783 0.747 1 1 1486 . 2 1 1 A 127 127 SER CA C 127 58.954 65.706 -6.752 1 1 1487 . 2 1 1 A 127 127 SER CB C 127 64.379 31.489 32.890 1 1 1488 . 2 1 1 A 128 128 ALA H H 128 8.345 8.173 0.172 1 1 1489 . 2 1 1 A 128 128 ALA HA H 128 4.432 3.952 0.480 1 1 1493 . 2 1 1 A 128 128 ALA CA C 128 52.963 59.255 -6.292 1 1 1494 . 2 1 1 A 128 128 ALA CB C 128 19.924 29.795 -9.871 1 1 1495 . 2 1 1 A 128 128 ALA N N 128 126.185 122.089 4.096 1 1 1496 . 2 1 1 A 129 129 GLU H H 129 8.329 7.951 0.378 1 1 1497 . 2 1 1 A 129 129 GLU HA H 129 4.353 4.083 0.270 1 1 1502 . 2 1 1 A 129 129 GLU CA C 129 57.111 58.641 -1.530 1 1 1503 . 2 1 1 A 129 129 GLU CB C 129 30.949 28.628 2.321 1 1 1504 . 2 1 1 A 129 129 GLU N N 129 120.842 118.624 2.218 1 1 1505 . 2 1 1 A 130 130 LYS H H 130 7.947 7.992 -0.045 1 1 1506 . 2 1 1 A 130 130 LYS HA H 130 3.835 4.043 -0.208 1 1 1515 . 2 1 1 A 130 130 LYS CA C 130 57.756 59.698 -1.942 1 1 1516 . 2 1 1 A 130 130 LYS CB C 130 33.156 32.117 1.039 1 1 826 . 3 1 1 A 70 70 GLY H H 70 9.295 8.278 1.017 1 1 829 . 3 1 1 A 70 70 GLY CA C 70 46.552 58.191 -11.639 1 1 830 . 3 1 1 A 70 70 GLY N N 70 108.643 116.081 -7.438 1 1 832 . 3 1 1 A 71 71 VAL HA H 71 3.538 4.837 -1.299 1 1 840 . 3 1 1 A 71 71 VAL CA C 71 65.623 62.694 2.929 1 1 841 . 3 1 1 A 71 71 VAL CB C 71 30.251 32.611 -2.360 1 1 844 . 3 1 1 A 71 71 VAL N N 71 110.808 136.450 -25.642 1 1 845 . 3 1 1 A 72 72 CYS H H 72 8.022 8.294 -0.272 1 1 846 . 3 1 1 A 72 72 CYS HA H 72 3.469 4.738 -1.269 1 1 849 . 3 1 1 A 72 72 CYS CA C 72 62.733 57.955 4.778 1 1 850 . 3 1 1 A 72 72 CYS CB C 72 27.163 63.285 -36.122 1 1 851 . 3 1 1 A 72 72 CYS N N 72 109.483 114.480 -4.997 1 1 852 . 3 1 1 A 73 73 SER H H 73 7.996 8.360 -0.364 1 1 853 . 3 1 1 A 73 73 SER HA H 73 4.439 4.095 0.344 1 1 856 . 3 1 1 A 73 73 SER CA C 73 62.145 59.346 2.799 1 1 857 . 3 1 1 A 73 73 SER CB C 73 66.013 29.308 36.705 1 1 858 . 3 1 1 A 73 73 SER N N 73 118.630 122.450 -3.820 1 1 859 . 3 1 1 A 74 74 LYS H H 74 10.186 7.952 2.234 1 1 860 . 3 1 1 A 74 74 LYS HA H 74 4.172 3.962 0.210 1 1 867 . 3 1 1 A 74 74 LYS CA C 74 59.848 58.364 1.484 1 1 868 . 3 1 1 A 74 74 LYS CB C 74 34.278 41.458 -7.180 1 1 870 . 3 1 1 A 74 74 LYS N N 74 123.341 117.486 5.855 1 1 871 . 3 1 1 A 75 75 ASP H H 75 7.542 8.229 -0.687 1 1 872 . 3 1 1 A 75 75 ASP HA H 75 3.538 3.940 -0.402 1 1 875 . 3 1 1 A 75 75 ASP CA C 75 52.472 59.931 -7.459 1 1 876 . 3 1 1 A 75 75 ASP CB C 75 42.360 29.362 12.998 1 1 877 . 3 1 1 A 75 75 ASP N N 75 112.035 119.587 -7.552 1 1 878 . 3 1 1 A 76 76 VAL H H 76 8.128 8.338 -0.210 1 1 879 . 3 1 1 A 76 76 VAL HA H 76 4.106 4.016 0.090 1 1 887 . 3 1 1 A 76 76 VAL CA C 76 65.179 59.133 6.046 1 1 888 . 3 1 1 A 76 76 VAL CB C 76 32.174 29.110 3.064 1 1 891 . 3 1 1 A 76 76 VAL N N 76 117.992 120.424 -2.432 1 1 892 . 3 1 1 A 77 77 TRP H H 77 6.869 7.964 -1.095 1 1 893 . 3 1 1 A 77 77 TRP HA H 77 4.509 4.101 0.408 1 1 899 . 3 1 1 A 77 77 TRP CA C 77 59.207 57.702 1.505 1 1 900 . 3 1 1 A 77 77 TRP CB C 77 28.941 41.518 -12.577 1 1 901 . 3 1 1 A 77 77 TRP N N 77 123.077 121.543 1.534 1 1 903 . 3 1 1 A 78 78 GLU H H 78 8.593 8.382 0.211 1 1 904 . 3 1 1 A 78 78 GLU HA H 78 4.318 3.902 0.416 1 1 909 . 3 1 1 A 78 78 GLU CA C 78 60.038 59.133 0.905 1 1 910 . 3 1 1 A 78 78 GLU CB C 78 31.178 28.225 2.953 1 1 912 . 3 1 1 A 78 78 GLU N N 78 121.505 117.892 3.613 1 1 913 . 3 1 1 A 79 79 PHE H H 79 8.071 8.123 -0.052 1 1 914 . 3 1 1 A 79 79 PHE HA H 79 4.986 4.068 0.918 1 1 919 . 3 1 1 A 79 79 PHE CA C 79 58.749 58.765 -0.016 1 1 920 . 3 1 1 A 79 79 PHE CB C 79 39.732 28.951 10.781 1 1 921 . 3 1 1 A 79 79 PHE N N 79 118.384 118.153 0.231 1 1 922 . 3 1 1 A 80 80 LEU H H 80 9.309 7.915 1.394 1 1 923 . 3 1 1 A 80 80 LEU HA H 80 3.970 4.435 -0.465 1 1 933 . 3 1 1 A 80 80 LEU CA C 80 59.307 56.418 2.889 1 1 934 . 3 1 1 A 80 80 LEU CB C 80 43.257 38.085 5.172 1 1 937 . 3 1 1 A 80 80 LEU N N 80 122.915 118.368 4.547 1 1 938 . 3 1 1 A 81 81 GLU H H 81 8.282 7.929 0.353 1 1 939 . 3 1 1 A 81 81 GLU HA H 81 3.832 3.705 0.127 1 1 944 . 3 1 1 A 81 81 GLU CA C 81 62.069 65.177 -3.108 1 1 945 . 3 1 1 A 81 81 GLU CB C 81 30.249 38.072 -7.823 1 1 947 . 3 1 1 A 81 81 GLU N N 81 119.345 120.561 -1.216 1 1 948 . 3 1 1 A 82 82 LEU H H 82 8.236 7.964 0.272 1 1 949 . 3 1 1 A 82 82 LEU HA H 82 4.187 4.390 -0.203 1 1 959 . 3 1 1 A 82 82 LEU CA C 82 58.348 58.605 -0.257 1 1 960 . 3 1 1 A 82 82 LEU CB C 82 42.827 32.005 10.822 1 1 963 . 3 1 1 A 82 82 LEU N N 82 120.013 119.422 0.591 1 1 964 . 3 1 1 A 83 83 GLN H H 83 7.949 8.043 -0.094 1 1 965 . 3 1 1 A 83 83 GLN HA H 83 3.812 3.886 -0.074 1 1 968 . 3 1 1 A 83 83 GLN CA C 83 60.248 58.120 2.128 1 1 969 . 3 1 1 A 83 83 GLN CB C 83 33.537 41.410 -7.873 1 1 970 . 3 1 1 A 83 83 GLN N N 83 116.443 120.293 -3.850 1 1 971 . 3 1 1 A 84 84 ILE H H 84 8.407 8.544 -0.137 1 1 972 . 3 1 1 A 84 84 ILE HA H 84 3.644 4.106 -0.462 1 1 982 . 3 1 1 A 84 84 ILE CA C 84 67.288 58.913 8.375 1 1 983 . 3 1 1 A 84 84 ILE CB C 84 38.305 29.224 9.081 1 1 987 . 3 1 1 A 84 84 ILE N N 84 120.422 117.843 2.579 1 1 988 . 3 1 1 A 85 85 GLU H H 85 7.741 8.148 -0.407 1 1 989 . 3 1 1 A 85 85 GLU HA H 85 3.811 4.984 -1.173 1 1 994 . 3 1 1 A 85 85 GLU CA C 85 59.862 52.883 6.979 1 1 995 . 3 1 1 A 85 85 GLU CB C 85 30.360 46.213 -15.853 1 1 997 . 3 1 1 A 85 85 GLU N N 85 115.705 116.916 -1.211 1 1 998 . 3 1 1 A 86 86 GLU H H 86 7.818 8.721 -0.903 1 1 999 . 3 1 1 A 86 86 GLU HA H 86 4.274 4.726 -0.452 1 1 1004 . 3 1 1 A 86 86 GLU CA C 86 58.068 55.877 2.191 1 1 1005 . 3 1 1 A 86 86 GLU CB C 86 31.424 33.351 -1.927 1 1 1007 . 3 1 1 A 86 86 GLU N N 86 114.297 118.628 -4.331 1 1 1008 . 3 1 1 A 87 87 ILE H H 87 8.753 8.413 0.340 1 1 1019 . 3 1 1 A 87 87 ILE CA C 87 62.660 44.595 18.065 1 1 1024 . 3 1 1 A 87 87 ILE N N 87 118.890 110.349 8.541 1 1 1025 . 3 1 1 A 88 88 TYR H H 88 8.059 8.738 -0.679 1 1 1026 . 3 1 1 A 88 88 TYR HA H 88 5.447 4.208 1.239 1 1 1033 . 3 1 1 A 88 88 TYR CA C 88 55.285 58.821 -3.536 1 1 1034 . 3 1 1 A 88 88 TYR CB C 88 40.687 32.100 8.587 1 1 1035 . 3 1 1 A 88 88 TYR N N 88 119.252 125.126 -5.874 1 1 1036 . 3 1 1 A 89 89 PRO HA H 89 4.410 3.983 0.427 1 1 1043 . 3 1 1 A 89 89 PRO CA C 89 66.374 59.475 6.899 1 1 1044 . 3 1 1 A 89 89 PRO CB C 89 31.377 29.137 2.240 1 1 1047 . 3 1 1 A 90 90 GLU H H 90 9.234 8.240 0.994 1 1 1048 . 3 1 1 A 90 90 GLU HA H 90 4.379 4.030 0.349 1 1 1053 . 3 1 1 A 90 90 GLU CA C 90 59.098 58.699 0.399 1 1 1054 . 3 1 1 A 90 90 GLU CB C 90 29.461 28.072 1.389 1 1 1056 . 3 1 1 A 90 90 GLU N N 90 117.574 118.123 -0.549 1 1 1057 . 3 1 1 A 91 91 GLU H H 91 7.966 8.084 -0.118 1 1 1058 . 3 1 1 A 91 91 GLU HA H 91 4.890 4.019 0.871 1 1 1063 . 3 1 1 A 91 91 GLU CA C 91 55.324 59.186 -3.862 1 1 1064 . 3 1 1 A 91 91 GLU CB C 91 31.590 29.346 2.244 1 1 1066 . 3 1 1 A 91 91 GLU N N 91 119.310 119.838 -0.528 1 1 1067 . 3 1 1 A 92 92 GLU H H 92 7.263 7.978 -0.715 1 1 1068 . 3 1 1 A 92 92 GLU HA H 92 3.789 3.969 -0.180 1 1 1073 . 3 1 1 A 92 92 GLU CA C 92 60.628 57.935 2.693 1 1 1074 . 3 1 1 A 92 92 GLU CB C 92 30.531 41.585 -11.054 1 1 1076 . 3 1 1 A 92 92 GLU N N 92 121.332 120.200 1.132 1 1 1077 . 3 1 1 A 93 93 GLU H H 93 8.646 7.923 0.723 1 1 1078 . 3 1 1 A 93 93 GLU HA H 93 4.127 4.077 0.050 1 1 1083 . 3 1 1 A 93 93 GLU CA C 93 60.528 55.430 5.098 1 1 1084 . 3 1 1 A 93 93 GLU CB C 93 29.744 18.239 11.505 1 1 1086 . 3 1 1 A 93 93 GLU N N 93 118.207 121.414 -3.207 1 1 1087 . 3 1 1 A 94 94 ILE H H 94 7.766 8.313 -0.547 1 1 1088 . 3 1 1 A 94 94 ILE HA H 94 3.976 3.896 0.080 1 1 1098 . 3 1 1 A 94 94 ILE CA C 94 64.361 58.190 6.171 1 1 1099 . 3 1 1 A 94 94 ILE CB C 94 38.921 41.431 -2.510 1 1 1103 . 3 1 1 A 94 94 ILE N N 94 119.072 118.157 0.915 1 1 1104 . 3 1 1 A 95 95 LEU H H 95 8.340 8.028 0.312 1 1 1105 . 3 1 1 A 95 95 LEU HA H 95 4.300 4.121 0.179 1 1 1115 . 3 1 1 A 95 95 LEU CA C 95 57.905 59.483 -1.578 1 1 1116 . 3 1 1 A 95 95 LEU CB C 95 42.144 29.168 12.976 1 1 1119 . 3 1 1 A 95 95 LEU N N 95 121.325 117.622 3.703 1 1 1120 . 3 1 1 A 96 96 LYS H H 96 8.899 8.022 0.877 1 1 1121 . 3 1 1 A 96 96 LYS HA H 96 4.075 4.021 0.054 1 1 1126 . 3 1 1 A 96 96 LYS CA C 96 61.707 57.821 3.886 1 1 1127 . 3 1 1 A 96 96 LYS CB C 96 32.910 41.699 -8.789 1 1 1128 . 3 1 1 A 96 96 LYS N N 96 120.018 122.071 -2.053 1 1 1129 . 3 1 1 A 97 97 LYS H H 97 7.808 8.008 -0.200 1 1 1130 . 3 1 1 A 97 97 LYS HA H 97 4.045 4.265 -0.220 1 1 1139 . 3 1 1 A 97 97 LYS CA C 97 60.198 56.003 4.195 1 1 1140 . 3 1 1 A 97 97 LYS CB C 97 32.600 41.298 -8.698 1 1 1143 . 3 1 1 A 97 97 LYS N N 97 121.016 115.794 5.222 1 1 1144 . 3 1 1 A 98 98 ALA H H 98 7.814 8.259 -0.445 1 1 1145 . 3 1 1 A 98 98 ALA HA H 98 4.320 4.754 -0.434 1 1 1149 . 3 1 1 A 98 98 ALA CA C 98 55.260 54.284 0.976 1 1 1150 . 3 1 1 A 98 98 ALA CB C 98 19.468 39.542 -20.074 1 1 1151 . 3 1 1 A 98 98 ALA N N 98 122.102 116.517 5.585 1 1 1152 . 3 1 1 A 99 99 LEU H H 99 8.212 7.946 0.266 1 1 1153 . 3 1 1 A 99 99 LEU HA H 99 4.187 4.778 -0.591 1 1 1160 . 3 1 1 A 99 99 LEU CA C 99 58.398 56.575 1.823 1 1 1161 . 3 1 1 A 99 99 LEU CB C 99 42.720 36.794 5.926 1 1 1164 . 3 1 1 A 99 99 LEU N N 99 118.467 115.637 2.830 1 1 1165 . 3 1 1 A 100 100 ARG H H 100 7.738 7.496 0.242 1 1 1166 . 3 1 1 A 100 100 ARG HA H 100 3.894 5.250 -1.356 1 1 1173 . 3 1 1 A 100 100 ARG CA C 100 60.135 52.846 7.289 1 1 1174 . 3 1 1 A 100 100 ARG CB C 100 30.187 45.659 -15.472 1 1 1177 . 3 1 1 A 100 100 ARG N N 100 119.100 117.881 1.219 1 1 1178 . 3 1 1 A 101 101 ASP H H 101 8.186 8.152 0.034 1 1 1179 . 3 1 1 A 101 101 ASP HA H 101 4.424 4.955 -0.531 1 1 1182 . 3 1 1 A 101 101 ASP CA C 101 57.902 51.989 5.913 1 1 1183 . 3 1 1 A 101 101 ASP CB C 101 40.033 39.971 0.062 1 1 1184 . 3 1 1 A 101 101 ASP N N 101 121.899 117.258 4.641 1 1 1185 . 3 1 1 A 102 102 LEU H H 102 8.730 8.609 0.121 1 1 1186 . 3 1 1 A 102 102 LEU HA H 102 4.373 4.123 0.250 1 1 1195 . 3 1 1 A 102 102 LEU CA C 102 58.218 58.343 -0.125 1 1 1196 . 3 1 1 A 102 102 LEU CB C 102 42.839 29.327 13.512 1 1 1199 . 3 1 1 A 102 102 LEU N N 102 124.505 120.841 3.664 1 1 1200 . 3 1 1 A 103 103 LYS HA H 103 3.726 4.347 -0.621 1 1 1209 . 3 1 1 A 103 103 LYS CA C 103 59.760 56.157 3.603 1 1 1210 . 3 1 1 A 103 103 LYS CB C 103 32.822 32.981 -0.159 1 1 1214 . 3 1 1 A 104 104 ARG H H 104 7.409 7.812 -0.403 1 1 1222 . 3 1 1 A 104 104 ARG CA C 104 56.298 45.164 11.134 1 1 1226 . 3 1 1 A 104 104 ARG N N 104 115.912 105.799 10.113 1 1 1227 . 3 1 1 A 105 105 GLY H H 105 8.046 7.875 0.171 1 1 1230 . 3 1 1 A 105 105 GLY CA C 105 46.309 55.362 -9.053 1 1 1231 . 3 1 1 A 105 105 GLY N N 105 108.860 117.947 -9.087 1 1 1232 . 3 1 1 A 106 106 LYS H H 106 8.033 8.350 -0.317 1 1 1233 . 3 1 1 A 106 106 LYS HA H 106 4.394 4.225 0.169 1 1 1242 . 3 1 1 A 106 106 LYS CA C 106 55.822 55.192 0.630 1 1 1243 . 3 1 1 A 106 106 LYS CB C 106 33.449 42.761 -9.312 1 1 1246 . 3 1 1 A 106 106 LYS N N 106 121.082 117.949 3.133 1 1 1247 . 3 1 1 A 107 107 LYS H H 107 8.271 8.711 -0.440 1 1 1248 . 3 1 1 A 107 107 LYS HA H 107 4.329 4.494 -0.165 1 1 1255 . 3 1 1 A 107 107 LYS CA C 107 56.673 59.056 -2.383 1 1 1256 . 3 1 1 A 107 107 LYS CB C 107 33.341 64.204 -30.863 1 1 1258 . 3 1 1 A 107 107 LYS N N 107 121.869 114.451 7.418 1 1 1259 . 3 1 1 A 108 108 LEU H H 108 8.481 7.510 0.971 1 1 1260 . 3 1 1 A 108 108 LEU HA H 108 4.637 4.810 -0.173 1 1 1269 . 3 1 1 A 108 108 LEU CA C 108 53.819 54.492 -0.673 1 1 1270 . 3 1 1 A 108 108 LEU CB C 108 45.135 37.101 8.034 1 1 1272 . 3 1 1 A 108 108 LEU N N 108 124.360 120.098 4.262 1 1 1273 . 3 1 1 A 109 109 LYS H H 109 8.657 8.901 -0.244 1 1 1274 . 3 1 1 A 109 109 LYS HA H 109 4.565 4.501 0.064 1 1 1283 . 3 1 1 A 109 109 LYS CA C 109 55.511 59.132 -3.621 1 1 1284 . 3 1 1 A 109 109 LYS CB C 109 32.029 64.051 -32.022 1 1 1287 . 3 1 1 A 109 109 LYS N N 109 123.165 118.048 5.117 1 1 1288 . 3 1 1 A 110 110 PRO HA H 110 4.232 3.590 0.642 1 1 1295 . 3 1 1 A 110 110 PRO CA C 110 66.732 66.593 0.139 1 1 1296 . 3 1 1 A 110 110 PRO CB C 110 32.481 31.514 0.967 1 1 1299 . 3 1 1 A 111 111 GLU HA H 111 4.221 3.919 0.302 1 1 1304 . 3 1 1 A 111 111 GLU CA C 111 59.819 59.829 -0.010 1 1 1305 . 3 1 1 A 111 111 GLU CB C 111 29.250 29.163 0.087 1 1 1307 . 3 1 1 A 112 112 ILE H H 112 7.233 8.147 -0.914 1 1 1308 . 3 1 1 A 112 112 ILE HA H 112 3.848 4.073 -0.225 1 1 1318 . 3 1 1 A 112 112 ILE CA C 112 62.635 59.214 3.421 1 1 1319 . 3 1 1 A 112 112 ILE CB C 112 37.159 29.184 7.975 1 1 1323 . 3 1 1 A 112 112 ILE N N 112 120.783 118.187 2.596 1 1 1324 . 3 1 1 A 113 113 LYS H H 113 8.268 7.960 0.308 1 1 1325 . 3 1 1 A 113 113 LYS HA H 113 3.849 3.665 0.184 1 1 1328 . 3 1 1 A 113 113 LYS CA C 113 60.248 65.189 -4.941 1 1 1329 . 3 1 1 A 113 113 LYS CB C 113 32.668 37.514 -4.846 1 1 1330 . 3 1 1 A 113 113 LYS N N 113 121.680 121.693 -0.013 1 1 1331 . 3 1 1 A 114 114 GLY H H 114 8.460 8.370 0.090 1 1 1334 . 3 1 1 A 114 114 GLY CA C 114 47.600 61.100 -13.500 1 1 1335 . 3 1 1 A 114 114 GLY N N 114 105.413 116.495 -11.082 1 1 1336 . 3 1 1 A 115 115 LYS H H 115 7.352 7.706 -0.354 1 1 1337 . 3 1 1 A 115 115 LYS HA H 115 4.189 4.465 -0.276 1 1 1346 . 3 1 1 A 115 115 LYS CA C 115 59.689 57.241 2.448 1 1 1347 . 3 1 1 A 115 115 LYS CB C 115 33.428 40.614 -7.186 1 1 1351 . 3 1 1 A 115 115 LYS N N 115 121.599 121.564 0.035 1 1 1352 . 3 1 1 A 116 116 LEU H H 116 8.046 8.013 0.033 1 1 1353 . 3 1 1 A 116 116 LEU HA H 116 4.153 3.772 0.381 1 1 1363 . 3 1 1 A 116 116 LEU CA C 116 57.698 65.386 -7.688 1 1 1364 . 3 1 1 A 116 116 LEU CB C 116 42.070 31.451 10.619 1 1 1366 . 3 1 1 A 116 116 LEU N N 116 118.827 116.256 2.571 1 1 1367 . 3 1 1 A 117 117 SER H H 117 8.321 7.506 0.815 1 1 1368 . 3 1 1 A 117 117 SER HA H 117 4.334 4.213 0.121 1 1 1371 . 3 1 1 A 117 117 SER CA C 117 61.467 54.069 7.398 1 1 1372 . 3 1 1 A 117 117 SER CB C 117 63.613 41.660 21.953 1 1 1373 . 3 1 1 A 117 117 SER N N 117 114.829 119.002 -4.173 1 1 1374 . 3 1 1 A 118 118 ARG H H 118 7.001 7.815 -0.814 1 1 1375 . 3 1 1 A 118 118 ARG HA H 118 4.403 3.853 0.550 1 1 1382 . 3 1 1 A 118 118 ARG CA C 118 56.734 56.996 -0.262 1 1 1383 . 3 1 1 A 118 118 ARG CB C 118 31.115 27.267 3.848 1 1 1385 . 3 1 1 A 118 118 ARG N N 118 118.114 114.174 3.940 1 1 1386 . 3 1 1 A 119 119 LEU H H 119 7.365 8.195 -0.830 1 1 1387 . 3 1 1 A 119 119 LEU HA H 119 4.253 4.862 -0.609 1 1 1397 . 3 1 1 A 119 119 LEU CA C 119 54.639 58.106 -3.467 1 1 1398 . 3 1 1 A 119 119 LEU CB C 119 41.700 31.897 9.803 1 1 1401 . 3 1 1 A 119 119 LEU N N 119 119.181 117.235 1.946 1 1 1402 . 3 1 1 A 120 120 ARG H H 120 8.766 8.798 -0.032 1 1 1403 . 3 1 1 A 120 120 ARG HA H 120 4.374 4.467 -0.093 1 1 1410 . 3 1 1 A 120 120 ARG CA C 120 56.426 58.595 -2.169 1 1 1411 . 3 1 1 A 120 120 ARG CB C 120 32.414 63.843 -31.429 1 1 1414 . 3 1 1 A 120 120 ARG N N 120 122.099 119.400 2.699 1 1 1415 . 3 1 1 A 121 121 LEU H H 121 8.312 8.751 -0.439 1 1 1416 . 3 1 1 A 121 121 LEU HA H 121 4.407 3.560 0.847 1 1 1426 . 3 1 1 A 121 121 LEU CA C 121 56.028 66.962 -10.934 1 1 1427 . 3 1 1 A 121 121 LEU CB C 121 43.122 32.035 11.087 1 1 1430 . 3 1 1 A 121 121 LEU N N 121 118.761 124.000 -5.239 1 1 1431 . 3 1 1 A 122 122 PHE H H 122 7.143 8.303 -1.160 1 1 1432 . 3 1 1 A 122 122 PHE HA H 122 5.201 4.084 1.117 1 1 1439 . 3 1 1 A 122 122 PHE CA C 122 53.047 59.234 -6.187 1 1 1440 . 3 1 1 A 122 122 PHE CB C 122 40.844 29.344 11.500 1 1 1441 . 3 1 1 A 122 122 PHE N N 122 112.750 120.031 -7.281 1 1 1442 . 3 1 1 A 123 123 PRO HA H 123 3.908 3.981 -0.073 1 1 1449 . 3 1 1 A 123 123 PRO CA C 123 65.478 59.148 6.330 1 1 1450 . 3 1 1 A 123 123 PRO CB C 123 33.248 29.305 3.943 1 1 1452 . 3 1 1 A 124 124 LEU H H 124 7.208 7.920 -0.712 1 1 1453 . 3 1 1 A 124 124 LEU HA H 124 4.673 4.072 0.601 1 1 1463 . 3 1 1 A 124 124 LEU CA C 124 53.307 57.687 -4.380 1 1 1464 . 3 1 1 A 124 124 LEU CB C 124 42.853 41.556 1.297 1 1 1468 . 3 1 1 A 124 124 LEU N N 124 113.875 121.486 -7.611 1 1 1469 . 3 1 1 A 125 125 SER H H 125 8.990 8.042 0.948 1 1 1470 . 3 1 1 A 125 125 SER HA H 125 4.533 4.002 0.531 1 1 1473 . 3 1 1 A 125 125 SER CA C 125 59.198 59.509 -0.311 1 1 1474 . 3 1 1 A 125 125 SER CB C 125 64.578 29.598 34.980 1 1 1475 . 3 1 1 A 125 125 SER N N 125 117.894 119.717 -1.823 1 1 1476 . 3 1 1 A 126 126 SER H H 126 8.618 7.823 0.795 1 1 1477 . 3 1 1 A 126 126 SER HA H 126 4.614 3.988 0.626 1 1 1480 . 3 1 1 A 126 126 SER CA C 126 58.730 59.699 -0.969 1 1 1481 . 3 1 1 A 126 126 SER CB C 126 64.367 32.339 32.028 1 1 1482 . 3 1 1 A 126 126 SER N N 126 118.602 118.798 -0.196 1 1 1483 . 3 1 1 A 127 127 SER HA H 127 4.530 3.770 0.760 1 1 1486 . 3 1 1 A 127 127 SER CA C 127 58.954 65.784 -6.830 1 1 1487 . 3 1 1 A 127 127 SER CB C 127 64.379 31.465 32.914 1 1 1488 . 3 1 1 A 128 128 ALA H H 128 8.345 8.117 0.228 1 1 1489 . 3 1 1 A 128 128 ALA HA H 128 4.432 3.957 0.475 1 1 1493 . 3 1 1 A 128 128 ALA CA C 128 52.963 59.219 -6.256 1 1 1494 . 3 1 1 A 128 128 ALA CB C 128 19.924 29.678 -9.754 1 1 1495 . 3 1 1 A 128 128 ALA N N 128 126.185 122.118 4.067 1 1 1496 . 3 1 1 A 129 129 GLU H H 129 8.329 7.966 0.363 1 1 1497 . 3 1 1 A 129 129 GLU HA H 129 4.353 4.080 0.273 1 1 1502 . 3 1 1 A 129 129 GLU CA C 129 57.111 58.669 -1.558 1 1 1503 . 3 1 1 A 129 129 GLU CB C 129 30.949 28.623 2.326 1 1 1504 . 3 1 1 A 129 129 GLU N N 129 120.842 118.622 2.220 1 1 1505 . 3 1 1 A 130 130 LYS H H 130 7.947 7.996 -0.049 1 1 1506 . 3 1 1 A 130 130 LYS HA H 130 3.835 4.042 -0.207 1 1 1515 . 3 1 1 A 130 130 LYS CA C 130 57.756 59.765 -2.009 1 1 1516 . 3 1 1 A 130 130 LYS CB C 130 33.156 32.058 1.098 1 1 826 . 4 1 1 A 70 70 GLY H H 70 9.295 8.398 0.897 1 1 829 . 4 1 1 A 70 70 GLY CA C 70 46.552 59.942 -13.390 1 1 830 . 4 1 1 A 70 70 GLY N N 70 108.643 117.151 -8.508 1 1 832 . 4 1 1 A 71 71 VAL HA H 71 3.538 4.807 -1.269 1 1 840 . 4 1 1 A 71 71 VAL CA C 71 65.623 62.761 2.862 1 1 841 . 4 1 1 A 71 71 VAL CB C 71 30.251 31.968 -1.717 1 1 844 . 4 1 1 A 71 71 VAL N N 71 110.808 136.445 -25.637 1 1 845 . 4 1 1 A 72 72 CYS H H 72 8.022 8.394 -0.372 1 1 846 . 4 1 1 A 72 72 CYS HA H 72 3.469 4.780 -1.311 1 1 849 . 4 1 1 A 72 72 CYS CA C 72 62.733 57.724 5.009 1 1 850 . 4 1 1 A 72 72 CYS CB C 72 27.163 64.251 -37.088 1 1 851 . 4 1 1 A 72 72 CYS N N 72 109.483 113.575 -4.092 1 1 852 . 4 1 1 A 73 73 SER H H 73 7.996 8.339 -0.343 1 1 853 . 4 1 1 A 73 73 SER HA H 73 4.439 4.118 0.321 1 1 856 . 4 1 1 A 73 73 SER CA C 73 62.145 59.181 2.964 1 1 857 . 4 1 1 A 73 73 SER CB C 73 66.013 29.327 36.686 1 1 858 . 4 1 1 A 73 73 SER N N 73 118.630 123.419 -4.789 1 1 859 . 4 1 1 A 74 74 LYS H H 74 10.186 7.812 2.374 1 1 860 . 4 1 1 A 74 74 LYS HA H 74 4.172 3.942 0.230 1 1 867 . 4 1 1 A 74 74 LYS CA C 74 59.848 58.410 1.438 1 1 868 . 4 1 1 A 74 74 LYS CB C 74 34.278 41.407 -7.129 1 1 870 . 4 1 1 A 74 74 LYS N N 74 123.341 117.704 5.637 1 1 871 . 4 1 1 A 75 75 ASP H H 75 7.542 8.213 -0.671 1 1 872 . 4 1 1 A 75 75 ASP HA H 75 3.538 3.906 -0.368 1 1 875 . 4 1 1 A 75 75 ASP CA C 75 52.472 60.053 -7.581 1 1 876 . 4 1 1 A 75 75 ASP CB C 75 42.360 29.453 12.907 1 1 877 . 4 1 1 A 75 75 ASP N N 75 112.035 119.588 -7.553 1 1 878 . 4 1 1 A 76 76 VAL H H 76 8.128 8.116 0.012 1 1 879 . 4 1 1 A 76 76 VAL HA H 76 4.106 3.997 0.109 1 1 887 . 4 1 1 A 76 76 VAL CA C 76 65.179 59.126 6.053 1 1 888 . 4 1 1 A 76 76 VAL CB C 76 32.174 29.165 3.009 1 1 891 . 4 1 1 A 76 76 VAL N N 76 117.992 120.766 -2.774 1 1 892 . 4 1 1 A 77 77 TRP H H 77 6.869 8.015 -1.146 1 1 893 . 4 1 1 A 77 77 TRP HA H 77 4.509 4.101 0.408 1 1 899 . 4 1 1 A 77 77 TRP CA C 77 59.207 57.717 1.490 1 1 900 . 4 1 1 A 77 77 TRP CB C 77 28.941 41.383 -12.442 1 1 901 . 4 1 1 A 77 77 TRP N N 77 123.077 121.417 1.660 1 1 903 . 4 1 1 A 78 78 GLU H H 78 8.593 8.366 0.227 1 1 904 . 4 1 1 A 78 78 GLU HA H 78 4.318 3.904 0.414 1 1 909 . 4 1 1 A 78 78 GLU CA C 78 60.038 59.162 0.876 1 1 910 . 4 1 1 A 78 78 GLU CB C 78 31.178 28.288 2.890 1 1 912 . 4 1 1 A 78 78 GLU N N 78 121.505 117.889 3.616 1 1 913 . 4 1 1 A 79 79 PHE H H 79 8.071 8.103 -0.032 1 1 914 . 4 1 1 A 79 79 PHE HA H 79 4.986 4.067 0.919 1 1 919 . 4 1 1 A 79 79 PHE CA C 79 58.749 58.760 -0.011 1 1 920 . 4 1 1 A 79 79 PHE CB C 79 39.732 28.960 10.772 1 1 921 . 4 1 1 A 79 79 PHE N N 79 118.384 118.146 0.238 1 1 922 . 4 1 1 A 80 80 LEU H H 80 9.309 7.903 1.406 1 1 923 . 4 1 1 A 80 80 LEU HA H 80 3.970 4.438 -0.468 1 1 933 . 4 1 1 A 80 80 LEU CA C 80 59.307 56.421 2.886 1 1 934 . 4 1 1 A 80 80 LEU CB C 80 43.257 38.189 5.068 1 1 937 . 4 1 1 A 80 80 LEU N N 80 122.915 118.373 4.542 1 1 938 . 4 1 1 A 81 81 GLU H H 81 8.282 7.960 0.322 1 1 939 . 4 1 1 A 81 81 GLU HA H 81 3.832 3.558 0.274 1 1 944 . 4 1 1 A 81 81 GLU CA C 81 62.069 65.296 -3.227 1 1 945 . 4 1 1 A 81 81 GLU CB C 81 30.249 38.109 -7.860 1 1 947 . 4 1 1 A 81 81 GLU N N 81 119.345 120.429 -1.084 1 1 948 . 4 1 1 A 82 82 LEU H H 82 8.236 7.934 0.302 1 1 949 . 4 1 1 A 82 82 LEU HA H 82 4.187 4.460 -0.273 1 1 959 . 4 1 1 A 82 82 LEU CA C 82 58.348 58.576 -0.228 1 1 960 . 4 1 1 A 82 82 LEU CB C 82 42.827 32.053 10.774 1 1 963 . 4 1 1 A 82 82 LEU N N 82 120.013 119.131 0.882 1 1 964 . 4 1 1 A 83 83 GLN H H 83 7.949 7.939 0.010 1 1 965 . 4 1 1 A 83 83 GLN HA H 83 3.812 3.996 -0.184 1 1 968 . 4 1 1 A 83 83 GLN CA C 83 60.248 58.077 2.171 1 1 969 . 4 1 1 A 83 83 GLN CB C 83 33.537 41.585 -8.048 1 1 970 . 4 1 1 A 83 83 GLN N N 83 116.443 120.320 -3.877 1 1 971 . 4 1 1 A 84 84 ILE H H 84 8.407 8.805 -0.398 1 1 972 . 4 1 1 A 84 84 ILE HA H 84 3.644 4.124 -0.480 1 1 982 . 4 1 1 A 84 84 ILE CA C 84 67.288 58.632 8.656 1 1 983 . 4 1 1 A 84 84 ILE CB C 84 38.305 29.018 9.287 1 1 987 . 4 1 1 A 84 84 ILE N N 84 120.422 117.707 2.715 1 1 988 . 4 1 1 A 85 85 GLU H H 85 7.741 8.283 -0.542 1 1 989 . 4 1 1 A 85 85 GLU HA H 85 3.811 4.945 -1.134 1 1 994 . 4 1 1 A 85 85 GLU CA C 85 59.862 52.899 6.963 1 1 995 . 4 1 1 A 85 85 GLU CB C 85 30.360 46.033 -15.673 1 1 997 . 4 1 1 A 85 85 GLU N N 85 115.705 116.740 -1.035 1 1 998 . 4 1 1 A 86 86 GLU H H 86 7.818 8.705 -0.887 1 1 999 . 4 1 1 A 86 86 GLU HA H 86 4.274 4.697 -0.423 1 1 1004 . 4 1 1 A 86 86 GLU CA C 86 58.068 55.846 2.222 1 1 1005 . 4 1 1 A 86 86 GLU CB C 86 31.424 33.266 -1.842 1 1 1007 . 4 1 1 A 86 86 GLU N N 86 114.297 118.638 -4.341 1 1 1008 . 4 1 1 A 87 87 ILE H H 87 8.753 8.438 0.315 1 1 1019 . 4 1 1 A 87 87 ILE CA C 87 62.660 44.615 18.045 1 1 1024 . 4 1 1 A 87 87 ILE N N 87 118.890 110.172 8.718 1 1 1025 . 4 1 1 A 88 88 TYR H H 88 8.059 8.893 -0.834 1 1 1026 . 4 1 1 A 88 88 TYR HA H 88 5.447 4.168 1.279 1 1 1033 . 4 1 1 A 88 88 TYR CA C 88 55.285 58.237 -2.952 1 1 1034 . 4 1 1 A 88 88 TYR CB C 88 40.687 32.280 8.407 1 1 1035 . 4 1 1 A 88 88 TYR N N 88 119.252 125.589 -6.337 1 1 1036 . 4 1 1 A 89 89 PRO HA H 89 4.410 3.975 0.435 1 1 1043 . 4 1 1 A 89 89 PRO CA C 89 66.374 59.544 6.830 1 1 1044 . 4 1 1 A 89 89 PRO CB C 89 31.377 29.133 2.244 1 1 1047 . 4 1 1 A 90 90 GLU H H 90 9.234 8.277 0.957 1 1 1048 . 4 1 1 A 90 90 GLU HA H 90 4.379 4.030 0.349 1 1 1053 . 4 1 1 A 90 90 GLU CA C 90 59.098 58.742 0.356 1 1 1054 . 4 1 1 A 90 90 GLU CB C 90 29.461 28.006 1.455 1 1 1056 . 4 1 1 A 90 90 GLU N N 90 117.574 118.076 -0.502 1 1 1057 . 4 1 1 A 91 91 GLU H H 91 7.966 8.148 -0.182 1 1 1058 . 4 1 1 A 91 91 GLU HA H 91 4.890 4.063 0.827 1 1 1063 . 4 1 1 A 91 91 GLU CA C 91 55.324 58.944 -3.620 1 1 1064 . 4 1 1 A 91 91 GLU CB C 91 31.590 29.461 2.129 1 1 1066 . 4 1 1 A 91 91 GLU N N 91 119.310 120.068 -0.758 1 1 1067 . 4 1 1 A 92 92 GLU H H 92 7.263 8.186 -0.923 1 1 1068 . 4 1 1 A 92 92 GLU HA H 92 3.789 3.905 -0.116 1 1 1073 . 4 1 1 A 92 92 GLU CA C 92 60.628 57.853 2.775 1 1 1074 . 4 1 1 A 92 92 GLU CB C 92 30.531 41.561 -11.030 1 1 1076 . 4 1 1 A 92 92 GLU N N 92 121.332 120.137 1.195 1 1 1077 . 4 1 1 A 93 93 GLU H H 93 8.646 7.928 0.718 1 1 1078 . 4 1 1 A 93 93 GLU HA H 93 4.127 4.136 -0.009 1 1 1083 . 4 1 1 A 93 93 GLU CA C 93 60.528 55.345 5.183 1 1 1084 . 4 1 1 A 93 93 GLU CB C 93 29.744 18.366 11.378 1 1 1086 . 4 1 1 A 93 93 GLU N N 93 118.207 121.848 -3.641 1 1 1087 . 4 1 1 A 94 94 ILE H H 94 7.766 8.380 -0.614 1 1 1088 . 4 1 1 A 94 94 ILE HA H 94 3.976 3.906 0.070 1 1 1098 . 4 1 1 A 94 94 ILE CA C 94 64.361 58.194 6.167 1 1 1099 . 4 1 1 A 94 94 ILE CB C 94 38.921 41.390 -2.469 1 1 1103 . 4 1 1 A 94 94 ILE N N 94 119.072 118.136 0.936 1 1 1104 . 4 1 1 A 95 95 LEU H H 95 8.340 8.026 0.314 1 1 1105 . 4 1 1 A 95 95 LEU HA H 95 4.300 4.129 0.171 1 1 1115 . 4 1 1 A 95 95 LEU CA C 95 57.905 59.496 -1.591 1 1 1116 . 4 1 1 A 95 95 LEU CB C 95 42.144 29.185 12.959 1 1 1119 . 4 1 1 A 95 95 LEU N N 95 121.325 117.639 3.686 1 1 1120 . 4 1 1 A 96 96 LYS H H 96 8.899 7.958 0.941 1 1 1121 . 4 1 1 A 96 96 LYS HA H 96 4.075 4.025 0.050 1 1 1126 . 4 1 1 A 96 96 LYS CA C 96 61.707 57.792 3.915 1 1 1127 . 4 1 1 A 96 96 LYS CB C 96 32.910 41.697 -8.787 1 1 1128 . 4 1 1 A 96 96 LYS N N 96 120.018 122.071 -2.053 1 1 1129 . 4 1 1 A 97 97 LYS H H 97 7.808 8.021 -0.213 1 1 1130 . 4 1 1 A 97 97 LYS HA H 97 4.045 4.328 -0.283 1 1 1139 . 4 1 1 A 97 97 LYS CA C 97 60.198 56.100 4.098 1 1 1140 . 4 1 1 A 97 97 LYS CB C 97 32.600 41.272 -8.672 1 1 1143 . 4 1 1 A 97 97 LYS N N 97 121.016 115.629 5.387 1 1 1144 . 4 1 1 A 98 98 ALA H H 98 7.814 8.259 -0.445 1 1 1145 . 4 1 1 A 98 98 ALA HA H 98 4.320 4.722 -0.402 1 1 1149 . 4 1 1 A 98 98 ALA CA C 98 55.260 54.543 0.717 1 1 1150 . 4 1 1 A 98 98 ALA CB C 98 19.468 39.347 -19.879 1 1 1151 . 4 1 1 A 98 98 ALA N N 98 122.102 116.651 5.451 1 1 1152 . 4 1 1 A 99 99 LEU H H 99 8.212 7.893 0.319 1 1 1153 . 4 1 1 A 99 99 LEU HA H 99 4.187 4.762 -0.575 1 1 1160 . 4 1 1 A 99 99 LEU CA C 99 58.398 56.709 1.689 1 1 1161 . 4 1 1 A 99 99 LEU CB C 99 42.720 36.847 5.873 1 1 1164 . 4 1 1 A 99 99 LEU N N 99 118.467 115.739 2.728 1 1 1165 . 4 1 1 A 100 100 ARG H H 100 7.738 7.427 0.311 1 1 1166 . 4 1 1 A 100 100 ARG HA H 100 3.894 5.169 -1.275 1 1 1173 . 4 1 1 A 100 100 ARG CA C 100 60.135 52.778 7.357 1 1 1174 . 4 1 1 A 100 100 ARG CB C 100 30.187 45.086 -14.899 1 1 1177 . 4 1 1 A 100 100 ARG N N 100 119.100 117.432 1.668 1 1 1178 . 4 1 1 A 101 101 ASP H H 101 8.186 8.362 -0.176 1 1 1179 . 4 1 1 A 101 101 ASP HA H 101 4.424 4.810 -0.386 1 1 1182 . 4 1 1 A 101 101 ASP CA C 101 57.902 51.484 6.418 1 1 1183 . 4 1 1 A 101 101 ASP CB C 101 40.033 40.562 -0.529 1 1 1184 . 4 1 1 A 101 101 ASP N N 101 121.899 119.635 2.264 1 1 1185 . 4 1 1 A 102 102 LEU H H 102 8.730 8.611 0.119 1 1 1186 . 4 1 1 A 102 102 LEU HA H 102 4.373 4.044 0.329 1 1 1195 . 4 1 1 A 102 102 LEU CA C 102 58.218 58.275 -0.057 1 1 1196 . 4 1 1 A 102 102 LEU CB C 102 42.839 29.365 13.474 1 1 1199 . 4 1 1 A 102 102 LEU N N 102 124.505 123.275 1.230 1 1 1200 . 4 1 1 A 103 103 LYS HA H 103 3.726 4.116 -0.390 1 1 1209 . 4 1 1 A 103 103 LYS CA C 103 59.760 55.755 4.005 1 1 1210 . 4 1 1 A 103 103 LYS CB C 103 32.822 32.216 0.606 1 1 1214 . 4 1 1 A 104 104 ARG H H 104 7.409 7.765 -0.356 1 1 1222 . 4 1 1 A 104 104 ARG CA C 104 56.298 44.995 11.303 1 1 1226 . 4 1 1 A 104 104 ARG N N 104 115.912 105.571 10.341 1 1 1227 . 4 1 1 A 105 105 GLY H H 105 8.046 7.121 0.925 1 1 1230 . 4 1 1 A 105 105 GLY CA C 105 46.309 55.368 -9.059 1 1 1231 . 4 1 1 A 105 105 GLY N N 105 108.860 118.368 -9.508 1 1 1232 . 4 1 1 A 106 106 LYS H H 106 8.033 8.405 -0.372 1 1 1233 . 4 1 1 A 106 106 LYS HA H 106 4.394 4.396 -0.002 1 1 1242 . 4 1 1 A 106 106 LYS CA C 106 55.822 55.375 0.447 1 1 1243 . 4 1 1 A 106 106 LYS CB C 106 33.449 42.664 -9.215 1 1 1246 . 4 1 1 A 106 106 LYS N N 106 121.082 117.674 3.408 1 1 1247 . 4 1 1 A 107 107 LYS H H 107 8.271 8.730 -0.459 1 1 1248 . 4 1 1 A 107 107 LYS HA H 107 4.329 4.768 -0.439 1 1 1255 . 4 1 1 A 107 107 LYS CA C 107 56.673 59.274 -2.601 1 1 1256 . 4 1 1 A 107 107 LYS CB C 107 33.341 64.375 -31.034 1 1 1258 . 4 1 1 A 107 107 LYS N N 107 121.869 114.983 6.886 1 1 1259 . 4 1 1 A 108 108 LEU H H 108 8.481 7.490 0.991 1 1 1260 . 4 1 1 A 108 108 LEU HA H 108 4.637 4.980 -0.343 1 1 1269 . 4 1 1 A 108 108 LEU CA C 108 53.819 54.582 -0.763 1 1 1270 . 4 1 1 A 108 108 LEU CB C 108 45.135 35.979 9.156 1 1 1272 . 4 1 1 A 108 108 LEU N N 108 124.360 117.612 6.748 1 1 1273 . 4 1 1 A 109 109 LYS H H 109 8.657 8.915 -0.258 1 1 1274 . 4 1 1 A 109 109 LYS HA H 109 4.565 4.543 0.022 1 1 1283 . 4 1 1 A 109 109 LYS CA C 109 55.511 58.620 -3.109 1 1 1284 . 4 1 1 A 109 109 LYS CB C 109 32.029 63.949 -31.920 1 1 1287 . 4 1 1 A 109 109 LYS N N 109 123.165 117.038 6.127 1 1 1288 . 4 1 1 A 110 110 PRO HA H 110 4.232 3.596 0.636 1 1 1295 . 4 1 1 A 110 110 PRO CA C 110 66.732 66.609 0.123 1 1 1296 . 4 1 1 A 110 110 PRO CB C 110 32.481 31.552 0.929 1 1 1299 . 4 1 1 A 111 111 GLU HA H 111 4.221 3.873 0.348 1 1 1304 . 4 1 1 A 111 111 GLU CA C 111 59.819 59.830 -0.011 1 1 1305 . 4 1 1 A 111 111 GLU CB C 111 29.250 29.133 0.117 1 1 1307 . 4 1 1 A 112 112 ILE H H 112 7.233 8.302 -1.069 1 1 1308 . 4 1 1 A 112 112 ILE HA H 112 3.848 4.078 -0.230 1 1 1318 . 4 1 1 A 112 112 ILE CA C 112 62.635 59.169 3.466 1 1 1319 . 4 1 1 A 112 112 ILE CB C 112 37.159 29.302 7.857 1 1 1323 . 4 1 1 A 112 112 ILE N N 112 120.783 118.082 2.701 1 1 1324 . 4 1 1 A 113 113 LYS H H 113 8.268 7.799 0.469 1 1 1325 . 4 1 1 A 113 113 LYS HA H 113 3.849 3.661 0.188 1 1 1328 . 4 1 1 A 113 113 LYS CA C 113 60.248 64.759 -4.511 1 1 1329 . 4 1 1 A 113 113 LYS CB C 113 32.668 37.451 -4.783 1 1 1330 . 4 1 1 A 113 113 LYS N N 113 121.680 121.722 -0.042 1 1 1331 . 4 1 1 A 114 114 GLY H H 114 8.460 8.348 0.112 1 1 1334 . 4 1 1 A 114 114 GLY CA C 114 47.600 61.138 -13.538 1 1 1335 . 4 1 1 A 114 114 GLY N N 114 105.413 115.316 -9.903 1 1 1336 . 4 1 1 A 115 115 LYS H H 115 7.352 7.809 -0.457 1 1 1337 . 4 1 1 A 115 115 LYS HA H 115 4.189 4.449 -0.260 1 1 1346 . 4 1 1 A 115 115 LYS CA C 115 59.689 57.247 2.442 1 1 1347 . 4 1 1 A 115 115 LYS CB C 115 33.428 40.511 -7.083 1 1 1351 . 4 1 1 A 115 115 LYS N N 115 121.599 122.602 -1.003 1 1 1352 . 4 1 1 A 116 116 LEU H H 116 8.046 7.936 0.110 1 1 1353 . 4 1 1 A 116 116 LEU HA H 116 4.153 3.877 0.276 1 1 1363 . 4 1 1 A 116 116 LEU CA C 116 57.698 64.872 -7.174 1 1 1364 . 4 1 1 A 116 116 LEU CB C 116 42.070 31.606 10.464 1 1 1366 . 4 1 1 A 116 116 LEU N N 116 118.827 118.663 0.164 1 1 1367 . 4 1 1 A 117 117 SER H H 117 8.321 7.543 0.778 1 1 1368 . 4 1 1 A 117 117 SER HA H 117 4.334 4.207 0.127 1 1 1371 . 4 1 1 A 117 117 SER CA C 117 61.467 54.306 7.161 1 1 1372 . 4 1 1 A 117 117 SER CB C 117 63.613 42.103 21.510 1 1 1373 . 4 1 1 A 117 117 SER N N 117 114.829 116.400 -1.571 1 1 1374 . 4 1 1 A 118 118 ARG H H 118 7.001 7.820 -0.819 1 1 1375 . 4 1 1 A 118 118 ARG HA H 118 4.403 3.881 0.522 1 1 1382 . 4 1 1 A 118 118 ARG CA C 118 56.734 57.030 -0.296 1 1 1383 . 4 1 1 A 118 118 ARG CB C 118 31.115 27.289 3.826 1 1 1385 . 4 1 1 A 118 118 ARG N N 118 118.114 114.230 3.884 1 1 1386 . 4 1 1 A 119 119 LEU H H 119 7.365 8.314 -0.949 1 1 1387 . 4 1 1 A 119 119 LEU HA H 119 4.253 4.876 -0.623 1 1 1397 . 4 1 1 A 119 119 LEU CA C 119 54.639 57.682 -3.043 1 1 1398 . 4 1 1 A 119 119 LEU CB C 119 41.700 31.523 10.177 1 1 1401 . 4 1 1 A 119 119 LEU N N 119 119.181 117.412 1.769 1 1 1402 . 4 1 1 A 120 120 ARG H H 120 8.766 8.682 0.084 1 1 1403 . 4 1 1 A 120 120 ARG HA H 120 4.374 4.474 -0.100 1 1 1410 . 4 1 1 A 120 120 ARG CA C 120 56.426 59.494 -3.068 1 1 1411 . 4 1 1 A 120 120 ARG CB C 120 32.414 63.861 -31.447 1 1 1414 . 4 1 1 A 120 120 ARG N N 120 122.099 120.840 1.259 1 1 1415 . 4 1 1 A 121 121 LEU H H 121 8.312 8.850 -0.538 1 1 1416 . 4 1 1 A 121 121 LEU HA H 121 4.407 3.708 0.699 1 1 1426 . 4 1 1 A 121 121 LEU CA C 121 56.028 65.781 -9.753 1 1 1427 . 4 1 1 A 121 121 LEU CB C 121 43.122 31.500 11.622 1 1 1430 . 4 1 1 A 121 121 LEU N N 121 118.761 123.233 -4.472 1 1 1431 . 4 1 1 A 122 122 PHE H H 122 7.143 8.424 -1.281 1 1 1432 . 4 1 1 A 122 122 PHE HA H 122 5.201 4.098 1.103 1 1 1439 . 4 1 1 A 122 122 PHE CA C 122 53.047 59.157 -6.110 1 1 1440 . 4 1 1 A 122 122 PHE CB C 122 40.844 29.476 11.368 1 1 1441 . 4 1 1 A 122 122 PHE N N 122 112.750 120.903 -8.153 1 1 1442 . 4 1 1 A 123 123 PRO HA H 123 3.908 3.962 -0.054 1 1 1449 . 4 1 1 A 123 123 PRO CA C 123 65.478 59.183 6.295 1 1 1450 . 4 1 1 A 123 123 PRO CB C 123 33.248 29.294 3.954 1 1 1452 . 4 1 1 A 124 124 LEU H H 124 7.208 8.193 -0.985 1 1 1453 . 4 1 1 A 124 124 LEU HA H 124 4.673 4.098 0.575 1 1 1463 . 4 1 1 A 124 124 LEU CA C 124 53.307 57.699 -4.392 1 1 1464 . 4 1 1 A 124 124 LEU CB C 124 42.853 40.957 1.896 1 1 1468 . 4 1 1 A 124 124 LEU N N 124 113.875 121.350 -7.475 1 1 1469 . 4 1 1 A 125 125 SER H H 125 8.990 8.204 0.786 1 1 1470 . 4 1 1 A 125 125 SER HA H 125 4.533 3.983 0.550 1 1 1473 . 4 1 1 A 125 125 SER CA C 125 59.198 59.668 -0.470 1 1 1474 . 4 1 1 A 125 125 SER CB C 125 64.578 29.528 35.050 1 1 1475 . 4 1 1 A 125 125 SER N N 125 117.894 119.051 -1.157 1 1 1476 . 4 1 1 A 126 126 SER H H 126 8.618 7.681 0.937 1 1 1477 . 4 1 1 A 126 126 SER HA H 126 4.614 4.019 0.595 1 1 1480 . 4 1 1 A 126 126 SER CA C 126 58.730 59.335 -0.605 1 1 1481 . 4 1 1 A 126 126 SER CB C 126 64.367 32.294 32.073 1 1 1482 . 4 1 1 A 126 126 SER N N 126 118.602 119.656 -1.054 1 1 1483 . 4 1 1 A 127 127 SER HA H 127 4.530 3.797 0.733 1 1 1486 . 4 1 1 A 127 127 SER CA C 127 58.954 65.626 -6.672 1 1 1487 . 4 1 1 A 127 127 SER CB C 127 64.379 31.592 32.787 1 1 1488 . 4 1 1 A 128 128 ALA H H 128 8.345 8.354 -0.009 1 1 1489 . 4 1 1 A 128 128 ALA HA H 128 4.432 4.001 0.431 1 1 1493 . 4 1 1 A 128 128 ALA CA C 128 52.963 58.766 -5.803 1 1 1494 . 4 1 1 A 128 128 ALA CB C 128 19.924 30.015 -10.091 1 1 1495 . 4 1 1 A 128 128 ALA N N 128 126.185 120.823 5.362 1 1 1496 . 4 1 1 A 129 129 GLU H H 129 8.329 7.752 0.577 1 1 1497 . 4 1 1 A 129 129 GLU HA H 129 4.353 4.067 0.286 1 1 1502 . 4 1 1 A 129 129 GLU CA C 129 57.111 58.637 -1.526 1 1 1503 . 4 1 1 A 129 129 GLU CB C 129 30.949 28.619 2.330 1 1 1504 . 4 1 1 A 129 129 GLU N N 129 120.842 118.733 2.109 1 1 1505 . 4 1 1 A 130 130 LYS H H 130 7.947 8.064 -0.117 1 1 1506 . 4 1 1 A 130 130 LYS HA H 130 3.835 4.042 -0.207 1 1 1515 . 4 1 1 A 130 130 LYS CA C 130 57.756 59.665 -1.909 1 1 1516 . 4 1 1 A 130 130 LYS CB C 130 33.156 32.149 1.007 1 1 826 . 5 1 1 A 70 70 GLY H H 70 9.295 8.172 1.123 1 1 829 . 5 1 1 A 70 70 GLY CA C 70 46.552 58.352 -11.800 1 1 830 . 5 1 1 A 70 70 GLY N N 70 108.643 117.560 -8.917 1 1 832 . 5 1 1 A 71 71 VAL HA H 71 3.538 4.882 -1.344 1 1 840 . 5 1 1 A 71 71 VAL CA C 71 65.623 62.828 2.795 1 1 841 . 5 1 1 A 71 71 VAL CB C 71 30.251 32.044 -1.793 1 1 844 . 5 1 1 A 71 71 VAL N N 71 110.808 136.929 -26.121 1 1 845 . 5 1 1 A 72 72 CYS H H 72 8.022 8.942 -0.920 1 1 846 . 5 1 1 A 72 72 CYS HA H 72 3.469 4.876 -1.407 1 1 849 . 5 1 1 A 72 72 CYS CA C 72 62.733 57.736 4.997 1 1 850 . 5 1 1 A 72 72 CYS CB C 72 27.163 63.923 -36.760 1 1 851 . 5 1 1 A 72 72 CYS N N 72 109.483 119.171 -9.688 1 1 852 . 5 1 1 A 73 73 SER H H 73 7.996 8.220 -0.224 1 1 853 . 5 1 1 A 73 73 SER HA H 73 4.439 4.032 0.407 1 1 856 . 5 1 1 A 73 73 SER CA C 73 62.145 59.340 2.805 1 1 857 . 5 1 1 A 73 73 SER CB C 73 66.013 29.414 36.599 1 1 858 . 5 1 1 A 73 73 SER N N 73 118.630 122.329 -3.699 1 1 859 . 5 1 1 A 74 74 LYS H H 74 10.186 7.892 2.294 1 1 860 . 5 1 1 A 74 74 LYS HA H 74 4.172 3.994 0.178 1 1 867 . 5 1 1 A 74 74 LYS CA C 74 59.848 58.403 1.445 1 1 868 . 5 1 1 A 74 74 LYS CB C 74 34.278 41.475 -7.197 1 1 870 . 5 1 1 A 74 74 LYS N N 74 123.341 119.782 3.559 1 1 871 . 5 1 1 A 75 75 ASP H H 75 7.542 8.245 -0.703 1 1 872 . 5 1 1 A 75 75 ASP HA H 75 3.538 3.950 -0.412 1 1 875 . 5 1 1 A 75 75 ASP CA C 75 52.472 59.929 -7.457 1 1 876 . 5 1 1 A 75 75 ASP CB C 75 42.360 29.336 13.024 1 1 877 . 5 1 1 A 75 75 ASP N N 75 112.035 119.605 -7.570 1 1 878 . 5 1 1 A 76 76 VAL H H 76 8.128 8.379 -0.251 1 1 879 . 5 1 1 A 76 76 VAL HA H 76 4.106 4.025 0.081 1 1 887 . 5 1 1 A 76 76 VAL CA C 76 65.179 59.184 5.995 1 1 888 . 5 1 1 A 76 76 VAL CB C 76 32.174 29.126 3.048 1 1 891 . 5 1 1 A 76 76 VAL N N 76 117.992 120.599 -2.607 1 1 892 . 5 1 1 A 77 77 TRP H H 77 6.869 7.969 -1.100 1 1 893 . 5 1 1 A 77 77 TRP HA H 77 4.509 4.103 0.406 1 1 899 . 5 1 1 A 77 77 TRP CA C 77 59.207 57.728 1.479 1 1 900 . 5 1 1 A 77 77 TRP CB C 77 28.941 41.369 -12.428 1 1 901 . 5 1 1 A 77 77 TRP N N 77 123.077 121.163 1.914 1 1 903 . 5 1 1 A 78 78 GLU H H 78 8.593 8.390 0.203 1 1 904 . 5 1 1 A 78 78 GLU HA H 78 4.318 3.897 0.421 1 1 909 . 5 1 1 A 78 78 GLU CA C 78 60.038 59.211 0.827 1 1 910 . 5 1 1 A 78 78 GLU CB C 78 31.178 28.325 2.853 1 1 912 . 5 1 1 A 78 78 GLU N N 78 121.505 117.774 3.731 1 1 913 . 5 1 1 A 79 79 PHE H H 79 8.071 8.167 -0.096 1 1 914 . 5 1 1 A 79 79 PHE HA H 79 4.986 4.077 0.909 1 1 919 . 5 1 1 A 79 79 PHE CA C 79 58.749 58.792 -0.043 1 1 920 . 5 1 1 A 79 79 PHE CB C 79 39.732 28.766 10.966 1 1 921 . 5 1 1 A 79 79 PHE N N 79 118.384 118.146 0.238 1 1 922 . 5 1 1 A 80 80 LEU H H 80 9.309 7.899 1.410 1 1 923 . 5 1 1 A 80 80 LEU HA H 80 3.970 4.445 -0.475 1 1 933 . 5 1 1 A 80 80 LEU CA C 80 59.307 56.480 2.827 1 1 934 . 5 1 1 A 80 80 LEU CB C 80 43.257 38.233 5.024 1 1 937 . 5 1 1 A 80 80 LEU N N 80 122.915 118.480 4.435 1 1 938 . 5 1 1 A 81 81 GLU H H 81 8.282 8.070 0.212 1 1 939 . 5 1 1 A 81 81 GLU HA H 81 3.832 3.674 0.158 1 1 944 . 5 1 1 A 81 81 GLU CA C 81 62.069 65.170 -3.101 1 1 945 . 5 1 1 A 81 81 GLU CB C 81 30.249 38.146 -7.897 1 1 947 . 5 1 1 A 81 81 GLU N N 81 119.345 120.415 -1.070 1 1 948 . 5 1 1 A 82 82 LEU H H 82 8.236 7.923 0.313 1 1 949 . 5 1 1 A 82 82 LEU HA H 82 4.187 4.420 -0.233 1 1 959 . 5 1 1 A 82 82 LEU CA C 82 58.348 58.756 -0.408 1 1 960 . 5 1 1 A 82 82 LEU CB C 82 42.827 31.993 10.834 1 1 963 . 5 1 1 A 82 82 LEU N N 82 120.013 119.339 0.674 1 1 964 . 5 1 1 A 83 83 GLN H H 83 7.949 7.919 0.030 1 1 965 . 5 1 1 A 83 83 GLN HA H 83 3.812 3.954 -0.142 1 1 968 . 5 1 1 A 83 83 GLN CA C 83 60.248 58.097 2.151 1 1 969 . 5 1 1 A 83 83 GLN CB C 83 33.537 41.510 -7.973 1 1 970 . 5 1 1 A 83 83 GLN N N 83 116.443 120.415 -3.972 1 1 971 . 5 1 1 A 84 84 ILE H H 84 8.407 8.799 -0.392 1 1 972 . 5 1 1 A 84 84 ILE HA H 84 3.644 4.087 -0.443 1 1 982 . 5 1 1 A 84 84 ILE CA C 84 67.288 58.729 8.559 1 1 983 . 5 1 1 A 84 84 ILE CB C 84 38.305 29.090 9.215 1 1 987 . 5 1 1 A 84 84 ILE N N 84 120.422 117.985 2.437 1 1 988 . 5 1 1 A 85 85 GLU H H 85 7.741 8.197 -0.456 1 1 989 . 5 1 1 A 85 85 GLU HA H 85 3.811 4.964 -1.153 1 1 994 . 5 1 1 A 85 85 GLU CA C 85 59.862 52.896 6.966 1 1 995 . 5 1 1 A 85 85 GLU CB C 85 30.360 46.078 -15.718 1 1 997 . 5 1 1 A 85 85 GLU N N 85 115.705 116.664 -0.959 1 1 998 . 5 1 1 A 86 86 GLU H H 86 7.818 8.704 -0.886 1 1 999 . 5 1 1 A 86 86 GLU HA H 86 4.274 4.697 -0.423 1 1 1004 . 5 1 1 A 86 86 GLU CA C 86 58.068 55.839 2.229 1 1 1005 . 5 1 1 A 86 86 GLU CB C 86 31.424 33.506 -2.082 1 1 1007 . 5 1 1 A 86 86 GLU N N 86 114.297 118.435 -4.138 1 1 1008 . 5 1 1 A 87 87 ILE H H 87 8.753 8.432 0.321 1 1 1019 . 5 1 1 A 87 87 ILE CA C 87 62.660 44.600 18.060 1 1 1024 . 5 1 1 A 87 87 ILE N N 87 118.890 110.224 8.666 1 1 1025 . 5 1 1 A 88 88 TYR H H 88 8.059 8.741 -0.682 1 1 1026 . 5 1 1 A 88 88 TYR HA H 88 5.447 4.199 1.248 1 1 1033 . 5 1 1 A 88 88 TYR CA C 88 55.285 58.733 -3.448 1 1 1034 . 5 1 1 A 88 88 TYR CB C 88 40.687 32.110 8.577 1 1 1035 . 5 1 1 A 88 88 TYR N N 88 119.252 125.109 -5.857 1 1 1036 . 5 1 1 A 89 89 PRO HA H 89 4.410 4.010 0.400 1 1 1043 . 5 1 1 A 89 89 PRO CA C 89 66.374 59.273 7.101 1 1 1044 . 5 1 1 A 89 89 PRO CB C 89 31.377 29.185 2.192 1 1 1047 . 5 1 1 A 90 90 GLU H H 90 9.234 8.304 0.930 1 1 1048 . 5 1 1 A 90 90 GLU HA H 90 4.379 4.000 0.379 1 1 1053 . 5 1 1 A 90 90 GLU CA C 90 59.098 58.671 0.427 1 1 1054 . 5 1 1 A 90 90 GLU CB C 90 29.461 28.155 1.306 1 1 1056 . 5 1 1 A 90 90 GLU N N 90 117.574 118.015 -0.441 1 1 1057 . 5 1 1 A 91 91 GLU H H 91 7.966 8.058 -0.092 1 1 1058 . 5 1 1 A 91 91 GLU HA H 91 4.890 4.077 0.813 1 1 1063 . 5 1 1 A 91 91 GLU CA C 91 55.324 58.943 -3.619 1 1 1064 . 5 1 1 A 91 91 GLU CB C 91 31.590 29.301 2.289 1 1 1066 . 5 1 1 A 91 91 GLU N N 91 119.310 119.664 -0.354 1 1 1067 . 5 1 1 A 92 92 GLU H H 92 7.263 7.984 -0.721 1 1 1068 . 5 1 1 A 92 92 GLU HA H 92 3.789 3.921 -0.132 1 1 1073 . 5 1 1 A 92 92 GLU CA C 92 60.628 57.911 2.717 1 1 1074 . 5 1 1 A 92 92 GLU CB C 92 30.531 41.615 -11.084 1 1 1076 . 5 1 1 A 92 92 GLU N N 92 121.332 120.481 0.851 1 1 1077 . 5 1 1 A 93 93 GLU H H 93 8.646 7.978 0.668 1 1 1078 . 5 1 1 A 93 93 GLU HA H 93 4.127 4.081 0.046 1 1 1083 . 5 1 1 A 93 93 GLU CA C 93 60.528 55.397 5.131 1 1 1084 . 5 1 1 A 93 93 GLU CB C 93 29.744 18.187 11.557 1 1 1086 . 5 1 1 A 93 93 GLU N N 93 118.207 121.516 -3.309 1 1 1087 . 5 1 1 A 94 94 ILE H H 94 7.766 8.284 -0.518 1 1 1088 . 5 1 1 A 94 94 ILE HA H 94 3.976 3.903 0.073 1 1 1098 . 5 1 1 A 94 94 ILE CA C 94 64.361 58.150 6.211 1 1 1099 . 5 1 1 A 94 94 ILE CB C 94 38.921 41.392 -2.471 1 1 1103 . 5 1 1 A 94 94 ILE N N 94 119.072 118.148 0.924 1 1 1104 . 5 1 1 A 95 95 LEU H H 95 8.340 8.000 0.340 1 1 1105 . 5 1 1 A 95 95 LEU HA H 95 4.300 4.113 0.187 1 1 1115 . 5 1 1 A 95 95 LEU CA C 95 57.905 59.475 -1.570 1 1 1116 . 5 1 1 A 95 95 LEU CB C 95 42.144 29.186 12.958 1 1 1119 . 5 1 1 A 95 95 LEU N N 95 121.325 117.633 3.692 1 1 1120 . 5 1 1 A 96 96 LYS H H 96 8.899 7.982 0.917 1 1 1121 . 5 1 1 A 96 96 LYS HA H 96 4.075 3.999 0.076 1 1 1126 . 5 1 1 A 96 96 LYS CA C 96 61.707 57.918 3.789 1 1 1127 . 5 1 1 A 96 96 LYS CB C 96 32.910 41.666 -8.756 1 1 1128 . 5 1 1 A 96 96 LYS N N 96 120.018 122.062 -2.044 1 1 1129 . 5 1 1 A 97 97 LYS H H 97 7.808 7.987 -0.179 1 1 1130 . 5 1 1 A 97 97 LYS HA H 97 4.045 4.299 -0.254 1 1 1139 . 5 1 1 A 97 97 LYS CA C 97 60.198 56.112 4.086 1 1 1140 . 5 1 1 A 97 97 LYS CB C 97 32.600 41.223 -8.623 1 1 1143 . 5 1 1 A 97 97 LYS N N 97 121.016 115.529 5.487 1 1 1144 . 5 1 1 A 98 98 ALA H H 98 7.814 8.207 -0.393 1 1 1145 . 5 1 1 A 98 98 ALA HA H 98 4.320 4.791 -0.471 1 1 1149 . 5 1 1 A 98 98 ALA CA C 98 55.260 54.128 1.132 1 1 1150 . 5 1 1 A 98 98 ALA CB C 98 19.468 39.615 -20.147 1 1 1151 . 5 1 1 A 98 98 ALA N N 98 122.102 116.742 5.360 1 1 1152 . 5 1 1 A 99 99 LEU H H 99 8.212 7.899 0.313 1 1 1153 . 5 1 1 A 99 99 LEU HA H 99 4.187 4.800 -0.613 1 1 1160 . 5 1 1 A 99 99 LEU CA C 99 58.398 56.928 1.470 1 1 1161 . 5 1 1 A 99 99 LEU CB C 99 42.720 37.463 5.257 1 1 1164 . 5 1 1 A 99 99 LEU N N 99 118.467 115.621 2.846 1 1 1165 . 5 1 1 A 100 100 ARG H H 100 7.738 7.386 0.352 1 1 1166 . 5 1 1 A 100 100 ARG HA H 100 3.894 5.026 -1.132 1 1 1173 . 5 1 1 A 100 100 ARG CA C 100 60.135 52.704 7.431 1 1 1174 . 5 1 1 A 100 100 ARG CB C 100 30.187 44.931 -14.744 1 1 1177 . 5 1 1 A 100 100 ARG N N 100 119.100 116.792 2.308 1 1 1178 . 5 1 1 A 101 101 ASP H H 101 8.186 8.230 -0.044 1 1 1179 . 5 1 1 A 101 101 ASP HA H 101 4.424 4.841 -0.417 1 1 1182 . 5 1 1 A 101 101 ASP CA C 101 57.902 51.663 6.239 1 1 1183 . 5 1 1 A 101 101 ASP CB C 101 40.033 39.953 0.080 1 1 1184 . 5 1 1 A 101 101 ASP N N 101 121.899 117.321 4.578 1 1 1185 . 5 1 1 A 102 102 LEU H H 102 8.730 8.615 0.115 1 1 1186 . 5 1 1 A 102 102 LEU HA H 102 4.373 4.128 0.245 1 1 1195 . 5 1 1 A 102 102 LEU CA C 102 58.218 58.341 -0.123 1 1 1196 . 5 1 1 A 102 102 LEU CB C 102 42.839 29.331 13.508 1 1 1199 . 5 1 1 A 102 102 LEU N N 102 124.505 121.139 3.366 1 1 1200 . 5 1 1 A 103 103 LYS HA H 103 3.726 4.332 -0.606 1 1 1209 . 5 1 1 A 103 103 LYS CA C 103 59.760 56.159 3.601 1 1 1210 . 5 1 1 A 103 103 LYS CB C 103 32.822 32.983 -0.161 1 1 1214 . 5 1 1 A 104 104 ARG H H 104 7.409 7.773 -0.364 1 1 1222 . 5 1 1 A 104 104 ARG CA C 104 56.298 45.185 11.113 1 1 1226 . 5 1 1 A 104 104 ARG N N 104 115.912 105.748 10.164 1 1 1227 . 5 1 1 A 105 105 GLY H H 105 8.046 7.894 0.152 1 1 1230 . 5 1 1 A 105 105 GLY CA C 105 46.309 55.301 -8.992 1 1 1231 . 5 1 1 A 105 105 GLY N N 105 108.860 118.271 -9.411 1 1 1232 . 5 1 1 A 106 106 LYS H H 106 8.033 8.354 -0.321 1 1 1233 . 5 1 1 A 106 106 LYS HA H 106 4.394 4.254 0.140 1 1 1242 . 5 1 1 A 106 106 LYS CA C 106 55.822 55.244 0.578 1 1 1243 . 5 1 1 A 106 106 LYS CB C 106 33.449 42.686 -9.237 1 1 1246 . 5 1 1 A 106 106 LYS N N 106 121.082 117.567 3.515 1 1 1247 . 5 1 1 A 107 107 LYS H H 107 8.271 8.565 -0.294 1 1 1248 . 5 1 1 A 107 107 LYS HA H 107 4.329 4.498 -0.169 1 1 1255 . 5 1 1 A 107 107 LYS CA C 107 56.673 59.150 -2.477 1 1 1256 . 5 1 1 A 107 107 LYS CB C 107 33.341 64.266 -30.925 1 1 1258 . 5 1 1 A 107 107 LYS N N 107 121.869 114.775 7.094 1 1 1259 . 5 1 1 A 108 108 LEU H H 108 8.481 7.448 1.033 1 1 1260 . 5 1 1 A 108 108 LEU HA H 108 4.637 4.979 -0.342 1 1 1269 . 5 1 1 A 108 108 LEU CA C 108 53.819 54.560 -0.741 1 1 1270 . 5 1 1 A 108 108 LEU CB C 108 45.135 35.830 9.305 1 1 1272 . 5 1 1 A 108 108 LEU N N 108 124.360 117.371 6.989 1 1 1273 . 5 1 1 A 109 109 LYS H H 109 8.657 8.888 -0.231 1 1 1274 . 5 1 1 A 109 109 LYS HA H 109 4.565 4.508 0.057 1 1 1283 . 5 1 1 A 109 109 LYS CA C 109 55.511 59.143 -3.632 1 1 1284 . 5 1 1 A 109 109 LYS CB C 109 32.029 64.046 -32.017 1 1 1287 . 5 1 1 A 109 109 LYS N N 109 123.165 117.762 5.403 1 1 1288 . 5 1 1 A 110 110 PRO HA H 110 4.232 3.586 0.646 1 1 1295 . 5 1 1 A 110 110 PRO CA C 110 66.732 66.667 0.065 1 1 1296 . 5 1 1 A 110 110 PRO CB C 110 32.481 31.578 0.903 1 1 1299 . 5 1 1 A 111 111 GLU HA H 111 4.221 3.908 0.313 1 1 1304 . 5 1 1 A 111 111 GLU CA C 111 59.819 59.832 -0.013 1 1 1305 . 5 1 1 A 111 111 GLU CB C 111 29.250 29.157 0.093 1 1 1307 . 5 1 1 A 112 112 ILE H H 112 7.233 8.208 -0.975 1 1 1308 . 5 1 1 A 112 112 ILE HA H 112 3.848 4.086 -0.238 1 1 1318 . 5 1 1 A 112 112 ILE CA C 112 62.635 59.148 3.487 1 1 1319 . 5 1 1 A 112 112 ILE CB C 112 37.159 29.262 7.897 1 1 1323 . 5 1 1 A 112 112 ILE N N 112 120.783 118.176 2.607 1 1 1324 . 5 1 1 A 113 113 LYS H H 113 8.268 7.921 0.347 1 1 1325 . 5 1 1 A 113 113 LYS HA H 113 3.849 3.648 0.201 1 1 1328 . 5 1 1 A 113 113 LYS CA C 113 60.248 65.106 -4.858 1 1 1329 . 5 1 1 A 113 113 LYS CB C 113 32.668 37.556 -4.888 1 1 1330 . 5 1 1 A 113 113 LYS N N 113 121.680 121.702 -0.022 1 1 1331 . 5 1 1 A 114 114 GLY H H 114 8.460 8.337 0.123 1 1 1334 . 5 1 1 A 114 114 GLY CA C 114 47.600 61.136 -13.536 1 1 1335 . 5 1 1 A 114 114 GLY N N 114 105.413 116.634 -11.221 1 1 1336 . 5 1 1 A 115 115 LYS H H 115 7.352 7.668 -0.316 1 1 1337 . 5 1 1 A 115 115 LYS HA H 115 4.189 4.487 -0.298 1 1 1346 . 5 1 1 A 115 115 LYS CA C 115 59.689 57.245 2.444 1 1 1347 . 5 1 1 A 115 115 LYS CB C 115 33.428 40.587 -7.159 1 1 1351 . 5 1 1 A 115 115 LYS N N 115 121.599 121.954 -0.355 1 1 1352 . 5 1 1 A 116 116 LEU H H 116 8.046 8.111 -0.065 1 1 1353 . 5 1 1 A 116 116 LEU HA H 116 4.153 3.896 0.257 1 1 1363 . 5 1 1 A 116 116 LEU CA C 116 57.698 64.936 -7.238 1 1 1364 . 5 1 1 A 116 116 LEU CB C 116 42.070 31.636 10.434 1 1 1366 . 5 1 1 A 116 116 LEU N N 116 118.827 118.987 -0.160 1 1 1367 . 5 1 1 A 117 117 SER H H 117 8.321 7.558 0.763 1 1 1368 . 5 1 1 A 117 117 SER HA H 117 4.334 4.189 0.145 1 1 1371 . 5 1 1 A 117 117 SER CA C 117 61.467 54.230 7.237 1 1 1372 . 5 1 1 A 117 117 SER CB C 117 63.613 41.922 21.691 1 1 1373 . 5 1 1 A 117 117 SER N N 117 114.829 115.886 -1.057 1 1 1374 . 5 1 1 A 118 118 ARG H H 118 7.001 7.832 -0.831 1 1 1375 . 5 1 1 A 118 118 ARG HA H 118 4.403 3.879 0.524 1 1 1382 . 5 1 1 A 118 118 ARG CA C 118 56.734 56.954 -0.220 1 1 1383 . 5 1 1 A 118 118 ARG CB C 118 31.115 27.225 3.890 1 1 1385 . 5 1 1 A 118 118 ARG N N 118 118.114 114.198 3.916 1 1 1386 . 5 1 1 A 119 119 LEU H H 119 7.365 8.318 -0.953 1 1 1387 . 5 1 1 A 119 119 LEU HA H 119 4.253 4.885 -0.632 1 1 1397 . 5 1 1 A 119 119 LEU CA C 119 54.639 57.730 -3.091 1 1 1398 . 5 1 1 A 119 119 LEU CB C 119 41.700 31.312 10.388 1 1 1401 . 5 1 1 A 119 119 LEU N N 119 119.181 117.346 1.835 1 1 1402 . 5 1 1 A 120 120 ARG H H 120 8.766 8.717 0.049 1 1 1403 . 5 1 1 A 120 120 ARG HA H 120 4.374 4.442 -0.068 1 1 1410 . 5 1 1 A 120 120 ARG CA C 120 56.426 59.287 -2.861 1 1 1411 . 5 1 1 A 120 120 ARG CB C 120 32.414 63.675 -31.261 1 1 1414 . 5 1 1 A 120 120 ARG N N 120 122.099 120.517 1.582 1 1 1415 . 5 1 1 A 121 121 LEU H H 121 8.312 8.723 -0.411 1 1 1416 . 5 1 1 A 121 121 LEU HA H 121 4.407 3.554 0.853 1 1 1426 . 5 1 1 A 121 121 LEU CA C 121 56.028 67.028 -11.000 1 1 1427 . 5 1 1 A 121 121 LEU CB C 121 43.122 32.011 11.111 1 1 1430 . 5 1 1 A 121 121 LEU N N 121 118.761 124.032 -5.271 1 1 1431 . 5 1 1 A 122 122 PHE H H 122 7.143 8.327 -1.184 1 1 1432 . 5 1 1 A 122 122 PHE HA H 122 5.201 4.254 0.947 1 1 1439 . 5 1 1 A 122 122 PHE CA C 122 53.047 59.187 -6.140 1 1 1440 . 5 1 1 A 122 122 PHE CB C 122 40.844 29.363 11.481 1 1 1441 . 5 1 1 A 122 122 PHE N N 122 112.750 120.019 -7.269 1 1 1442 . 5 1 1 A 123 123 PRO HA H 123 3.908 3.967 -0.059 1 1 1449 . 5 1 1 A 123 123 PRO CA C 123 65.478 59.211 6.267 1 1 1450 . 5 1 1 A 123 123 PRO CB C 123 33.248 29.381 3.867 1 1 1452 . 5 1 1 A 124 124 LEU H H 124 7.208 7.935 -0.727 1 1 1453 . 5 1 1 A 124 124 LEU HA H 124 4.673 4.049 0.624 1 1 1463 . 5 1 1 A 124 124 LEU CA C 124 53.307 57.737 -4.430 1 1 1464 . 5 1 1 A 124 124 LEU CB C 124 42.853 41.937 0.916 1 1 1468 . 5 1 1 A 124 124 LEU N N 124 113.875 121.152 -7.277 1 1 1469 . 5 1 1 A 125 125 SER H H 125 8.990 8.069 0.921 1 1 1470 . 5 1 1 A 125 125 SER HA H 125 4.533 3.956 0.577 1 1 1473 . 5 1 1 A 125 125 SER CA C 125 59.198 59.599 -0.401 1 1 1474 . 5 1 1 A 125 125 SER CB C 125 64.578 29.335 35.243 1 1 1475 . 5 1 1 A 125 125 SER N N 125 117.894 119.981 -2.087 1 1 1476 . 5 1 1 A 126 126 SER H H 126 8.618 7.658 0.960 1 1 1477 . 5 1 1 A 126 126 SER HA H 126 4.614 3.956 0.658 1 1 1480 . 5 1 1 A 126 126 SER CA C 126 58.730 60.704 -1.974 1 1 1481 . 5 1 1 A 126 126 SER CB C 126 64.367 32.406 31.961 1 1 1482 . 5 1 1 A 126 126 SER N N 126 118.602 118.974 -0.372 1 1 1483 . 5 1 1 A 127 127 SER HA H 127 4.530 3.756 0.774 1 1 1486 . 5 1 1 A 127 127 SER CA C 127 58.954 65.726 -6.772 1 1 1487 . 5 1 1 A 127 127 SER CB C 127 64.379 31.497 32.882 1 1 1488 . 5 1 1 A 128 128 ALA H H 128 8.345 8.315 0.030 1 1 1489 . 5 1 1 A 128 128 ALA HA H 128 4.432 3.949 0.483 1 1 1493 . 5 1 1 A 128 128 ALA CA C 128 52.963 59.225 -6.262 1 1 1494 . 5 1 1 A 128 128 ALA CB C 128 19.924 29.670 -9.746 1 1 1495 . 5 1 1 A 128 128 ALA N N 128 126.185 122.157 4.028 1 1 1496 . 5 1 1 A 129 129 GLU H H 129 8.329 7.958 0.371 1 1 1497 . 5 1 1 A 129 129 GLU HA H 129 4.353 4.058 0.295 1 1 1502 . 5 1 1 A 129 129 GLU CA C 129 57.111 58.600 -1.489 1 1 1503 . 5 1 1 A 129 129 GLU CB C 129 30.949 28.480 2.469 1 1 1504 . 5 1 1 A 129 129 GLU N N 129 120.842 118.603 2.239 1 1 1505 . 5 1 1 A 130 130 LYS H H 130 7.947 7.963 -0.016 1 1 1506 . 5 1 1 A 130 130 LYS HA H 130 3.835 4.024 -0.189 1 1 1515 . 5 1 1 A 130 130 LYS CA C 130 57.756 59.679 -1.923 1 1 1516 . 5 1 1 A 130 130 LYS CB C 130 33.156 32.135 1.021 1 1 826 . 6 1 1 A 70 70 GLY H H 70 9.295 8.675 0.620 1 1 829 . 6 1 1 A 70 70 GLY CA C 70 46.552 59.407 -12.855 1 1 830 . 6 1 1 A 70 70 GLY N N 70 108.643 117.441 -8.798 1 1 832 . 6 1 1 A 71 71 VAL HA H 71 3.538 4.845 -1.307 1 1 840 . 6 1 1 A 71 71 VAL CA C 71 65.623 62.866 2.757 1 1 841 . 6 1 1 A 71 71 VAL CB C 71 30.251 31.992 -1.741 1 1 844 . 6 1 1 A 71 71 VAL N N 71 110.808 136.588 -25.780 1 1 845 . 6 1 1 A 72 72 CYS H H 72 8.022 8.943 -0.921 1 1 846 . 6 1 1 A 72 72 CYS HA H 72 3.469 4.922 -1.453 1 1 849 . 6 1 1 A 72 72 CYS CA C 72 62.733 57.633 5.100 1 1 850 . 6 1 1 A 72 72 CYS CB C 72 27.163 64.451 -37.288 1 1 851 . 6 1 1 A 72 72 CYS N N 72 109.483 119.196 -9.713 1 1 852 . 6 1 1 A 73 73 SER H H 73 7.996 8.182 -0.186 1 1 853 . 6 1 1 A 73 73 SER HA H 73 4.439 4.014 0.425 1 1 856 . 6 1 1 A 73 73 SER CA C 73 62.145 59.299 2.846 1 1 857 . 6 1 1 A 73 73 SER CB C 73 66.013 29.360 36.653 1 1 858 . 6 1 1 A 73 73 SER N N 73 118.630 122.249 -3.619 1 1 859 . 6 1 1 A 74 74 LYS H H 74 10.186 7.866 2.320 1 1 860 . 6 1 1 A 74 74 LYS HA H 74 4.172 3.960 0.212 1 1 867 . 6 1 1 A 74 74 LYS CA C 74 59.848 58.375 1.473 1 1 868 . 6 1 1 A 74 74 LYS CB C 74 34.278 41.457 -7.179 1 1 870 . 6 1 1 A 74 74 LYS N N 74 123.341 119.756 3.585 1 1 871 . 6 1 1 A 75 75 ASP H H 75 7.542 8.236 -0.694 1 1 872 . 6 1 1 A 75 75 ASP HA H 75 3.538 3.940 -0.402 1 1 875 . 6 1 1 A 75 75 ASP CA C 75 52.472 59.898 -7.426 1 1 876 . 6 1 1 A 75 75 ASP CB C 75 42.360 29.309 13.051 1 1 877 . 6 1 1 A 75 75 ASP N N 75 112.035 119.595 -7.560 1 1 878 . 6 1 1 A 76 76 VAL H H 76 8.128 8.353 -0.225 1 1 879 . 6 1 1 A 76 76 VAL HA H 76 4.106 4.022 0.084 1 1 887 . 6 1 1 A 76 76 VAL CA C 76 65.179 59.161 6.018 1 1 888 . 6 1 1 A 76 76 VAL CB C 76 32.174 29.090 3.084 1 1 891 . 6 1 1 A 76 76 VAL N N 76 117.992 120.594 -2.602 1 1 892 . 6 1 1 A 77 77 TRP H H 77 6.869 7.975 -1.106 1 1 893 . 6 1 1 A 77 77 TRP HA H 77 4.509 4.100 0.409 1 1 899 . 6 1 1 A 77 77 TRP CA C 77 59.207 57.739 1.468 1 1 900 . 6 1 1 A 77 77 TRP CB C 77 28.941 41.370 -12.429 1 1 901 . 6 1 1 A 77 77 TRP N N 77 123.077 121.498 1.579 1 1 903 . 6 1 1 A 78 78 GLU H H 78 8.593 8.440 0.153 1 1 904 . 6 1 1 A 78 78 GLU HA H 78 4.318 3.895 0.423 1 1 909 . 6 1 1 A 78 78 GLU CA C 78 60.038 59.239 0.799 1 1 910 . 6 1 1 A 78 78 GLU CB C 78 31.178 28.314 2.864 1 1 912 . 6 1 1 A 78 78 GLU N N 78 121.505 117.738 3.767 1 1 913 . 6 1 1 A 79 79 PHE H H 79 8.071 8.156 -0.085 1 1 914 . 6 1 1 A 79 79 PHE HA H 79 4.986 4.063 0.923 1 1 919 . 6 1 1 A 79 79 PHE CA C 79 58.749 58.768 -0.019 1 1 920 . 6 1 1 A 79 79 PHE CB C 79 39.732 28.963 10.769 1 1 921 . 6 1 1 A 79 79 PHE N N 79 118.384 118.149 0.235 1 1 922 . 6 1 1 A 80 80 LEU H H 80 9.309 7.919 1.390 1 1 923 . 6 1 1 A 80 80 LEU HA H 80 3.970 4.442 -0.472 1 1 933 . 6 1 1 A 80 80 LEU CA C 80 59.307 56.426 2.881 1 1 934 . 6 1 1 A 80 80 LEU CB C 80 43.257 38.229 5.028 1 1 937 . 6 1 1 A 80 80 LEU N N 80 122.915 118.373 4.542 1 1 938 . 6 1 1 A 81 81 GLU H H 81 8.282 7.963 0.319 1 1 939 . 6 1 1 A 81 81 GLU HA H 81 3.832 3.590 0.242 1 1 944 . 6 1 1 A 81 81 GLU CA C 81 62.069 65.203 -3.134 1 1 945 . 6 1 1 A 81 81 GLU CB C 81 30.249 38.136 -7.887 1 1 947 . 6 1 1 A 81 81 GLU N N 81 119.345 120.294 -0.949 1 1 948 . 6 1 1 A 82 82 LEU H H 82 8.236 7.933 0.303 1 1 949 . 6 1 1 A 82 82 LEU HA H 82 4.187 4.393 -0.206 1 1 959 . 6 1 1 A 82 82 LEU CA C 82 58.348 58.774 -0.426 1 1 960 . 6 1 1 A 82 82 LEU CB C 82 42.827 31.976 10.851 1 1 963 . 6 1 1 A 82 82 LEU N N 82 120.013 119.383 0.630 1 1 964 . 6 1 1 A 83 83 GLN H H 83 7.949 8.093 -0.144 1 1 965 . 6 1 1 A 83 83 GLN HA H 83 3.812 3.889 -0.077 1 1 968 . 6 1 1 A 83 83 GLN CA C 83 60.248 58.166 2.082 1 1 969 . 6 1 1 A 83 83 GLN CB C 83 33.537 41.506 -7.969 1 1 970 . 6 1 1 A 83 83 GLN N N 83 116.443 120.291 -3.848 1 1 971 . 6 1 1 A 84 84 ILE H H 84 8.407 8.607 -0.200 1 1 972 . 6 1 1 A 84 84 ILE HA H 84 3.644 4.106 -0.462 1 1 982 . 6 1 1 A 84 84 ILE CA C 84 67.288 58.851 8.437 1 1 983 . 6 1 1 A 84 84 ILE CB C 84 38.305 29.130 9.175 1 1 987 . 6 1 1 A 84 84 ILE N N 84 120.422 117.862 2.560 1 1 988 . 6 1 1 A 85 85 GLU H H 85 7.741 8.175 -0.434 1 1 989 . 6 1 1 A 85 85 GLU HA H 85 3.811 5.021 -1.210 1 1 994 . 6 1 1 A 85 85 GLU CA C 85 59.862 52.714 7.148 1 1 995 . 6 1 1 A 85 85 GLU CB C 85 30.360 46.406 -16.046 1 1 997 . 6 1 1 A 85 85 GLU N N 85 115.705 116.998 -1.293 1 1 998 . 6 1 1 A 86 86 GLU H H 86 7.818 8.759 -0.941 1 1 999 . 6 1 1 A 86 86 GLU HA H 86 4.274 4.781 -0.507 1 1 1004 . 6 1 1 A 86 86 GLU CA C 86 58.068 55.917 2.151 1 1 1005 . 6 1 1 A 86 86 GLU CB C 86 31.424 33.289 -1.865 1 1 1007 . 6 1 1 A 86 86 GLU N N 86 114.297 118.781 -4.484 1 1 1008 . 6 1 1 A 87 87 ILE H H 87 8.753 8.429 0.324 1 1 1019 . 6 1 1 A 87 87 ILE CA C 87 62.660 44.513 18.147 1 1 1024 . 6 1 1 A 87 87 ILE N N 87 118.890 110.517 8.373 1 1 1025 . 6 1 1 A 88 88 TYR H H 88 8.059 8.801 -0.742 1 1 1026 . 6 1 1 A 88 88 TYR HA H 88 5.447 4.173 1.274 1 1 1033 . 6 1 1 A 88 88 TYR CA C 88 55.285 58.691 -3.406 1 1 1034 . 6 1 1 A 88 88 TYR CB C 88 40.687 32.063 8.624 1 1 1035 . 6 1 1 A 88 88 TYR N N 88 119.252 124.847 -5.595 1 1 1036 . 6 1 1 A 89 89 PRO HA H 89 4.410 4.053 0.357 1 1 1043 . 6 1 1 A 89 89 PRO CA C 89 66.374 59.220 7.154 1 1 1044 . 6 1 1 A 89 89 PRO CB C 89 31.377 29.246 2.131 1 1 1047 . 6 1 1 A 90 90 GLU H H 90 9.234 8.197 1.037 1 1 1048 . 6 1 1 A 90 90 GLU HA H 90 4.379 4.011 0.368 1 1 1053 . 6 1 1 A 90 90 GLU CA C 90 59.098 58.714 0.384 1 1 1054 . 6 1 1 A 90 90 GLU CB C 90 29.461 28.505 0.956 1 1 1056 . 6 1 1 A 90 90 GLU N N 90 117.574 118.147 -0.573 1 1 1057 . 6 1 1 A 91 91 GLU H H 91 7.966 8.113 -0.147 1 1 1058 . 6 1 1 A 91 91 GLU HA H 91 4.890 4.027 0.863 1 1 1063 . 6 1 1 A 91 91 GLU CA C 91 55.324 59.035 -3.711 1 1 1064 . 6 1 1 A 91 91 GLU CB C 91 31.590 29.256 2.334 1 1 1066 . 6 1 1 A 91 91 GLU N N 91 119.310 119.587 -0.277 1 1 1067 . 6 1 1 A 92 92 GLU H H 92 7.263 7.921 -0.658 1 1 1068 . 6 1 1 A 92 92 GLU HA H 92 3.789 3.985 -0.196 1 1 1073 . 6 1 1 A 92 92 GLU CA C 92 60.628 57.953 2.675 1 1 1074 . 6 1 1 A 92 92 GLU CB C 92 30.531 41.645 -11.114 1 1 1076 . 6 1 1 A 92 92 GLU N N 92 121.332 120.433 0.899 1 1 1077 . 6 1 1 A 93 93 GLU H H 93 8.646 7.917 0.729 1 1 1078 . 6 1 1 A 93 93 GLU HA H 93 4.127 4.093 0.034 1 1 1083 . 6 1 1 A 93 93 GLU CA C 93 60.528 55.395 5.133 1 1 1084 . 6 1 1 A 93 93 GLU CB C 93 29.744 18.215 11.529 1 1 1086 . 6 1 1 A 93 93 GLU N N 93 118.207 121.370 -3.163 1 1 1087 . 6 1 1 A 94 94 ILE H H 94 7.766 8.310 -0.544 1 1 1088 . 6 1 1 A 94 94 ILE HA H 94 3.976 3.918 0.058 1 1 1098 . 6 1 1 A 94 94 ILE CA C 94 64.361 58.147 6.214 1 1 1099 . 6 1 1 A 94 94 ILE CB C 94 38.921 41.398 -2.477 1 1 1103 . 6 1 1 A 94 94 ILE N N 94 119.072 118.140 0.932 1 1 1104 . 6 1 1 A 95 95 LEU H H 95 8.340 8.028 0.312 1 1 1105 . 6 1 1 A 95 95 LEU HA H 95 4.300 4.160 0.140 1 1 1115 . 6 1 1 A 95 95 LEU CA C 95 57.905 59.522 -1.617 1 1 1116 . 6 1 1 A 95 95 LEU CB C 95 42.144 29.294 12.850 1 1 1119 . 6 1 1 A 95 95 LEU N N 95 121.325 117.878 3.447 1 1 1120 . 6 1 1 A 96 96 LYS H H 96 8.899 7.972 0.927 1 1 1121 . 6 1 1 A 96 96 LYS HA H 96 4.075 4.033 0.042 1 1 1126 . 6 1 1 A 96 96 LYS CA C 96 61.707 57.835 3.872 1 1 1127 . 6 1 1 A 96 96 LYS CB C 96 32.910 41.677 -8.767 1 1 1128 . 6 1 1 A 96 96 LYS N N 96 120.018 122.093 -2.075 1 1 1129 . 6 1 1 A 97 97 LYS H H 97 7.808 8.001 -0.193 1 1 1130 . 6 1 1 A 97 97 LYS HA H 97 4.045 4.295 -0.250 1 1 1139 . 6 1 1 A 97 97 LYS CA C 97 60.198 56.118 4.080 1 1 1140 . 6 1 1 A 97 97 LYS CB C 97 32.600 41.317 -8.717 1 1 1143 . 6 1 1 A 97 97 LYS N N 97 121.016 115.615 5.401 1 1 1144 . 6 1 1 A 98 98 ALA H H 98 7.814 8.185 -0.371 1 1 1145 . 6 1 1 A 98 98 ALA HA H 98 4.320 4.706 -0.386 1 1 1149 . 6 1 1 A 98 98 ALA CA C 98 55.260 54.487 0.773 1 1 1150 . 6 1 1 A 98 98 ALA CB C 98 19.468 39.595 -20.127 1 1 1151 . 6 1 1 A 98 98 ALA N N 98 122.102 116.859 5.243 1 1 1152 . 6 1 1 A 99 99 LEU H H 99 8.212 7.896 0.316 1 1 1153 . 6 1 1 A 99 99 LEU HA H 99 4.187 4.851 -0.664 1 1 1160 . 6 1 1 A 99 99 LEU CA C 99 58.398 56.615 1.783 1 1 1161 . 6 1 1 A 99 99 LEU CB C 99 42.720 37.004 5.716 1 1 1164 . 6 1 1 A 99 99 LEU N N 99 118.467 115.471 2.996 1 1 1165 . 6 1 1 A 100 100 ARG H H 100 7.738 7.544 0.194 1 1 1166 . 6 1 1 A 100 100 ARG HA H 100 3.894 5.376 -1.482 1 1 1173 . 6 1 1 A 100 100 ARG CA C 100 60.135 52.897 7.238 1 1 1174 . 6 1 1 A 100 100 ARG CB C 100 30.187 45.651 -15.464 1 1 1177 . 6 1 1 A 100 100 ARG N N 100 119.100 117.516 1.584 1 1 1178 . 6 1 1 A 101 101 ASP H H 101 8.186 8.224 -0.038 1 1 1179 . 6 1 1 A 101 101 ASP HA H 101 4.424 4.930 -0.506 1 1 1182 . 6 1 1 A 101 101 ASP CA C 101 57.902 51.164 6.738 1 1 1183 . 6 1 1 A 101 101 ASP CB C 101 40.033 41.049 -1.016 1 1 1184 . 6 1 1 A 101 101 ASP N N 101 121.899 119.148 2.751 1 1 1185 . 6 1 1 A 102 102 LEU H H 102 8.730 8.788 -0.058 1 1 1186 . 6 1 1 A 102 102 LEU HA H 102 4.373 4.136 0.237 1 1 1195 . 6 1 1 A 102 102 LEU CA C 102 58.218 57.727 0.491 1 1 1196 . 6 1 1 A 102 102 LEU CB C 102 42.839 29.695 13.144 1 1 1199 . 6 1 1 A 102 102 LEU N N 102 124.505 124.190 0.315 1 1 1200 . 6 1 1 A 103 103 LYS HA H 103 3.726 4.074 -0.348 1 1 1209 . 6 1 1 A 103 103 LYS CA C 103 59.760 55.709 4.051 1 1 1210 . 6 1 1 A 103 103 LYS CB C 103 32.822 32.270 0.552 1 1 1214 . 6 1 1 A 104 104 ARG H H 104 7.409 7.766 -0.357 1 1 1222 . 6 1 1 A 104 104 ARG CA C 104 56.298 45.051 11.247 1 1 1226 . 6 1 1 A 104 104 ARG N N 104 115.912 105.566 10.346 1 1 1227 . 6 1 1 A 105 105 GLY H H 105 8.046 6.996 1.050 1 1 1230 . 6 1 1 A 105 105 GLY CA C 105 46.309 55.205 -8.896 1 1 1231 . 6 1 1 A 105 105 GLY N N 105 108.860 117.016 -8.156 1 1 1232 . 6 1 1 A 106 106 LYS H H 106 8.033 8.401 -0.368 1 1 1233 . 6 1 1 A 106 106 LYS HA H 106 4.394 4.375 0.019 1 1 1242 . 6 1 1 A 106 106 LYS CA C 106 55.822 55.202 0.620 1 1 1243 . 6 1 1 A 106 106 LYS CB C 106 33.449 42.941 -9.492 1 1 1246 . 6 1 1 A 106 106 LYS N N 106 121.082 118.277 2.805 1 1 1247 . 6 1 1 A 107 107 LYS H H 107 8.271 8.790 -0.519 1 1 1248 . 6 1 1 A 107 107 LYS HA H 107 4.329 4.713 -0.384 1 1 1255 . 6 1 1 A 107 107 LYS CA C 107 56.673 58.944 -2.271 1 1 1256 . 6 1 1 A 107 107 LYS CB C 107 33.341 64.451 -31.110 1 1 1258 . 6 1 1 A 107 107 LYS N N 107 121.869 114.518 7.351 1 1 1259 . 6 1 1 A 108 108 LEU H H 108 8.481 7.510 0.971 1 1 1260 . 6 1 1 A 108 108 LEU HA H 108 4.637 4.830 -0.193 1 1 1269 . 6 1 1 A 108 108 LEU CA C 108 53.819 54.499 -0.680 1 1 1270 . 6 1 1 A 108 108 LEU CB C 108 45.135 36.631 8.504 1 1 1272 . 6 1 1 A 108 108 LEU N N 108 124.360 119.967 4.393 1 1 1273 . 6 1 1 A 109 109 LYS H H 109 8.657 8.882 -0.225 1 1 1274 . 6 1 1 A 109 109 LYS HA H 109 4.565 4.482 0.083 1 1 1283 . 6 1 1 A 109 109 LYS CA C 109 55.511 59.106 -3.595 1 1 1284 . 6 1 1 A 109 109 LYS CB C 109 32.029 64.032 -32.003 1 1 1287 . 6 1 1 A 109 109 LYS N N 109 123.165 118.039 5.126 1 1 1288 . 6 1 1 A 110 110 PRO HA H 110 4.232 3.600 0.632 1 1 1295 . 6 1 1 A 110 110 PRO CA C 110 66.732 66.585 0.147 1 1 1296 . 6 1 1 A 110 110 PRO CB C 110 32.481 31.469 1.012 1 1 1299 . 6 1 1 A 111 111 GLU HA H 111 4.221 3.916 0.305 1 1 1304 . 6 1 1 A 111 111 GLU CA C 111 59.819 59.826 -0.007 1 1 1305 . 6 1 1 A 111 111 GLU CB C 111 29.250 29.159 0.091 1 1 1307 . 6 1 1 A 112 112 ILE H H 112 7.233 8.166 -0.933 1 1 1308 . 6 1 1 A 112 112 ILE HA H 112 3.848 4.080 -0.232 1 1 1318 . 6 1 1 A 112 112 ILE CA C 112 62.635 59.197 3.438 1 1 1319 . 6 1 1 A 112 112 ILE CB C 112 37.159 29.303 7.856 1 1 1323 . 6 1 1 A 112 112 ILE N N 112 120.783 118.175 2.608 1 1 1324 . 6 1 1 A 113 113 LYS H H 113 8.268 7.997 0.271 1 1 1325 . 6 1 1 A 113 113 LYS HA H 113 3.849 3.711 0.138 1 1 1328 . 6 1 1 A 113 113 LYS CA C 113 60.248 65.245 -4.997 1 1 1329 . 6 1 1 A 113 113 LYS CB C 113 32.668 37.570 -4.902 1 1 1330 . 6 1 1 A 113 113 LYS N N 113 121.680 121.730 -0.050 1 1 1331 . 6 1 1 A 114 114 GLY H H 114 8.460 8.360 0.100 1 1 1334 . 6 1 1 A 114 114 GLY CA C 114 47.600 61.099 -13.499 1 1 1335 . 6 1 1 A 114 114 GLY N N 114 105.413 116.509 -11.096 1 1 1336 . 6 1 1 A 115 115 LYS H H 115 7.352 7.882 -0.530 1 1 1337 . 6 1 1 A 115 115 LYS HA H 115 4.189 4.438 -0.249 1 1 1346 . 6 1 1 A 115 115 LYS CA C 115 59.689 57.254 2.435 1 1 1347 . 6 1 1 A 115 115 LYS CB C 115 33.428 40.693 -7.265 1 1 1351 . 6 1 1 A 115 115 LYS N N 115 121.599 121.446 0.153 1 1 1352 . 6 1 1 A 116 116 LEU H H 116 8.046 8.152 -0.106 1 1 1353 . 6 1 1 A 116 116 LEU HA H 116 4.153 3.877 0.276 1 1 1363 . 6 1 1 A 116 116 LEU CA C 116 57.698 64.935 -7.237 1 1 1364 . 6 1 1 A 116 116 LEU CB C 116 42.070 31.604 10.466 1 1 1366 . 6 1 1 A 116 116 LEU N N 116 118.827 119.282 -0.455 1 1 1367 . 6 1 1 A 117 117 SER H H 117 8.321 7.528 0.793 1 1 1368 . 6 1 1 A 117 117 SER HA H 117 4.334 4.200 0.134 1 1 1371 . 6 1 1 A 117 117 SER CA C 117 61.467 54.255 7.212 1 1 1372 . 6 1 1 A 117 117 SER CB C 117 63.613 41.911 21.702 1 1 1373 . 6 1 1 A 117 117 SER N N 117 114.829 116.332 -1.503 1 1 1374 . 6 1 1 A 118 118 ARG H H 118 7.001 7.836 -0.835 1 1 1375 . 6 1 1 A 118 118 ARG HA H 118 4.403 3.881 0.522 1 1 1382 . 6 1 1 A 118 118 ARG CA C 118 56.734 56.958 -0.224 1 1 1383 . 6 1 1 A 118 118 ARG CB C 118 31.115 27.239 3.876 1 1 1385 . 6 1 1 A 118 118 ARG N N 118 118.114 114.188 3.926 1 1 1386 . 6 1 1 A 119 119 LEU H H 119 7.365 8.268 -0.903 1 1 1387 . 6 1 1 A 119 119 LEU HA H 119 4.253 4.887 -0.634 1 1 1397 . 6 1 1 A 119 119 LEU CA C 119 54.639 57.740 -3.101 1 1 1398 . 6 1 1 A 119 119 LEU CB C 119 41.700 31.141 10.559 1 1 1401 . 6 1 1 A 119 119 LEU N N 119 119.181 117.357 1.824 1 1 1402 . 6 1 1 A 120 120 ARG H H 120 8.766 8.725 0.041 1 1 1403 . 6 1 1 A 120 120 ARG HA H 120 4.374 4.455 -0.081 1 1 1410 . 6 1 1 A 120 120 ARG CA C 120 56.426 59.294 -2.868 1 1 1411 . 6 1 1 A 120 120 ARG CB C 120 32.414 63.735 -31.321 1 1 1414 . 6 1 1 A 120 120 ARG N N 120 122.099 120.497 1.602 1 1 1415 . 6 1 1 A 121 121 LEU H H 121 8.312 8.725 -0.413 1 1 1416 . 6 1 1 A 121 121 LEU HA H 121 4.407 3.556 0.851 1 1 1426 . 6 1 1 A 121 121 LEU CA C 121 56.028 67.028 -11.000 1 1 1427 . 6 1 1 A 121 121 LEU CB C 121 43.122 31.984 11.138 1 1 1430 . 6 1 1 A 121 121 LEU N N 121 118.761 124.028 -5.267 1 1 1431 . 6 1 1 A 122 122 PHE H H 122 7.143 8.192 -1.049 1 1 1432 . 6 1 1 A 122 122 PHE HA H 122 5.201 4.110 1.091 1 1 1439 . 6 1 1 A 122 122 PHE CA C 122 53.047 59.103 -6.056 1 1 1440 . 6 1 1 A 122 122 PHE CB C 122 40.844 29.459 11.385 1 1 1441 . 6 1 1 A 122 122 PHE N N 122 112.750 119.820 -7.070 1 1 1442 . 6 1 1 A 123 123 PRO HA H 123 3.908 3.985 -0.077 1 1 1449 . 6 1 1 A 123 123 PRO CA C 123 65.478 59.229 6.249 1 1 1450 . 6 1 1 A 123 123 PRO CB C 123 33.248 29.300 3.948 1 1 1452 . 6 1 1 A 124 124 LEU H H 124 7.208 7.871 -0.663 1 1 1453 . 6 1 1 A 124 124 LEU HA H 124 4.673 4.071 0.602 1 1 1463 . 6 1 1 A 124 124 LEU CA C 124 53.307 57.652 -4.345 1 1 1464 . 6 1 1 A 124 124 LEU CB C 124 42.853 41.954 0.899 1 1 1468 . 6 1 1 A 124 124 LEU N N 124 113.875 121.302 -7.427 1 1 1469 . 6 1 1 A 125 125 SER H H 125 8.990 8.132 0.858 1 1 1470 . 6 1 1 A 125 125 SER HA H 125 4.533 3.929 0.604 1 1 1473 . 6 1 1 A 125 125 SER CA C 125 59.198 59.857 -0.659 1 1 1474 . 6 1 1 A 125 125 SER CB C 125 64.578 29.198 35.380 1 1 1475 . 6 1 1 A 125 125 SER N N 125 117.894 120.392 -2.498 1 1 1476 . 6 1 1 A 126 126 SER H H 126 8.618 7.785 0.833 1 1 1477 . 6 1 1 A 126 126 SER HA H 126 4.614 3.991 0.623 1 1 1480 . 6 1 1 A 126 126 SER CA C 126 58.730 59.817 -1.087 1 1 1481 . 6 1 1 A 126 126 SER CB C 126 64.367 32.353 32.014 1 1 1482 . 6 1 1 A 126 126 SER N N 126 118.602 118.469 0.133 1 1 1483 . 6 1 1 A 127 127 SER HA H 127 4.530 3.778 0.752 1 1 1486 . 6 1 1 A 127 127 SER CA C 127 58.954 65.743 -6.789 1 1 1487 . 6 1 1 A 127 127 SER CB C 127 64.379 31.501 32.878 1 1 1488 . 6 1 1 A 128 128 ALA H H 128 8.345 8.310 0.035 1 1 1489 . 6 1 1 A 128 128 ALA HA H 128 4.432 3.962 0.470 1 1 1493 . 6 1 1 A 128 128 ALA CA C 128 52.963 59.237 -6.274 1 1 1494 . 6 1 1 A 128 128 ALA CB C 128 19.924 29.722 -9.798 1 1 1495 . 6 1 1 A 128 128 ALA N N 128 126.185 122.163 4.022 1 1 1496 . 6 1 1 A 129 129 GLU H H 129 8.329 8.067 0.262 1 1 1497 . 6 1 1 A 129 129 GLU HA H 129 4.353 4.079 0.274 1 1 1502 . 6 1 1 A 129 129 GLU CA C 129 57.111 58.635 -1.524 1 1 1503 . 6 1 1 A 129 129 GLU CB C 129 30.949 28.654 2.295 1 1 1504 . 6 1 1 A 129 129 GLU N N 129 120.842 118.635 2.207 1 1 1505 . 6 1 1 A 130 130 LYS H H 130 7.947 7.987 -0.040 1 1 1506 . 6 1 1 A 130 130 LYS HA H 130 3.835 4.029 -0.194 1 1 1515 . 6 1 1 A 130 130 LYS CA C 130 57.756 59.764 -2.008 1 1 1516 . 6 1 1 A 130 130 LYS CB C 130 33.156 32.065 1.091 1 1 826 . 7 1 1 A 70 70 GLY H H 70 9.295 8.626 0.669 1 1 829 . 7 1 1 A 70 70 GLY CA C 70 46.552 59.284 -12.732 1 1 830 . 7 1 1 A 70 70 GLY N N 70 108.643 117.728 -9.085 1 1 832 . 7 1 1 A 71 71 VAL HA H 71 3.538 4.846 -1.308 1 1 840 . 7 1 1 A 71 71 VAL CA C 71 65.623 62.855 2.768 1 1 841 . 7 1 1 A 71 71 VAL CB C 71 30.251 32.060 -1.809 1 1 844 . 7 1 1 A 71 71 VAL N N 71 110.808 136.655 -25.847 1 1 845 . 7 1 1 A 72 72 CYS H H 72 8.022 8.377 -0.355 1 1 846 . 7 1 1 A 72 72 CYS HA H 72 3.469 4.840 -1.371 1 1 849 . 7 1 1 A 72 72 CYS CA C 72 62.733 57.649 5.084 1 1 850 . 7 1 1 A 72 72 CYS CB C 72 27.163 64.267 -37.104 1 1 851 . 7 1 1 A 72 72 CYS N N 72 109.483 113.163 -3.680 1 1 852 . 7 1 1 A 73 73 SER H H 73 7.996 8.314 -0.318 1 1 853 . 7 1 1 A 73 73 SER HA H 73 4.439 4.107 0.332 1 1 856 . 7 1 1 A 73 73 SER CA C 73 62.145 59.294 2.851 1 1 857 . 7 1 1 A 73 73 SER CB C 73 66.013 29.274 36.739 1 1 858 . 7 1 1 A 73 73 SER N N 73 118.630 122.983 -4.353 1 1 859 . 7 1 1 A 74 74 LYS H H 74 10.186 7.968 2.218 1 1 860 . 7 1 1 A 74 74 LYS HA H 74 4.172 3.974 0.198 1 1 867 . 7 1 1 A 74 74 LYS CA C 74 59.848 58.389 1.459 1 1 868 . 7 1 1 A 74 74 LYS CB C 74 34.278 41.467 -7.189 1 1 870 . 7 1 1 A 74 74 LYS N N 74 123.341 117.686 5.655 1 1 871 . 7 1 1 A 75 75 ASP H H 75 7.542 8.228 -0.686 1 1 872 . 7 1 1 A 75 75 ASP HA H 75 3.538 3.945 -0.407 1 1 875 . 7 1 1 A 75 75 ASP CA C 75 52.472 59.954 -7.482 1 1 876 . 7 1 1 A 75 75 ASP CB C 75 42.360 29.325 13.035 1 1 877 . 7 1 1 A 75 75 ASP N N 75 112.035 119.603 -7.568 1 1 878 . 7 1 1 A 76 76 VAL H H 76 8.128 8.336 -0.208 1 1 879 . 7 1 1 A 76 76 VAL HA H 76 4.106 4.023 0.083 1 1 887 . 7 1 1 A 76 76 VAL CA C 76 65.179 59.133 6.046 1 1 888 . 7 1 1 A 76 76 VAL CB C 76 32.174 29.097 3.077 1 1 891 . 7 1 1 A 76 76 VAL N N 76 117.992 120.736 -2.744 1 1 892 . 7 1 1 A 77 77 TRP H H 77 6.869 7.957 -1.088 1 1 893 . 7 1 1 A 77 77 TRP HA H 77 4.509 4.100 0.409 1 1 899 . 7 1 1 A 77 77 TRP CA C 77 59.207 57.774 1.433 1 1 900 . 7 1 1 A 77 77 TRP CB C 77 28.941 41.448 -12.507 1 1 901 . 7 1 1 A 77 77 TRP N N 77 123.077 121.356 1.721 1 1 903 . 7 1 1 A 78 78 GLU H H 78 8.593 8.415 0.178 1 1 904 . 7 1 1 A 78 78 GLU HA H 78 4.318 3.890 0.428 1 1 909 . 7 1 1 A 78 78 GLU CA C 78 60.038 59.236 0.802 1 1 910 . 7 1 1 A 78 78 GLU CB C 78 31.178 28.327 2.851 1 1 912 . 7 1 1 A 78 78 GLU N N 78 121.505 117.629 3.876 1 1 913 . 7 1 1 A 79 79 PHE H H 79 8.071 8.167 -0.096 1 1 914 . 7 1 1 A 79 79 PHE HA H 79 4.986 4.064 0.922 1 1 919 . 7 1 1 A 79 79 PHE CA C 79 58.749 58.763 -0.014 1 1 920 . 7 1 1 A 79 79 PHE CB C 79 39.732 29.006 10.726 1 1 921 . 7 1 1 A 79 79 PHE N N 79 118.384 118.114 0.270 1 1 922 . 7 1 1 A 80 80 LEU H H 80 9.309 7.894 1.415 1 1 923 . 7 1 1 A 80 80 LEU HA H 80 3.970 4.444 -0.474 1 1 933 . 7 1 1 A 80 80 LEU CA C 80 59.307 56.453 2.854 1 1 934 . 7 1 1 A 80 80 LEU CB C 80 43.257 38.219 5.038 1 1 937 . 7 1 1 A 80 80 LEU N N 80 122.915 118.368 4.547 1 1 938 . 7 1 1 A 81 81 GLU H H 81 8.282 8.001 0.281 1 1 939 . 7 1 1 A 81 81 GLU HA H 81 3.832 3.602 0.230 1 1 944 . 7 1 1 A 81 81 GLU CA C 81 62.069 65.171 -3.102 1 1 945 . 7 1 1 A 81 81 GLU CB C 81 30.249 38.158 -7.909 1 1 947 . 7 1 1 A 81 81 GLU N N 81 119.345 120.352 -1.007 1 1 948 . 7 1 1 A 82 82 LEU H H 82 8.236 7.897 0.339 1 1 949 . 7 1 1 A 82 82 LEU HA H 82 4.187 4.386 -0.199 1 1 959 . 7 1 1 A 82 82 LEU CA C 82 58.348 58.875 -0.527 1 1 960 . 7 1 1 A 82 82 LEU CB C 82 42.827 31.909 10.918 1 1 963 . 7 1 1 A 82 82 LEU N N 82 120.013 119.386 0.627 1 1 964 . 7 1 1 A 83 83 GLN H H 83 7.949 8.145 -0.196 1 1 965 . 7 1 1 A 83 83 GLN HA H 83 3.812 3.950 -0.138 1 1 968 . 7 1 1 A 83 83 GLN CA C 83 60.248 57.961 2.287 1 1 969 . 7 1 1 A 83 83 GLN CB C 83 33.537 41.671 -8.134 1 1 970 . 7 1 1 A 83 83 GLN N N 83 116.443 120.912 -4.469 1 1 971 . 7 1 1 A 84 84 ILE H H 84 8.407 7.858 0.549 1 1 972 . 7 1 1 A 84 84 ILE HA H 84 3.644 4.263 -0.619 1 1 982 . 7 1 1 A 84 84 ILE CA C 84 67.288 58.913 8.375 1 1 983 . 7 1 1 A 84 84 ILE CB C 84 38.305 30.304 8.001 1 1 987 . 7 1 1 A 84 84 ILE N N 84 120.422 117.364 3.058 1 1 988 . 7 1 1 A 85 85 GLU H H 85 7.741 8.005 -0.264 1 1 989 . 7 1 1 A 85 85 GLU HA H 85 3.811 4.998 -1.187 1 1 994 . 7 1 1 A 85 85 GLU CA C 85 59.862 52.576 7.286 1 1 995 . 7 1 1 A 85 85 GLU CB C 85 30.360 45.420 -15.060 1 1 997 . 7 1 1 A 85 85 GLU N N 85 115.705 116.448 -0.743 1 1 998 . 7 1 1 A 86 86 GLU H H 86 7.818 8.623 -0.805 1 1 999 . 7 1 1 A 86 86 GLU HA H 86 4.274 4.704 -0.430 1 1 1004 . 7 1 1 A 86 86 GLU CA C 86 58.068 55.614 2.454 1 1 1005 . 7 1 1 A 86 86 GLU CB C 86 31.424 33.770 -2.346 1 1 1007 . 7 1 1 A 86 86 GLU N N 86 114.297 118.390 -4.093 1 1 1008 . 7 1 1 A 87 87 ILE H H 87 8.753 8.473 0.280 1 1 1019 . 7 1 1 A 87 87 ILE CA C 87 62.660 44.734 17.926 1 1 1024 . 7 1 1 A 87 87 ILE N N 87 118.890 109.416 9.474 1 1 1025 . 7 1 1 A 88 88 TYR H H 88 8.059 8.796 -0.737 1 1 1026 . 7 1 1 A 88 88 TYR HA H 88 5.447 4.151 1.296 1 1 1033 . 7 1 1 A 88 88 TYR CA C 88 55.285 58.479 -3.194 1 1 1034 . 7 1 1 A 88 88 TYR CB C 88 40.687 32.060 8.627 1 1 1035 . 7 1 1 A 88 88 TYR N N 88 119.252 124.891 -5.639 1 1 1036 . 7 1 1 A 89 89 PRO HA H 89 4.410 4.050 0.360 1 1 1043 . 7 1 1 A 89 89 PRO CA C 89 66.374 59.216 7.158 1 1 1044 . 7 1 1 A 89 89 PRO CB C 89 31.377 29.250 2.127 1 1 1047 . 7 1 1 A 90 90 GLU H H 90 9.234 8.168 1.066 1 1 1048 . 7 1 1 A 90 90 GLU HA H 90 4.379 4.005 0.374 1 1 1053 . 7 1 1 A 90 90 GLU CA C 90 59.098 58.709 0.389 1 1 1054 . 7 1 1 A 90 90 GLU CB C 90 29.461 28.158 1.303 1 1 1056 . 7 1 1 A 90 90 GLU N N 90 117.574 118.130 -0.556 1 1 1057 . 7 1 1 A 91 91 GLU H H 91 7.966 8.125 -0.159 1 1 1058 . 7 1 1 A 91 91 GLU HA H 91 4.890 4.030 0.860 1 1 1063 . 7 1 1 A 91 91 GLU CA C 91 55.324 59.044 -3.720 1 1 1064 . 7 1 1 A 91 91 GLU CB C 91 31.590 29.248 2.342 1 1 1066 . 7 1 1 A 91 91 GLU N N 91 119.310 119.551 -0.241 1 1 1067 . 7 1 1 A 92 92 GLU H H 92 7.263 7.804 -0.541 1 1 1068 . 7 1 1 A 92 92 GLU HA H 92 3.789 3.936 -0.147 1 1 1073 . 7 1 1 A 92 92 GLU CA C 92 60.628 57.947 2.681 1 1 1074 . 7 1 1 A 92 92 GLU CB C 92 30.531 41.648 -11.117 1 1 1076 . 7 1 1 A 92 92 GLU N N 92 121.332 120.572 0.760 1 1 1077 . 7 1 1 A 93 93 GLU H H 93 8.646 7.871 0.775 1 1 1078 . 7 1 1 A 93 93 GLU HA H 93 4.127 4.081 0.046 1 1 1083 . 7 1 1 A 93 93 GLU CA C 93 60.528 55.374 5.154 1 1 1084 . 7 1 1 A 93 93 GLU CB C 93 29.744 18.245 11.499 1 1 1086 . 7 1 1 A 93 93 GLU N N 93 118.207 121.099 -2.892 1 1 1087 . 7 1 1 A 94 94 ILE H H 94 7.766 8.326 -0.560 1 1 1088 . 7 1 1 A 94 94 ILE HA H 94 3.976 3.917 0.059 1 1 1098 . 7 1 1 A 94 94 ILE CA C 94 64.361 58.103 6.258 1 1 1099 . 7 1 1 A 94 94 ILE CB C 94 38.921 41.390 -2.469 1 1 1103 . 7 1 1 A 94 94 ILE N N 94 119.072 118.085 0.987 1 1 1104 . 7 1 1 A 95 95 LEU H H 95 8.340 8.092 0.248 1 1 1105 . 7 1 1 A 95 95 LEU HA H 95 4.300 4.103 0.197 1 1 1115 . 7 1 1 A 95 95 LEU CA C 95 57.905 59.499 -1.594 1 1 1116 . 7 1 1 A 95 95 LEU CB C 95 42.144 29.182 12.962 1 1 1119 . 7 1 1 A 95 95 LEU N N 95 121.325 117.946 3.379 1 1 1120 . 7 1 1 A 96 96 LYS H H 96 8.899 8.081 0.818 1 1 1121 . 7 1 1 A 96 96 LYS HA H 96 4.075 3.980 0.095 1 1 1126 . 7 1 1 A 96 96 LYS CA C 96 61.707 58.366 3.341 1 1 1127 . 7 1 1 A 96 96 LYS CB C 96 32.910 41.725 -8.815 1 1 1128 . 7 1 1 A 96 96 LYS N N 96 120.018 122.079 -2.061 1 1 1129 . 7 1 1 A 97 97 LYS H H 97 7.808 8.097 -0.289 1 1 1130 . 7 1 1 A 97 97 LYS HA H 97 4.045 4.222 -0.177 1 1 1139 . 7 1 1 A 97 97 LYS CA C 97 60.198 57.368 2.830 1 1 1140 . 7 1 1 A 97 97 LYS CB C 97 32.600 41.490 -8.890 1 1 1143 . 7 1 1 A 97 97 LYS N N 97 121.016 115.360 5.656 1 1 1144 . 7 1 1 A 98 98 ALA H H 98 7.814 8.156 -0.342 1 1 1145 . 7 1 1 A 98 98 ALA HA H 98 4.320 4.648 -0.328 1 1 1149 . 7 1 1 A 98 98 ALA CA C 98 55.260 54.490 0.770 1 1 1150 . 7 1 1 A 98 98 ALA CB C 98 19.468 39.466 -19.998 1 1 1151 . 7 1 1 A 98 98 ALA N N 98 122.102 117.195 4.907 1 1 1152 . 7 1 1 A 99 99 LEU H H 99 8.212 8.039 0.173 1 1 1153 . 7 1 1 A 99 99 LEU HA H 99 4.187 4.797 -0.610 1 1 1160 . 7 1 1 A 99 99 LEU CA C 99 58.398 56.798 1.600 1 1 1161 . 7 1 1 A 99 99 LEU CB C 99 42.720 37.669 5.051 1 1 1164 . 7 1 1 A 99 99 LEU N N 99 118.467 115.634 2.833 1 1 1165 . 7 1 1 A 100 100 ARG H H 100 7.738 7.326 0.412 1 1 1166 . 7 1 1 A 100 100 ARG HA H 100 3.894 5.014 -1.120 1 1 1173 . 7 1 1 A 100 100 ARG CA C 100 60.135 52.976 7.159 1 1 1174 . 7 1 1 A 100 100 ARG CB C 100 30.187 44.884 -14.697 1 1 1177 . 7 1 1 A 100 100 ARG N N 100 119.100 117.164 1.936 1 1 1178 . 7 1 1 A 101 101 ASP H H 101 8.186 8.175 0.011 1 1 1179 . 7 1 1 A 101 101 ASP HA H 101 4.424 4.834 -0.410 1 1 1182 . 7 1 1 A 101 101 ASP CA C 101 57.902 51.683 6.219 1 1 1183 . 7 1 1 A 101 101 ASP CB C 101 40.033 39.930 0.103 1 1 1184 . 7 1 1 A 101 101 ASP N N 101 121.899 117.886 4.013 1 1 1185 . 7 1 1 A 102 102 LEU H H 102 8.730 8.603 0.127 1 1 1186 . 7 1 1 A 102 102 LEU HA H 102 4.373 4.194 0.179 1 1 1195 . 7 1 1 A 102 102 LEU CA C 102 58.218 58.226 -0.008 1 1 1196 . 7 1 1 A 102 102 LEU CB C 102 42.839 29.180 13.659 1 1 1199 . 7 1 1 A 102 102 LEU N N 102 124.505 121.140 3.365 1 1 1200 . 7 1 1 A 103 103 LYS HA H 103 3.726 4.308 -0.582 1 1 1209 . 7 1 1 A 103 103 LYS CA C 103 59.760 56.116 3.644 1 1 1210 . 7 1 1 A 103 103 LYS CB C 103 32.822 32.914 -0.092 1 1 1214 . 7 1 1 A 104 104 ARG H H 104 7.409 7.943 -0.534 1 1 1222 . 7 1 1 A 104 104 ARG CA C 104 56.298 45.266 11.032 1 1 1226 . 7 1 1 A 104 104 ARG N N 104 115.912 105.856 10.056 1 1 1227 . 7 1 1 A 105 105 GLY H H 105 8.046 7.722 0.324 1 1 1230 . 7 1 1 A 105 105 GLY CA C 105 46.309 55.294 -8.985 1 1 1231 . 7 1 1 A 105 105 GLY N N 105 108.860 117.253 -8.393 1 1 1232 . 7 1 1 A 106 106 LYS H H 106 8.033 8.729 -0.696 1 1 1233 . 7 1 1 A 106 106 LYS HA H 106 4.394 4.148 0.246 1 1 1242 . 7 1 1 A 106 106 LYS CA C 106 55.822 55.704 0.118 1 1 1243 . 7 1 1 A 106 106 LYS CB C 106 33.449 42.115 -8.666 1 1 1246 . 7 1 1 A 106 106 LYS N N 106 121.082 122.991 -1.909 1 1 1247 . 7 1 1 A 107 107 LYS H H 107 8.271 8.809 -0.538 1 1 1248 . 7 1 1 A 107 107 LYS HA H 107 4.329 4.323 0.006 1 1 1255 . 7 1 1 A 107 107 LYS CA C 107 56.673 59.300 -2.627 1 1 1256 . 7 1 1 A 107 107 LYS CB C 107 33.341 63.785 -30.444 1 1 1258 . 7 1 1 A 107 107 LYS N N 107 121.869 119.560 2.309 1 1 1259 . 7 1 1 A 108 108 LEU H H 108 8.481 7.484 0.997 1 1 1260 . 7 1 1 A 108 108 LEU HA H 108 4.637 4.856 -0.219 1 1 1269 . 7 1 1 A 108 108 LEU CA C 108 53.819 54.494 -0.675 1 1 1270 . 7 1 1 A 108 108 LEU CB C 108 45.135 37.119 8.016 1 1 1272 . 7 1 1 A 108 108 LEU N N 108 124.360 119.109 5.251 1 1 1273 . 7 1 1 A 109 109 LYS H H 109 8.657 8.953 -0.296 1 1 1274 . 7 1 1 A 109 109 LYS HA H 109 4.565 4.581 -0.016 1 1 1283 . 7 1 1 A 109 109 LYS CA C 109 55.511 58.001 -2.490 1 1 1284 . 7 1 1 A 109 109 LYS CB C 109 32.029 64.708 -32.679 1 1 1287 . 7 1 1 A 109 109 LYS N N 109 123.165 116.859 6.306 1 1 1288 . 7 1 1 A 110 110 PRO HA H 110 4.232 3.616 0.616 1 1 1295 . 7 1 1 A 110 110 PRO CA C 110 66.732 66.431 0.301 1 1 1296 . 7 1 1 A 110 110 PRO CB C 110 32.481 31.489 0.992 1 1 1299 . 7 1 1 A 111 111 GLU HA H 111 4.221 3.922 0.299 1 1 1304 . 7 1 1 A 111 111 GLU CA C 111 59.819 59.831 -0.012 1 1 1305 . 7 1 1 A 111 111 GLU CB C 111 29.250 29.210 0.040 1 1 1307 . 7 1 1 A 112 112 ILE H H 112 7.233 8.219 -0.986 1 1 1308 . 7 1 1 A 112 112 ILE HA H 112 3.848 4.077 -0.229 1 1 1318 . 7 1 1 A 112 112 ILE CA C 112 62.635 59.159 3.476 1 1 1319 . 7 1 1 A 112 112 ILE CB C 112 37.159 29.132 8.027 1 1 1323 . 7 1 1 A 112 112 ILE N N 112 120.783 118.156 2.627 1 1 1324 . 7 1 1 A 113 113 LYS H H 113 8.268 7.762 0.506 1 1 1325 . 7 1 1 A 113 113 LYS HA H 113 3.849 3.631 0.218 1 1 1328 . 7 1 1 A 113 113 LYS CA C 113 60.248 65.088 -4.840 1 1 1329 . 7 1 1 A 113 113 LYS CB C 113 32.668 37.528 -4.860 1 1 1330 . 7 1 1 A 113 113 LYS N N 113 121.680 121.729 -0.049 1 1 1331 . 7 1 1 A 114 114 GLY H H 114 8.460 8.272 0.188 1 1 1334 . 7 1 1 A 114 114 GLY CA C 114 47.600 61.110 -13.510 1 1 1335 . 7 1 1 A 114 114 GLY N N 114 105.413 116.649 -11.236 1 1 1336 . 7 1 1 A 115 115 LYS H H 115 7.352 7.654 -0.302 1 1 1337 . 7 1 1 A 115 115 LYS HA H 115 4.189 4.463 -0.274 1 1 1346 . 7 1 1 A 115 115 LYS CA C 115 59.689 57.254 2.435 1 1 1347 . 7 1 1 A 115 115 LYS CB C 115 33.428 40.546 -7.118 1 1 1351 . 7 1 1 A 115 115 LYS N N 115 121.599 121.428 0.171 1 1 1352 . 7 1 1 A 116 116 LEU H H 116 8.046 8.063 -0.017 1 1 1353 . 7 1 1 A 116 116 LEU HA H 116 4.153 3.876 0.277 1 1 1363 . 7 1 1 A 116 116 LEU CA C 116 57.698 64.942 -7.244 1 1 1364 . 7 1 1 A 116 116 LEU CB C 116 42.070 31.603 10.467 1 1 1366 . 7 1 1 A 116 116 LEU N N 116 118.827 119.067 -0.240 1 1 1367 . 7 1 1 A 117 117 SER H H 117 8.321 7.506 0.815 1 1 1368 . 7 1 1 A 117 117 SER HA H 117 4.334 4.192 0.142 1 1 1371 . 7 1 1 A 117 117 SER CA C 117 61.467 54.184 7.283 1 1 1372 . 7 1 1 A 117 117 SER CB C 117 63.613 41.911 21.702 1 1 1373 . 7 1 1 A 117 117 SER N N 117 114.829 116.329 -1.500 1 1 1374 . 7 1 1 A 118 118 ARG H H 118 7.001 7.835 -0.834 1 1 1375 . 7 1 1 A 118 118 ARG HA H 118 4.403 3.880 0.523 1 1 1382 . 7 1 1 A 118 118 ARG CA C 118 56.734 56.956 -0.222 1 1 1383 . 7 1 1 A 118 118 ARG CB C 118 31.115 27.236 3.879 1 1 1385 . 7 1 1 A 118 118 ARG N N 118 118.114 114.179 3.935 1 1 1386 . 7 1 1 A 119 119 LEU H H 119 7.365 8.247 -0.882 1 1 1387 . 7 1 1 A 119 119 LEU HA H 119 4.253 4.885 -0.632 1 1 1397 . 7 1 1 A 119 119 LEU CA C 119 54.639 57.746 -3.107 1 1 1398 . 7 1 1 A 119 119 LEU CB C 119 41.700 31.235 10.465 1 1 1401 . 7 1 1 A 119 119 LEU N N 119 119.181 117.352 1.829 1 1 1402 . 7 1 1 A 120 120 ARG H H 120 8.766 8.724 0.042 1 1 1403 . 7 1 1 A 120 120 ARG HA H 120 4.374 4.520 -0.146 1 1 1410 . 7 1 1 A 120 120 ARG CA C 120 56.426 59.260 -2.834 1 1 1411 . 7 1 1 A 120 120 ARG CB C 120 32.414 63.884 -31.470 1 1 1414 . 7 1 1 A 120 120 ARG N N 120 122.099 120.316 1.783 1 1 1415 . 7 1 1 A 121 121 LEU H H 121 8.312 8.849 -0.537 1 1 1416 . 7 1 1 A 121 121 LEU HA H 121 4.407 3.699 0.708 1 1 1426 . 7 1 1 A 121 121 LEU CA C 121 56.028 65.717 -9.689 1 1 1427 . 7 1 1 A 121 121 LEU CB C 121 43.122 31.610 11.512 1 1 1430 . 7 1 1 A 121 121 LEU N N 121 118.761 123.390 -4.629 1 1 1431 . 7 1 1 A 122 122 PHE H H 122 7.143 8.432 -1.289 1 1 1432 . 7 1 1 A 122 122 PHE HA H 122 5.201 4.095 1.106 1 1 1439 . 7 1 1 A 122 122 PHE CA C 122 53.047 59.142 -6.095 1 1 1440 . 7 1 1 A 122 122 PHE CB C 122 40.844 29.448 11.396 1 1 1441 . 7 1 1 A 122 122 PHE N N 122 112.750 120.882 -8.132 1 1 1442 . 7 1 1 A 123 123 PRO HA H 123 3.908 3.993 -0.085 1 1 1449 . 7 1 1 A 123 123 PRO CA C 123 65.478 59.204 6.274 1 1 1450 . 7 1 1 A 123 123 PRO CB C 123 33.248 29.349 3.899 1 1 1452 . 7 1 1 A 124 124 LEU H H 124 7.208 8.079 -0.871 1 1 1453 . 7 1 1 A 124 124 LEU HA H 124 4.673 4.067 0.606 1 1 1463 . 7 1 1 A 124 124 LEU CA C 124 53.307 57.676 -4.369 1 1 1464 . 7 1 1 A 124 124 LEU CB C 124 42.853 41.825 1.028 1 1 1468 . 7 1 1 A 124 124 LEU N N 124 113.875 121.481 -7.606 1 1 1469 . 7 1 1 A 125 125 SER H H 125 8.990 8.201 0.789 1 1 1470 . 7 1 1 A 125 125 SER HA H 125 4.533 4.003 0.530 1 1 1473 . 7 1 1 A 125 125 SER CA C 125 59.198 59.656 -0.458 1 1 1474 . 7 1 1 A 125 125 SER CB C 125 64.578 29.464 35.114 1 1 1475 . 7 1 1 A 125 125 SER N N 125 117.894 119.941 -2.047 1 1 1476 . 7 1 1 A 126 126 SER H H 126 8.618 7.905 0.713 1 1 1477 . 7 1 1 A 126 126 SER HA H 126 4.614 3.993 0.621 1 1 1480 . 7 1 1 A 126 126 SER CA C 126 58.730 59.622 -0.892 1 1 1481 . 7 1 1 A 126 126 SER CB C 126 64.367 32.345 32.022 1 1 1482 . 7 1 1 A 126 126 SER N N 126 118.602 119.124 -0.522 1 1 1483 . 7 1 1 A 127 127 SER HA H 127 4.530 3.760 0.770 1 1 1486 . 7 1 1 A 127 127 SER CA C 127 58.954 65.859 -6.905 1 1 1487 . 7 1 1 A 127 127 SER CB C 127 64.379 31.477 32.902 1 1 1488 . 7 1 1 A 128 128 ALA H H 128 8.345 8.186 0.159 1 1 1489 . 7 1 1 A 128 128 ALA HA H 128 4.432 3.936 0.496 1 1 1493 . 7 1 1 A 128 128 ALA CA C 128 52.963 59.455 -6.492 1 1 1494 . 7 1 1 A 128 128 ALA CB C 128 19.924 29.554 -9.630 1 1 1495 . 7 1 1 A 128 128 ALA N N 128 126.185 121.928 4.257 1 1 1496 . 7 1 1 A 129 129 GLU H H 129 8.329 7.888 0.441 1 1 1497 . 7 1 1 A 129 129 GLU HA H 129 4.353 4.084 0.269 1 1 1502 . 7 1 1 A 129 129 GLU CA C 129 57.111 58.682 -1.571 1 1 1503 . 7 1 1 A 129 129 GLU CB C 129 30.949 28.522 2.427 1 1 1504 . 7 1 1 A 129 129 GLU N N 129 120.842 118.501 2.341 1 1 1505 . 7 1 1 A 130 130 LYS H H 130 7.947 7.964 -0.017 1 1 1506 . 7 1 1 A 130 130 LYS HA H 130 3.835 4.042 -0.207 1 1 1515 . 7 1 1 A 130 130 LYS CA C 130 57.756 59.721 -1.965 1 1 1516 . 7 1 1 A 130 130 LYS CB C 130 33.156 32.081 1.075 1 1 826 . 8 1 1 A 70 70 GLY H H 70 9.295 8.149 1.146 1 1 829 . 8 1 1 A 70 70 GLY CA C 70 46.552 58.148 -11.596 1 1 830 . 8 1 1 A 70 70 GLY N N 70 108.643 115.051 -6.408 1 1 832 . 8 1 1 A 71 71 VAL HA H 71 3.538 4.895 -1.357 1 1 840 . 8 1 1 A 71 71 VAL CA C 71 65.623 62.753 2.870 1 1 841 . 8 1 1 A 71 71 VAL CB C 71 30.251 32.281 -2.030 1 1 844 . 8 1 1 A 71 71 VAL N N 71 110.808 136.537 -25.729 1 1 845 . 8 1 1 A 72 72 CYS H H 72 8.022 8.310 -0.288 1 1 846 . 8 1 1 A 72 72 CYS HA H 72 3.469 4.525 -1.056 1 1 849 . 8 1 1 A 72 72 CYS CA C 72 62.733 58.335 4.398 1 1 850 . 8 1 1 A 72 72 CYS CB C 72 27.163 64.464 -37.301 1 1 851 . 8 1 1 A 72 72 CYS N N 72 109.483 115.393 -5.910 1 1 852 . 8 1 1 A 73 73 SER H H 73 7.996 8.470 -0.474 1 1 853 . 8 1 1 A 73 73 SER HA H 73 4.439 4.128 0.311 1 1 856 . 8 1 1 A 73 73 SER CA C 73 62.145 59.220 2.925 1 1 857 . 8 1 1 A 73 73 SER CB C 73 66.013 29.450 36.563 1 1 858 . 8 1 1 A 73 73 SER N N 73 118.630 122.680 -4.050 1 1 859 . 8 1 1 A 74 74 LYS H H 74 10.186 7.989 2.197 1 1 860 . 8 1 1 A 74 74 LYS HA H 74 4.172 3.996 0.176 1 1 867 . 8 1 1 A 74 74 LYS CA C 74 59.848 58.403 1.445 1 1 868 . 8 1 1 A 74 74 LYS CB C 74 34.278 41.480 -7.202 1 1 870 . 8 1 1 A 74 74 LYS N N 74 123.341 117.710 5.631 1 1 871 . 8 1 1 A 75 75 ASP H H 75 7.542 8.242 -0.700 1 1 872 . 8 1 1 A 75 75 ASP HA H 75 3.538 3.943 -0.405 1 1 875 . 8 1 1 A 75 75 ASP CA C 75 52.472 59.901 -7.429 1 1 876 . 8 1 1 A 75 75 ASP CB C 75 42.360 29.233 13.127 1 1 877 . 8 1 1 A 75 75 ASP N N 75 112.035 119.600 -7.565 1 1 878 . 8 1 1 A 76 76 VAL H H 76 8.128 8.412 -0.284 1 1 879 . 8 1 1 A 76 76 VAL HA H 76 4.106 4.032 0.074 1 1 887 . 8 1 1 A 76 76 VAL CA C 76 65.179 59.178 6.001 1 1 888 . 8 1 1 A 76 76 VAL CB C 76 32.174 29.042 3.132 1 1 891 . 8 1 1 A 76 76 VAL N N 76 117.992 120.636 -2.644 1 1 892 . 8 1 1 A 77 77 TRP H H 77 6.869 8.019 -1.150 1 1 893 . 8 1 1 A 77 77 TRP HA H 77 4.509 4.106 0.403 1 1 899 . 8 1 1 A 77 77 TRP CA C 77 59.207 57.779 1.428 1 1 900 . 8 1 1 A 77 77 TRP CB C 77 28.941 41.444 -12.503 1 1 901 . 8 1 1 A 77 77 TRP N N 77 123.077 121.612 1.465 1 1 903 . 8 1 1 A 78 78 GLU H H 78 8.593 8.343 0.250 1 1 904 . 8 1 1 A 78 78 GLU HA H 78 4.318 3.898 0.420 1 1 909 . 8 1 1 A 78 78 GLU CA C 78 60.038 59.066 0.972 1 1 910 . 8 1 1 A 78 78 GLU CB C 78 31.178 28.363 2.815 1 1 912 . 8 1 1 A 78 78 GLU N N 78 121.505 117.885 3.620 1 1 913 . 8 1 1 A 79 79 PHE H H 79 8.071 8.109 -0.038 1 1 914 . 8 1 1 A 79 79 PHE HA H 79 4.986 4.077 0.909 1 1 919 . 8 1 1 A 79 79 PHE CA C 79 58.749 58.741 0.008 1 1 920 . 8 1 1 A 79 79 PHE CB C 79 39.732 28.950 10.782 1 1 921 . 8 1 1 A 79 79 PHE N N 79 118.384 118.140 0.244 1 1 922 . 8 1 1 A 80 80 LEU H H 80 9.309 7.904 1.405 1 1 923 . 8 1 1 A 80 80 LEU HA H 80 3.970 4.446 -0.476 1 1 933 . 8 1 1 A 80 80 LEU CA C 80 59.307 56.453 2.854 1 1 934 . 8 1 1 A 80 80 LEU CB C 80 43.257 38.227 5.030 1 1 937 . 8 1 1 A 80 80 LEU N N 80 122.915 118.365 4.550 1 1 938 . 8 1 1 A 81 81 GLU H H 81 8.282 7.934 0.348 1 1 939 . 8 1 1 A 81 81 GLU HA H 81 3.832 3.596 0.236 1 1 944 . 8 1 1 A 81 81 GLU CA C 81 62.069 65.141 -3.072 1 1 945 . 8 1 1 A 81 81 GLU CB C 81 30.249 38.216 -7.967 1 1 947 . 8 1 1 A 81 81 GLU N N 81 119.345 120.345 -1.000 1 1 948 . 8 1 1 A 82 82 LEU H H 82 8.236 7.936 0.300 1 1 949 . 8 1 1 A 82 82 LEU HA H 82 4.187 4.465 -0.278 1 1 959 . 8 1 1 A 82 82 LEU CA C 82 58.348 58.585 -0.237 1 1 960 . 8 1 1 A 82 82 LEU CB C 82 42.827 32.123 10.704 1 1 963 . 8 1 1 A 82 82 LEU N N 82 120.013 119.409 0.604 1 1 964 . 8 1 1 A 83 83 GLN H H 83 7.949 8.079 -0.130 1 1 965 . 8 1 1 A 83 83 GLN HA H 83 3.812 3.859 -0.047 1 1 968 . 8 1 1 A 83 83 GLN CA C 83 60.248 58.052 2.196 1 1 969 . 8 1 1 A 83 83 GLN CB C 83 33.537 41.446 -7.909 1 1 970 . 8 1 1 A 83 83 GLN N N 83 116.443 120.775 -4.332 1 1 971 . 8 1 1 A 84 84 ILE H H 84 8.407 8.518 -0.111 1 1 972 . 8 1 1 A 84 84 ILE HA H 84 3.644 4.108 -0.464 1 1 982 . 8 1 1 A 84 84 ILE CA C 84 67.288 58.999 8.289 1 1 983 . 8 1 1 A 84 84 ILE CB C 84 38.305 29.212 9.093 1 1 987 . 8 1 1 A 84 84 ILE N N 84 120.422 117.651 2.771 1 1 988 . 8 1 1 A 85 85 GLU H H 85 7.741 8.068 -0.327 1 1 989 . 8 1 1 A 85 85 GLU HA H 85 3.811 5.026 -1.215 1 1 994 . 8 1 1 A 85 85 GLU CA C 85 59.862 52.541 7.321 1 1 995 . 8 1 1 A 85 85 GLU CB C 85 30.360 46.330 -15.970 1 1 997 . 8 1 1 A 85 85 GLU N N 85 115.705 117.188 -1.483 1 1 998 . 8 1 1 A 86 86 GLU H H 86 7.818 8.717 -0.899 1 1 999 . 8 1 1 A 86 86 GLU HA H 86 4.274 4.691 -0.417 1 1 1004 . 8 1 1 A 86 86 GLU CA C 86 58.068 55.918 2.150 1 1 1005 . 8 1 1 A 86 86 GLU CB C 86 31.424 33.152 -1.728 1 1 1007 . 8 1 1 A 86 86 GLU N N 86 114.297 118.672 -4.375 1 1 1008 . 8 1 1 A 87 87 ILE H H 87 8.753 8.426 0.327 1 1 1019 . 8 1 1 A 87 87 ILE CA C 87 62.660 44.572 18.088 1 1 1024 . 8 1 1 A 87 87 ILE N N 87 118.890 110.492 8.398 1 1 1025 . 8 1 1 A 88 88 TYR H H 88 8.059 8.737 -0.678 1 1 1026 . 8 1 1 A 88 88 TYR HA H 88 5.447 4.183 1.264 1 1 1033 . 8 1 1 A 88 88 TYR CA C 88 55.285 58.750 -3.465 1 1 1034 . 8 1 1 A 88 88 TYR CB C 88 40.687 32.261 8.426 1 1 1035 . 8 1 1 A 88 88 TYR N N 88 119.252 125.110 -5.858 1 1 1036 . 8 1 1 A 89 89 PRO HA H 89 4.410 4.025 0.385 1 1 1043 . 8 1 1 A 89 89 PRO CA C 89 66.374 59.287 7.087 1 1 1044 . 8 1 1 A 89 89 PRO CB C 89 31.377 29.163 2.214 1 1 1047 . 8 1 1 A 90 90 GLU H H 90 9.234 8.222 1.012 1 1 1048 . 8 1 1 A 90 90 GLU HA H 90 4.379 4.008 0.371 1 1 1053 . 8 1 1 A 90 90 GLU CA C 90 59.098 58.738 0.360 1 1 1054 . 8 1 1 A 90 90 GLU CB C 90 29.461 28.388 1.073 1 1 1056 . 8 1 1 A 90 90 GLU N N 90 117.574 118.138 -0.564 1 1 1057 . 8 1 1 A 91 91 GLU H H 91 7.966 8.118 -0.152 1 1 1058 . 8 1 1 A 91 91 GLU HA H 91 4.890 4.024 0.866 1 1 1063 . 8 1 1 A 91 91 GLU CA C 91 55.324 59.067 -3.743 1 1 1064 . 8 1 1 A 91 91 GLU CB C 91 31.590 29.258 2.332 1 1 1066 . 8 1 1 A 91 91 GLU N N 91 119.310 119.580 -0.270 1 1 1067 . 8 1 1 A 92 92 GLU H H 92 7.263 7.950 -0.687 1 1 1068 . 8 1 1 A 92 92 GLU HA H 92 3.789 3.976 -0.187 1 1 1073 . 8 1 1 A 92 92 GLU CA C 92 60.628 57.905 2.723 1 1 1074 . 8 1 1 A 92 92 GLU CB C 92 30.531 41.596 -11.065 1 1 1076 . 8 1 1 A 92 92 GLU N N 92 121.332 120.390 0.942 1 1 1077 . 8 1 1 A 93 93 GLU H H 93 8.646 7.919 0.727 1 1 1078 . 8 1 1 A 93 93 GLU HA H 93 4.127 4.092 0.035 1 1 1083 . 8 1 1 A 93 93 GLU CA C 93 60.528 55.358 5.170 1 1 1084 . 8 1 1 A 93 93 GLU CB C 93 29.744 18.337 11.407 1 1 1086 . 8 1 1 A 93 93 GLU N N 93 118.207 121.506 -3.299 1 1 1087 . 8 1 1 A 94 94 ILE H H 94 7.766 8.308 -0.542 1 1 1088 . 8 1 1 A 94 94 ILE HA H 94 3.976 3.907 0.069 1 1 1098 . 8 1 1 A 94 94 ILE CA C 94 64.361 58.153 6.208 1 1 1099 . 8 1 1 A 94 94 ILE CB C 94 38.921 41.404 -2.483 1 1 1103 . 8 1 1 A 94 94 ILE N N 94 119.072 118.148 0.924 1 1 1104 . 8 1 1 A 95 95 LEU H H 95 8.340 8.069 0.271 1 1 1105 . 8 1 1 A 95 95 LEU HA H 95 4.300 4.129 0.171 1 1 1115 . 8 1 1 A 95 95 LEU CA C 95 57.905 59.496 -1.591 1 1 1116 . 8 1 1 A 95 95 LEU CB C 95 42.144 29.218 12.926 1 1 1119 . 8 1 1 A 95 95 LEU N N 95 121.325 117.651 3.674 1 1 1120 . 8 1 1 A 96 96 LYS H H 96 8.899 7.999 0.900 1 1 1121 . 8 1 1 A 96 96 LYS HA H 96 4.075 4.034 0.041 1 1 1126 . 8 1 1 A 96 96 LYS CA C 96 61.707 57.819 3.888 1 1 1127 . 8 1 1 A 96 96 LYS CB C 96 32.910 41.728 -8.818 1 1 1128 . 8 1 1 A 96 96 LYS N N 96 120.018 122.239 -2.221 1 1 1129 . 8 1 1 A 97 97 LYS H H 97 7.808 8.009 -0.201 1 1 1130 . 8 1 1 A 97 97 LYS HA H 97 4.045 4.294 -0.249 1 1 1139 . 8 1 1 A 97 97 LYS CA C 97 60.198 56.006 4.192 1 1 1140 . 8 1 1 A 97 97 LYS CB C 97 32.600 41.268 -8.668 1 1 1143 . 8 1 1 A 97 97 LYS N N 97 121.016 115.831 5.185 1 1 1144 . 8 1 1 A 98 98 ALA H H 98 7.814 8.289 -0.475 1 1 1145 . 8 1 1 A 98 98 ALA HA H 98 4.320 4.729 -0.409 1 1 1149 . 8 1 1 A 98 98 ALA CA C 98 55.260 54.471 0.789 1 1 1150 . 8 1 1 A 98 98 ALA CB C 98 19.468 39.574 -20.106 1 1 1151 . 8 1 1 A 98 98 ALA N N 98 122.102 116.554 5.548 1 1 1152 . 8 1 1 A 99 99 LEU H H 99 8.212 7.797 0.415 1 1 1153 . 8 1 1 A 99 99 LEU HA H 99 4.187 4.743 -0.556 1 1 1160 . 8 1 1 A 99 99 LEU CA C 99 58.398 56.521 1.877 1 1 1161 . 8 1 1 A 99 99 LEU CB C 99 42.720 36.683 6.037 1 1 1164 . 8 1 1 A 99 99 LEU N N 99 118.467 115.633 2.834 1 1 1165 . 8 1 1 A 100 100 ARG H H 100 7.738 7.541 0.197 1 1 1166 . 8 1 1 A 100 100 ARG HA H 100 3.894 5.257 -1.363 1 1 1173 . 8 1 1 A 100 100 ARG CA C 100 60.135 52.833 7.302 1 1 1174 . 8 1 1 A 100 100 ARG CB C 100 30.187 45.709 -15.522 1 1 1177 . 8 1 1 A 100 100 ARG N N 100 119.100 117.852 1.248 1 1 1178 . 8 1 1 A 101 101 ASP H H 101 8.186 8.144 0.042 1 1 1179 . 8 1 1 A 101 101 ASP HA H 101 4.424 4.954 -0.530 1 1 1182 . 8 1 1 A 101 101 ASP CA C 101 57.902 52.041 5.861 1 1 1183 . 8 1 1 A 101 101 ASP CB C 101 40.033 39.687 0.346 1 1 1184 . 8 1 1 A 101 101 ASP N N 101 121.899 117.269 4.630 1 1 1185 . 8 1 1 A 102 102 LEU H H 102 8.730 8.952 -0.222 1 1 1186 . 8 1 1 A 102 102 LEU HA H 102 4.373 4.066 0.307 1 1 1195 . 8 1 1 A 102 102 LEU CA C 102 58.218 58.240 -0.022 1 1 1196 . 8 1 1 A 102 102 LEU CB C 102 42.839 28.597 14.242 1 1 1199 . 8 1 1 A 102 102 LEU N N 102 124.505 120.638 3.867 1 1 1200 . 8 1 1 A 103 103 LYS HA H 103 3.726 4.345 -0.619 1 1 1209 . 8 1 1 A 103 103 LYS CA C 103 59.760 56.143 3.617 1 1 1210 . 8 1 1 A 103 103 LYS CB C 103 32.822 32.962 -0.140 1 1 1214 . 8 1 1 A 104 104 ARG H H 104 7.409 7.811 -0.402 1 1 1222 . 8 1 1 A 104 104 ARG CA C 104 56.298 45.160 11.138 1 1 1226 . 8 1 1 A 104 104 ARG N N 104 115.912 105.812 10.100 1 1 1227 . 8 1 1 A 105 105 GLY H H 105 8.046 7.869 0.177 1 1 1230 . 8 1 1 A 105 105 GLY CA C 105 46.309 55.505 -9.196 1 1 1231 . 8 1 1 A 105 105 GLY N N 105 108.860 117.999 -9.139 1 1 1232 . 8 1 1 A 106 106 LYS H H 106 8.033 8.389 -0.356 1 1 1233 . 8 1 1 A 106 106 LYS HA H 106 4.394 4.239 0.155 1 1 1242 . 8 1 1 A 106 106 LYS CA C 106 55.822 55.202 0.620 1 1 1243 . 8 1 1 A 106 106 LYS CB C 106 33.449 42.571 -9.122 1 1 1246 . 8 1 1 A 106 106 LYS N N 106 121.082 118.041 3.041 1 1 1247 . 8 1 1 A 107 107 LYS H H 107 8.271 8.653 -0.382 1 1 1248 . 8 1 1 A 107 107 LYS HA H 107 4.329 4.501 -0.172 1 1 1255 . 8 1 1 A 107 107 LYS CA C 107 56.673 59.134 -2.461 1 1 1256 . 8 1 1 A 107 107 LYS CB C 107 33.341 64.165 -30.824 1 1 1258 . 8 1 1 A 107 107 LYS N N 107 121.869 114.448 7.421 1 1 1259 . 8 1 1 A 108 108 LEU H H 108 8.481 7.484 0.997 1 1 1260 . 8 1 1 A 108 108 LEU HA H 108 4.637 4.920 -0.283 1 1 1269 . 8 1 1 A 108 108 LEU CA C 108 53.819 54.569 -0.750 1 1 1270 . 8 1 1 A 108 108 LEU CB C 108 45.135 36.321 8.814 1 1 1272 . 8 1 1 A 108 108 LEU N N 108 124.360 119.226 5.134 1 1 1273 . 8 1 1 A 109 109 LYS H H 109 8.657 8.969 -0.312 1 1 1274 . 8 1 1 A 109 109 LYS HA H 109 4.565 4.574 -0.009 1 1 1283 . 8 1 1 A 109 109 LYS CA C 109 55.511 58.610 -3.099 1 1 1284 . 8 1 1 A 109 109 LYS CB C 109 32.029 64.116 -32.087 1 1 1287 . 8 1 1 A 109 109 LYS N N 109 123.165 118.152 5.013 1 1 1288 . 8 1 1 A 110 110 PRO HA H 110 4.232 3.608 0.624 1 1 1295 . 8 1 1 A 110 110 PRO CA C 110 66.732 66.533 0.199 1 1 1296 . 8 1 1 A 110 110 PRO CB C 110 32.481 31.469 1.012 1 1 1299 . 8 1 1 A 111 111 GLU HA H 111 4.221 3.919 0.302 1 1 1304 . 8 1 1 A 111 111 GLU CA C 111 59.819 59.832 -0.013 1 1 1305 . 8 1 1 A 111 111 GLU CB C 111 29.250 29.161 0.089 1 1 1307 . 8 1 1 A 112 112 ILE H H 112 7.233 8.173 -0.940 1 1 1308 . 8 1 1 A 112 112 ILE HA H 112 3.848 4.081 -0.233 1 1 1318 . 8 1 1 A 112 112 ILE CA C 112 62.635 59.204 3.431 1 1 1319 . 8 1 1 A 112 112 ILE CB C 112 37.159 29.296 7.863 1 1 1323 . 8 1 1 A 112 112 ILE N N 112 120.783 118.189 2.594 1 1 1324 . 8 1 1 A 113 113 LYS H H 113 8.268 8.001 0.267 1 1 1325 . 8 1 1 A 113 113 LYS HA H 113 3.849 3.691 0.158 1 1 1328 . 8 1 1 A 113 113 LYS CA C 113 60.248 65.240 -4.992 1 1 1329 . 8 1 1 A 113 113 LYS CB C 113 32.668 37.463 -4.795 1 1 1330 . 8 1 1 A 113 113 LYS N N 113 121.680 121.674 0.006 1 1 1331 . 8 1 1 A 114 114 GLY H H 114 8.460 8.394 0.066 1 1 1334 . 8 1 1 A 114 114 GLY CA C 114 47.600 61.274 -13.674 1 1 1335 . 8 1 1 A 114 114 GLY N N 114 105.413 116.754 -11.341 1 1 1336 . 8 1 1 A 115 115 LYS H H 115 7.352 7.563 -0.211 1 1 1337 . 8 1 1 A 115 115 LYS HA H 115 4.189 4.504 -0.315 1 1 1346 . 8 1 1 A 115 115 LYS CA C 115 59.689 57.127 2.562 1 1 1347 . 8 1 1 A 115 115 LYS CB C 115 33.428 41.052 -7.624 1 1 1351 . 8 1 1 A 115 115 LYS N N 115 121.599 122.238 -0.639 1 1 1352 . 8 1 1 A 116 116 LEU H H 116 8.046 7.925 0.121 1 1 1353 . 8 1 1 A 116 116 LEU HA H 116 4.153 3.772 0.381 1 1 1363 . 8 1 1 A 116 116 LEU CA C 116 57.698 65.378 -7.680 1 1 1364 . 8 1 1 A 116 116 LEU CB C 116 42.070 31.451 10.619 1 1 1366 . 8 1 1 A 116 116 LEU N N 116 118.827 115.812 3.015 1 1 1367 . 8 1 1 A 117 117 SER H H 117 8.321 7.530 0.791 1 1 1368 . 8 1 1 A 117 117 SER HA H 117 4.334 4.197 0.137 1 1 1371 . 8 1 1 A 117 117 SER CA C 117 61.467 54.308 7.159 1 1 1372 . 8 1 1 A 117 117 SER CB C 117 63.613 41.913 21.700 1 1 1373 . 8 1 1 A 117 117 SER N N 117 114.829 118.692 -3.863 1 1 1374 . 8 1 1 A 118 118 ARG H H 118 7.001 7.833 -0.832 1 1 1375 . 8 1 1 A 118 118 ARG HA H 118 4.403 3.879 0.524 1 1 1382 . 8 1 1 A 118 118 ARG CA C 118 56.734 56.956 -0.222 1 1 1383 . 8 1 1 A 118 118 ARG CB C 118 31.115 27.233 3.882 1 1 1385 . 8 1 1 A 118 118 ARG N N 118 118.114 114.193 3.921 1 1 1386 . 8 1 1 A 119 119 LEU H H 119 7.365 8.297 -0.932 1 1 1387 . 8 1 1 A 119 119 LEU HA H 119 4.253 4.893 -0.640 1 1 1397 . 8 1 1 A 119 119 LEU CA C 119 54.639 57.736 -3.097 1 1 1398 . 8 1 1 A 119 119 LEU CB C 119 41.700 31.181 10.519 1 1 1401 . 8 1 1 A 119 119 LEU N N 119 119.181 117.355 1.826 1 1 1402 . 8 1 1 A 120 120 ARG H H 120 8.766 8.697 0.069 1 1 1403 . 8 1 1 A 120 120 ARG HA H 120 4.374 4.454 -0.080 1 1 1410 . 8 1 1 A 120 120 ARG CA C 120 56.426 59.305 -2.879 1 1 1411 . 8 1 1 A 120 120 ARG CB C 120 32.414 63.730 -31.316 1 1 1414 . 8 1 1 A 120 120 ARG N N 120 122.099 120.493 1.606 1 1 1415 . 8 1 1 A 121 121 LEU H H 121 8.312 8.726 -0.414 1 1 1416 . 8 1 1 A 121 121 LEU HA H 121 4.407 3.557 0.850 1 1 1426 . 8 1 1 A 121 121 LEU CA C 121 56.028 67.029 -11.001 1 1 1427 . 8 1 1 A 121 121 LEU CB C 121 43.122 31.983 11.139 1 1 1430 . 8 1 1 A 121 121 LEU N N 121 118.761 124.064 -5.303 1 1 1431 . 8 1 1 A 122 122 PHE H H 122 7.143 8.193 -1.050 1 1 1432 . 8 1 1 A 122 122 PHE HA H 122 5.201 4.111 1.090 1 1 1439 . 8 1 1 A 122 122 PHE CA C 122 53.047 59.103 -6.056 1 1 1440 . 8 1 1 A 122 122 PHE CB C 122 40.844 29.461 11.383 1 1 1441 . 8 1 1 A 122 122 PHE N N 122 112.750 119.826 -7.076 1 1 1442 . 8 1 1 A 123 123 PRO HA H 123 3.908 3.967 -0.059 1 1 1449 . 8 1 1 A 123 123 PRO CA C 123 65.478 59.225 6.253 1 1 1450 . 8 1 1 A 123 123 PRO CB C 123 33.248 29.302 3.946 1 1 1452 . 8 1 1 A 124 124 LEU H H 124 7.208 7.820 -0.612 1 1 1453 . 8 1 1 A 124 124 LEU HA H 124 4.673 4.055 0.618 1 1 1463 . 8 1 1 A 124 124 LEU CA C 124 53.307 57.672 -4.365 1 1 1464 . 8 1 1 A 124 124 LEU CB C 124 42.853 41.920 0.933 1 1 1468 . 8 1 1 A 124 124 LEU N N 124 113.875 121.162 -7.287 1 1 1469 . 8 1 1 A 125 125 SER H H 125 8.990 7.987 1.003 1 1 1470 . 8 1 1 A 125 125 SER HA H 125 4.533 3.974 0.559 1 1 1473 . 8 1 1 A 125 125 SER CA C 125 59.198 59.540 -0.342 1 1 1474 . 8 1 1 A 125 125 SER CB C 125 64.578 29.251 35.327 1 1 1475 . 8 1 1 A 125 125 SER N N 125 117.894 120.044 -2.150 1 1 1476 . 8 1 1 A 126 126 SER H H 126 8.618 7.760 0.858 1 1 1477 . 8 1 1 A 126 126 SER HA H 126 4.614 3.983 0.631 1 1 1480 . 8 1 1 A 126 126 SER CA C 126 58.730 60.333 -1.603 1 1 1481 . 8 1 1 A 126 126 SER CB C 126 64.367 32.381 31.986 1 1 1482 . 8 1 1 A 126 126 SER N N 126 118.602 119.098 -0.496 1 1 1483 . 8 1 1 A 127 127 SER HA H 127 4.530 3.779 0.751 1 1 1486 . 8 1 1 A 127 127 SER CA C 127 58.954 65.696 -6.742 1 1 1487 . 8 1 1 A 127 127 SER CB C 127 64.379 31.483 32.896 1 1 1488 . 8 1 1 A 128 128 ALA H H 128 8.345 8.286 0.059 1 1 1489 . 8 1 1 A 128 128 ALA HA H 128 4.432 3.940 0.492 1 1 1493 . 8 1 1 A 128 128 ALA CA C 128 52.963 59.307 -6.344 1 1 1494 . 8 1 1 A 128 128 ALA CB C 128 19.924 29.738 -9.814 1 1 1495 . 8 1 1 A 128 128 ALA N N 128 126.185 122.081 4.104 1 1 1496 . 8 1 1 A 129 129 GLU H H 129 8.329 7.967 0.362 1 1 1497 . 8 1 1 A 129 129 GLU HA H 129 4.353 4.070 0.283 1 1 1502 . 8 1 1 A 129 129 GLU CA C 129 57.111 58.609 -1.498 1 1 1503 . 8 1 1 A 129 129 GLU CB C 129 30.949 28.530 2.419 1 1 1504 . 8 1 1 A 129 129 GLU N N 129 120.842 118.608 2.234 1 1 1505 . 8 1 1 A 130 130 LYS H H 130 7.947 7.995 -0.048 1 1 1506 . 8 1 1 A 130 130 LYS HA H 130 3.835 4.036 -0.201 1 1 1515 . 8 1 1 A 130 130 LYS CA C 130 57.756 59.682 -1.926 1 1 1516 . 8 1 1 A 130 130 LYS CB C 130 33.156 32.121 1.035 1 1 826 . 9 1 1 A 70 70 GLY H H 70 9.295 8.263 1.032 1 1 829 . 9 1 1 A 70 70 GLY CA C 70 46.552 58.532 -11.980 1 1 830 . 9 1 1 A 70 70 GLY N N 70 108.643 118.303 -9.660 1 1 832 . 9 1 1 A 71 71 VAL HA H 71 3.538 4.772 -1.234 1 1 840 . 9 1 1 A 71 71 VAL CA C 71 65.623 62.662 2.961 1 1 841 . 9 1 1 A 71 71 VAL CB C 71 30.251 32.119 -1.868 1 1 844 . 9 1 1 A 71 71 VAL N N 71 110.808 136.208 -25.400 1 1 845 . 9 1 1 A 72 72 CYS H H 72 8.022 8.208 -0.186 1 1 846 . 9 1 1 A 72 72 CYS HA H 72 3.469 4.796 -1.327 1 1 849 . 9 1 1 A 72 72 CYS CA C 72 62.733 57.751 4.982 1 1 850 . 9 1 1 A 72 72 CYS CB C 72 27.163 63.061 -35.898 1 1 851 . 9 1 1 A 72 72 CYS N N 72 109.483 114.474 -4.991 1 1 852 . 9 1 1 A 73 73 SER H H 73 7.996 8.171 -0.175 1 1 853 . 9 1 1 A 73 73 SER HA H 73 4.439 4.026 0.413 1 1 856 . 9 1 1 A 73 73 SER CA C 73 62.145 59.316 2.829 1 1 857 . 9 1 1 A 73 73 SER CB C 73 66.013 29.330 36.683 1 1 858 . 9 1 1 A 73 73 SER N N 73 118.630 123.384 -4.754 1 1 859 . 9 1 1 A 74 74 LYS H H 74 10.186 7.934 2.252 1 1 860 . 9 1 1 A 74 74 LYS HA H 74 4.172 3.995 0.177 1 1 867 . 9 1 1 A 74 74 LYS CA C 74 59.848 58.401 1.447 1 1 868 . 9 1 1 A 74 74 LYS CB C 74 34.278 41.471 -7.193 1 1 870 . 9 1 1 A 74 74 LYS N N 74 123.341 119.779 3.562 1 1 871 . 9 1 1 A 75 75 ASP H H 75 7.542 8.237 -0.695 1 1 872 . 9 1 1 A 75 75 ASP HA H 75 3.538 3.942 -0.404 1 1 875 . 9 1 1 A 75 75 ASP CA C 75 52.472 59.879 -7.407 1 1 876 . 9 1 1 A 75 75 ASP CB C 75 42.360 29.299 13.061 1 1 877 . 9 1 1 A 75 75 ASP N N 75 112.035 119.627 -7.592 1 1 878 . 9 1 1 A 76 76 VAL H H 76 8.128 8.378 -0.250 1 1 879 . 9 1 1 A 76 76 VAL HA H 76 4.106 4.028 0.078 1 1 887 . 9 1 1 A 76 76 VAL CA C 76 65.179 59.134 6.045 1 1 888 . 9 1 1 A 76 76 VAL CB C 76 32.174 29.111 3.063 1 1 891 . 9 1 1 A 76 76 VAL N N 76 117.992 120.602 -2.610 1 1 892 . 9 1 1 A 77 77 TRP H H 77 6.869 7.989 -1.120 1 1 893 . 9 1 1 A 77 77 TRP HA H 77 4.509 4.115 0.394 1 1 899 . 9 1 1 A 77 77 TRP CA C 77 59.207 57.772 1.435 1 1 900 . 9 1 1 A 77 77 TRP CB C 77 28.941 41.415 -12.474 1 1 901 . 9 1 1 A 77 77 TRP N N 77 123.077 121.362 1.715 1 1 903 . 9 1 1 A 78 78 GLU H H 78 8.593 8.398 0.195 1 1 904 . 9 1 1 A 78 78 GLU HA H 78 4.318 3.896 0.422 1 1 909 . 9 1 1 A 78 78 GLU CA C 78 60.038 59.230 0.808 1 1 910 . 9 1 1 A 78 78 GLU CB C 78 31.178 28.304 2.874 1 1 912 . 9 1 1 A 78 78 GLU N N 78 121.505 117.729 3.776 1 1 913 . 9 1 1 A 79 79 PHE H H 79 8.071 8.146 -0.075 1 1 914 . 9 1 1 A 79 79 PHE HA H 79 4.986 4.067 0.919 1 1 919 . 9 1 1 A 79 79 PHE CA C 79 58.749 58.771 -0.022 1 1 920 . 9 1 1 A 79 79 PHE CB C 79 39.732 28.974 10.758 1 1 921 . 9 1 1 A 79 79 PHE N N 79 118.384 118.143 0.241 1 1 922 . 9 1 1 A 80 80 LEU H H 80 9.309 7.909 1.400 1 1 923 . 9 1 1 A 80 80 LEU HA H 80 3.970 4.443 -0.473 1 1 933 . 9 1 1 A 80 80 LEU CA C 80 59.307 56.426 2.881 1 1 934 . 9 1 1 A 80 80 LEU CB C 80 43.257 38.190 5.067 1 1 937 . 9 1 1 A 80 80 LEU N N 80 122.915 118.376 4.539 1 1 938 . 9 1 1 A 81 81 GLU H H 81 8.282 8.060 0.222 1 1 939 . 9 1 1 A 81 81 GLU HA H 81 3.832 3.592 0.240 1 1 944 . 9 1 1 A 81 81 GLU CA C 81 62.069 65.160 -3.091 1 1 945 . 9 1 1 A 81 81 GLU CB C 81 30.249 38.148 -7.899 1 1 947 . 9 1 1 A 81 81 GLU N N 81 119.345 120.335 -0.990 1 1 948 . 9 1 1 A 82 82 LEU H H 82 8.236 7.919 0.317 1 1 949 . 9 1 1 A 82 82 LEU HA H 82 4.187 4.406 -0.219 1 1 959 . 9 1 1 A 82 82 LEU CA C 82 58.348 58.581 -0.233 1 1 960 . 9 1 1 A 82 82 LEU CB C 82 42.827 32.005 10.822 1 1 963 . 9 1 1 A 82 82 LEU N N 82 120.013 119.374 0.639 1 1 964 . 9 1 1 A 83 83 GLN H H 83 7.949 7.933 0.016 1 1 965 . 9 1 1 A 83 83 GLN HA H 83 3.812 3.950 -0.138 1 1 968 . 9 1 1 A 83 83 GLN CA C 83 60.248 58.144 2.104 1 1 969 . 9 1 1 A 83 83 GLN CB C 83 33.537 41.499 -7.962 1 1 970 . 9 1 1 A 83 83 GLN N N 83 116.443 120.410 -3.967 1 1 971 . 9 1 1 A 84 84 ILE H H 84 8.407 8.740 -0.333 1 1 972 . 9 1 1 A 84 84 ILE HA H 84 3.644 4.096 -0.452 1 1 982 . 9 1 1 A 84 84 ILE CA C 84 67.288 58.772 8.516 1 1 983 . 9 1 1 A 84 84 ILE CB C 84 38.305 29.110 9.195 1 1 987 . 9 1 1 A 84 84 ILE N N 84 120.422 118.158 2.264 1 1 988 . 9 1 1 A 85 85 GLU H H 85 7.741 8.200 -0.459 1 1 989 . 9 1 1 A 85 85 GLU HA H 85 3.811 4.947 -1.136 1 1 994 . 9 1 1 A 85 85 GLU CA C 85 59.862 52.895 6.967 1 1 995 . 9 1 1 A 85 85 GLU CB C 85 30.360 46.063 -15.703 1 1 997 . 9 1 1 A 85 85 GLU N N 85 115.705 116.676 -0.971 1 1 998 . 9 1 1 A 86 86 GLU H H 86 7.818 8.709 -0.891 1 1 999 . 9 1 1 A 86 86 GLU HA H 86 4.274 4.705 -0.431 1 1 1004 . 9 1 1 A 86 86 GLU CA C 86 58.068 55.826 2.242 1 1 1005 . 9 1 1 A 86 86 GLU CB C 86 31.424 33.517 -2.093 1 1 1007 . 9 1 1 A 86 86 GLU N N 86 114.297 118.632 -4.335 1 1 1008 . 9 1 1 A 87 87 ILE H H 87 8.753 8.443 0.310 1 1 1019 . 9 1 1 A 87 87 ILE CA C 87 62.660 44.677 17.983 1 1 1024 . 9 1 1 A 87 87 ILE N N 87 118.890 109.956 8.934 1 1 1025 . 9 1 1 A 88 88 TYR H H 88 8.059 8.741 -0.682 1 1 1026 . 9 1 1 A 88 88 TYR HA H 88 5.447 4.191 1.256 1 1 1033 . 9 1 1 A 88 88 TYR CA C 88 55.285 58.847 -3.562 1 1 1034 . 9 1 1 A 88 88 TYR CB C 88 40.687 32.182 8.505 1 1 1035 . 9 1 1 A 88 88 TYR N N 88 119.252 125.137 -5.885 1 1 1036 . 9 1 1 A 89 89 PRO HA H 89 4.410 3.977 0.433 1 1 1043 . 9 1 1 A 89 89 PRO CA C 89 66.374 59.468 6.906 1 1 1044 . 9 1 1 A 89 89 PRO CB C 89 31.377 29.111 2.266 1 1 1047 . 9 1 1 A 90 90 GLU H H 90 9.234 8.274 0.960 1 1 1048 . 9 1 1 A 90 90 GLU HA H 90 4.379 4.019 0.360 1 1 1053 . 9 1 1 A 90 90 GLU CA C 90 59.098 58.641 0.457 1 1 1054 . 9 1 1 A 90 90 GLU CB C 90 29.461 28.320 1.141 1 1 1056 . 9 1 1 A 90 90 GLU N N 90 117.574 118.050 -0.476 1 1 1057 . 9 1 1 A 91 91 GLU H H 91 7.966 7.961 0.005 1 1 1058 . 9 1 1 A 91 91 GLU HA H 91 4.890 4.043 0.847 1 1 1063 . 9 1 1 A 91 91 GLU CA C 91 55.324 59.214 -3.890 1 1 1064 . 9 1 1 A 91 91 GLU CB C 91 31.590 29.447 2.143 1 1 1066 . 9 1 1 A 91 91 GLU N N 91 119.310 119.921 -0.611 1 1 1067 . 9 1 1 A 92 92 GLU H H 92 7.263 8.031 -0.768 1 1 1068 . 9 1 1 A 92 92 GLU HA H 92 3.789 3.937 -0.148 1 1 1073 . 9 1 1 A 92 92 GLU CA C 92 60.628 57.965 2.663 1 1 1074 . 9 1 1 A 92 92 GLU CB C 92 30.531 41.476 -10.945 1 1 1076 . 9 1 1 A 92 92 GLU N N 92 121.332 120.204 1.128 1 1 1077 . 9 1 1 A 93 93 GLU H H 93 8.646 8.005 0.641 1 1 1078 . 9 1 1 A 93 93 GLU HA H 93 4.127 4.082 0.045 1 1 1083 . 9 1 1 A 93 93 GLU CA C 93 60.528 55.357 5.171 1 1 1084 . 9 1 1 A 93 93 GLU CB C 93 29.744 18.308 11.436 1 1 1086 . 9 1 1 A 93 93 GLU N N 93 118.207 121.298 -3.091 1 1 1087 . 9 1 1 A 94 94 ILE H H 94 7.766 8.283 -0.517 1 1 1088 . 9 1 1 A 94 94 ILE HA H 94 3.976 3.927 0.049 1 1 1098 . 9 1 1 A 94 94 ILE CA C 94 64.361 58.158 6.203 1 1 1099 . 9 1 1 A 94 94 ILE CB C 94 38.921 41.387 -2.466 1 1 1103 . 9 1 1 A 94 94 ILE N N 94 119.072 118.118 0.954 1 1 1104 . 9 1 1 A 95 95 LEU H H 95 8.340 8.089 0.251 1 1 1105 . 9 1 1 A 95 95 LEU HA H 95 4.300 4.144 0.156 1 1 1115 . 9 1 1 A 95 95 LEU CA C 95 57.905 59.508 -1.603 1 1 1116 . 9 1 1 A 95 95 LEU CB C 95 42.144 29.197 12.947 1 1 1119 . 9 1 1 A 95 95 LEU N N 95 121.325 117.795 3.530 1 1 1120 . 9 1 1 A 96 96 LYS H H 96 8.899 7.956 0.943 1 1 1121 . 9 1 1 A 96 96 LYS HA H 96 4.075 4.045 0.030 1 1 1126 . 9 1 1 A 96 96 LYS CA C 96 61.707 57.779 3.928 1 1 1127 . 9 1 1 A 96 96 LYS CB C 96 32.910 41.745 -8.835 1 1 1128 . 9 1 1 A 96 96 LYS N N 96 120.018 122.250 -2.232 1 1 1129 . 9 1 1 A 97 97 LYS H H 97 7.808 7.983 -0.175 1 1 1130 . 9 1 1 A 97 97 LYS HA H 97 4.045 4.313 -0.268 1 1 1139 . 9 1 1 A 97 97 LYS CA C 97 60.198 55.711 4.487 1 1 1140 . 9 1 1 A 97 97 LYS CB C 97 32.600 41.210 -8.610 1 1 1143 . 9 1 1 A 97 97 LYS N N 97 121.016 115.705 5.311 1 1 1144 . 9 1 1 A 98 98 ALA H H 98 7.814 8.341 -0.527 1 1 1145 . 9 1 1 A 98 98 ALA HA H 98 4.320 4.790 -0.470 1 1 1149 . 9 1 1 A 98 98 ALA CA C 98 55.260 54.506 0.754 1 1 1150 . 9 1 1 A 98 98 ALA CB C 98 19.468 39.342 -19.874 1 1 1151 . 9 1 1 A 98 98 ALA N N 98 122.102 116.249 5.853 1 1 1152 . 9 1 1 A 99 99 LEU H H 99 8.212 7.907 0.305 1 1 1153 . 9 1 1 A 99 99 LEU HA H 99 4.187 4.761 -0.574 1 1 1160 . 9 1 1 A 99 99 LEU CA C 99 58.398 56.809 1.589 1 1 1161 . 9 1 1 A 99 99 LEU CB C 99 42.720 37.117 5.603 1 1 1164 . 9 1 1 A 99 99 LEU N N 99 118.467 115.909 2.558 1 1 1165 . 9 1 1 A 100 100 ARG H H 100 7.738 7.446 0.292 1 1 1166 . 9 1 1 A 100 100 ARG HA H 100 3.894 5.212 -1.318 1 1 1173 . 9 1 1 A 100 100 ARG CA C 100 60.135 52.849 7.286 1 1 1174 . 9 1 1 A 100 100 ARG CB C 100 30.187 45.428 -15.241 1 1 1177 . 9 1 1 A 100 100 ARG N N 100 119.100 116.918 2.182 1 1 1178 . 9 1 1 A 101 101 ASP H H 101 8.186 8.078 0.108 1 1 1179 . 9 1 1 A 101 101 ASP HA H 101 4.424 4.970 -0.546 1 1 1182 . 9 1 1 A 101 101 ASP CA C 101 57.902 51.925 5.977 1 1 1183 . 9 1 1 A 101 101 ASP CB C 101 40.033 40.460 -0.427 1 1 1184 . 9 1 1 A 101 101 ASP N N 101 121.899 117.112 4.787 1 1 1185 . 9 1 1 A 102 102 LEU H H 102 8.730 8.494 0.236 1 1 1186 . 9 1 1 A 102 102 LEU HA H 102 4.373 4.379 -0.006 1 1 1195 . 9 1 1 A 102 102 LEU CA C 102 58.218 56.447 1.771 1 1 1196 . 9 1 1 A 102 102 LEU CB C 102 42.839 29.845 12.994 1 1 1199 . 9 1 1 A 102 102 LEU N N 102 124.505 120.737 3.768 1 1 1200 . 9 1 1 A 103 103 LYS HA H 103 3.726 4.298 -0.572 1 1 1209 . 9 1 1 A 103 103 LYS CA C 103 59.760 55.895 3.865 1 1 1210 . 9 1 1 A 103 103 LYS CB C 103 32.822 33.217 -0.395 1 1 1214 . 9 1 1 A 104 104 ARG H H 104 7.409 7.834 -0.425 1 1 1222 . 9 1 1 A 104 104 ARG CA C 104 56.298 45.163 11.135 1 1 1226 . 9 1 1 A 104 104 ARG N N 104 115.912 106.053 9.859 1 1 1227 . 9 1 1 A 105 105 GLY H H 105 8.046 7.249 0.797 1 1 1230 . 9 1 1 A 105 105 GLY CA C 105 46.309 55.288 -8.979 1 1 1231 . 9 1 1 A 105 105 GLY N N 105 108.860 115.396 -6.536 1 1 1232 . 9 1 1 A 106 106 LYS H H 106 8.033 8.525 -0.492 1 1 1233 . 9 1 1 A 106 106 LYS HA H 106 4.394 4.313 0.081 1 1 1242 . 9 1 1 A 106 106 LYS CA C 106 55.822 55.205 0.617 1 1 1243 . 9 1 1 A 106 106 LYS CB C 106 33.449 42.806 -9.357 1 1 1246 . 9 1 1 A 106 106 LYS N N 106 121.082 119.002 2.080 1 1 1247 . 9 1 1 A 107 107 LYS H H 107 8.271 8.698 -0.427 1 1 1248 . 9 1 1 A 107 107 LYS HA H 107 4.329 4.652 -0.323 1 1 1255 . 9 1 1 A 107 107 LYS CA C 107 56.673 59.263 -2.590 1 1 1256 . 9 1 1 A 107 107 LYS CB C 107 33.341 64.363 -31.022 1 1 1258 . 9 1 1 A 107 107 LYS N N 107 121.869 114.514 7.355 1 1 1259 . 9 1 1 A 108 108 LEU H H 108 8.481 7.432 1.049 1 1 1260 . 9 1 1 A 108 108 LEU HA H 108 4.637 4.971 -0.334 1 1 1269 . 9 1 1 A 108 108 LEU CA C 108 53.819 54.687 -0.868 1 1 1270 . 9 1 1 A 108 108 LEU CB C 108 45.135 35.650 9.485 1 1 1272 . 9 1 1 A 108 108 LEU N N 108 124.360 117.475 6.885 1 1 1273 . 9 1 1 A 109 109 LYS H H 109 8.657 8.893 -0.236 1 1 1274 . 9 1 1 A 109 109 LYS HA H 109 4.565 4.494 0.071 1 1 1283 . 9 1 1 A 109 109 LYS CA C 109 55.511 59.131 -3.620 1 1 1284 . 9 1 1 A 109 109 LYS CB C 109 32.029 64.030 -32.001 1 1 1287 . 9 1 1 A 109 109 LYS N N 109 123.165 117.869 5.296 1 1 1288 . 9 1 1 A 110 110 PRO HA H 110 4.232 3.594 0.638 1 1 1295 . 9 1 1 A 110 110 PRO CA C 110 66.732 66.627 0.105 1 1 1296 . 9 1 1 A 110 110 PRO CB C 110 32.481 31.553 0.928 1 1 1299 . 9 1 1 A 111 111 GLU HA H 111 4.221 3.871 0.350 1 1 1304 . 9 1 1 A 111 111 GLU CA C 111 59.819 59.826 -0.007 1 1 1305 . 9 1 1 A 111 111 GLU CB C 111 29.250 29.128 0.122 1 1 1307 . 9 1 1 A 112 112 ILE H H 112 7.233 8.304 -1.071 1 1 1308 . 9 1 1 A 112 112 ILE HA H 112 3.848 4.072 -0.224 1 1 1318 . 9 1 1 A 112 112 ILE CA C 112 62.635 59.167 3.468 1 1 1319 . 9 1 1 A 112 112 ILE CB C 112 37.159 29.294 7.865 1 1 1323 . 9 1 1 A 112 112 ILE N N 112 120.783 118.056 2.727 1 1 1324 . 9 1 1 A 113 113 LYS H H 113 8.268 7.575 0.693 1 1 1325 . 9 1 1 A 113 113 LYS HA H 113 3.849 3.651 0.198 1 1 1328 . 9 1 1 A 113 113 LYS CA C 113 60.248 64.678 -4.430 1 1 1329 . 9 1 1 A 113 113 LYS CB C 113 32.668 37.341 -4.673 1 1 1330 . 9 1 1 A 113 113 LYS N N 113 121.680 121.704 -0.024 1 1 1331 . 9 1 1 A 114 114 GLY H H 114 8.460 8.327 0.133 1 1 1334 . 9 1 1 A 114 114 GLY CA C 114 47.600 61.071 -13.471 1 1 1335 . 9 1 1 A 114 114 GLY N N 114 105.413 115.495 -10.082 1 1 1336 . 9 1 1 A 115 115 LYS H H 115 7.352 7.689 -0.337 1 1 1337 . 9 1 1 A 115 115 LYS HA H 115 4.189 4.530 -0.341 1 1 1346 . 9 1 1 A 115 115 LYS CA C 115 59.689 57.117 2.572 1 1 1347 . 9 1 1 A 115 115 LYS CB C 115 33.428 41.021 -7.593 1 1 1351 . 9 1 1 A 115 115 LYS N N 115 121.599 122.560 -0.961 1 1 1352 . 9 1 1 A 116 116 LEU H H 116 8.046 7.981 0.065 1 1 1353 . 9 1 1 A 116 116 LEU HA H 116 4.153 3.877 0.276 1 1 1363 . 9 1 1 A 116 116 LEU CA C 116 57.698 64.926 -7.228 1 1 1364 . 9 1 1 A 116 116 LEU CB C 116 42.070 31.568 10.502 1 1 1366 . 9 1 1 A 116 116 LEU N N 116 118.827 119.045 -0.218 1 1 1367 . 9 1 1 A 117 117 SER H H 117 8.321 7.539 0.782 1 1 1368 . 9 1 1 A 117 117 SER HA H 117 4.334 4.191 0.143 1 1 1371 . 9 1 1 A 117 117 SER CA C 117 61.467 54.238 7.229 1 1 1372 . 9 1 1 A 117 117 SER CB C 117 63.613 41.953 21.660 1 1 1373 . 9 1 1 A 117 117 SER N N 117 114.829 115.869 -1.040 1 1 1374 . 9 1 1 A 118 118 ARG H H 118 7.001 7.818 -0.817 1 1 1375 . 9 1 1 A 118 118 ARG HA H 118 4.403 3.880 0.523 1 1 1382 . 9 1 1 A 118 118 ARG CA C 118 56.734 56.956 -0.222 1 1 1383 . 9 1 1 A 118 118 ARG CB C 118 31.115 27.236 3.879 1 1 1385 . 9 1 1 A 118 118 ARG N N 118 118.114 114.211 3.903 1 1 1386 . 9 1 1 A 119 119 LEU H H 119 7.365 8.257 -0.892 1 1 1387 . 9 1 1 A 119 119 LEU HA H 119 4.253 4.884 -0.631 1 1 1397 . 9 1 1 A 119 119 LEU CA C 119 54.639 57.675 -3.036 1 1 1398 . 9 1 1 A 119 119 LEU CB C 119 41.700 31.332 10.368 1 1 1401 . 9 1 1 A 119 119 LEU N N 119 119.181 117.382 1.799 1 1 1402 . 9 1 1 A 120 120 ARG H H 120 8.766 8.732 0.034 1 1 1403 . 9 1 1 A 120 120 ARG HA H 120 4.374 4.507 -0.133 1 1 1410 . 9 1 1 A 120 120 ARG CA C 120 56.426 59.245 -2.819 1 1 1411 . 9 1 1 A 120 120 ARG CB C 120 32.414 63.782 -31.368 1 1 1414 . 9 1 1 A 120 120 ARG N N 120 122.099 120.472 1.627 1 1 1415 . 9 1 1 A 121 121 LEU H H 121 8.312 8.850 -0.538 1 1 1416 . 9 1 1 A 121 121 LEU HA H 121 4.407 3.731 0.676 1 1 1426 . 9 1 1 A 121 121 LEU CA C 121 56.028 65.783 -9.755 1 1 1427 . 9 1 1 A 121 121 LEU CB C 121 43.122 31.497 11.625 1 1 1430 . 9 1 1 A 121 121 LEU N N 121 118.761 123.061 -4.300 1 1 1431 . 9 1 1 A 122 122 PHE H H 122 7.143 8.429 -1.286 1 1 1432 . 9 1 1 A 122 122 PHE HA H 122 5.201 4.093 1.108 1 1 1439 . 9 1 1 A 122 122 PHE CA C 122 53.047 59.143 -6.096 1 1 1440 . 9 1 1 A 122 122 PHE CB C 122 40.844 29.445 11.399 1 1 1441 . 9 1 1 A 122 122 PHE N N 122 112.750 120.908 -8.158 1 1 1442 . 9 1 1 A 123 123 PRO HA H 123 3.908 3.980 -0.072 1 1 1449 . 9 1 1 A 123 123 PRO CA C 123 65.478 59.238 6.240 1 1 1450 . 9 1 1 A 123 123 PRO CB C 123 33.248 29.313 3.935 1 1 1452 . 9 1 1 A 124 124 LEU H H 124 7.208 8.269 -1.061 1 1 1453 . 9 1 1 A 124 124 LEU HA H 124 4.673 4.082 0.591 1 1 1463 . 9 1 1 A 124 124 LEU CA C 124 53.307 57.618 -4.311 1 1 1464 . 9 1 1 A 124 124 LEU CB C 124 42.853 41.961 0.892 1 1 1468 . 9 1 1 A 124 124 LEU N N 124 113.875 121.490 -7.615 1 1 1469 . 9 1 1 A 125 125 SER H H 125 8.990 8.151 0.839 1 1 1470 . 9 1 1 A 125 125 SER HA H 125 4.533 3.938 0.595 1 1 1473 . 9 1 1 A 125 125 SER CA C 125 59.198 59.502 -0.304 1 1 1474 . 9 1 1 A 125 125 SER CB C 125 64.578 29.293 35.285 1 1 1475 . 9 1 1 A 125 125 SER N N 125 117.894 119.846 -1.952 1 1 1476 . 9 1 1 A 126 126 SER H H 126 8.618 7.823 0.795 1 1 1477 . 9 1 1 A 126 126 SER HA H 126 4.614 3.993 0.621 1 1 1480 . 9 1 1 A 126 126 SER CA C 126 58.730 60.132 -1.402 1 1 1481 . 9 1 1 A 126 126 SER CB C 126 64.367 32.362 32.005 1 1 1482 . 9 1 1 A 126 126 SER N N 126 118.602 118.839 -0.237 1 1 1483 . 9 1 1 A 127 127 SER HA H 127 4.530 3.781 0.749 1 1 1486 . 9 1 1 A 127 127 SER CA C 127 58.954 65.714 -6.760 1 1 1487 . 9 1 1 A 127 127 SER CB C 127 64.379 31.531 32.848 1 1 1488 . 9 1 1 A 128 128 ALA H H 128 8.345 8.222 0.123 1 1 1489 . 9 1 1 A 128 128 ALA HA H 128 4.432 3.934 0.498 1 1 1493 . 9 1 1 A 128 128 ALA CA C 128 52.963 59.219 -6.256 1 1 1494 . 9 1 1 A 128 128 ALA CB C 128 19.924 29.812 -9.888 1 1 1495 . 9 1 1 A 128 128 ALA N N 128 126.185 122.091 4.094 1 1 1496 . 9 1 1 A 129 129 GLU H H 129 8.329 7.948 0.381 1 1 1497 . 9 1 1 A 129 129 GLU HA H 129 4.353 4.073 0.280 1 1 1502 . 9 1 1 A 129 129 GLU CA C 129 57.111 58.632 -1.521 1 1 1503 . 9 1 1 A 129 129 GLU CB C 129 30.949 28.656 2.293 1 1 1504 . 9 1 1 A 129 129 GLU N N 129 120.842 118.612 2.230 1 1 1505 . 9 1 1 A 130 130 LYS H H 130 7.947 7.989 -0.042 1 1 1506 . 9 1 1 A 130 130 LYS HA H 130 3.835 4.037 -0.202 1 1 1515 . 9 1 1 A 130 130 LYS CA C 130 57.756 59.683 -1.927 1 1 1516 . 9 1 1 A 130 130 LYS CB C 130 33.156 32.088 1.068 1 1 826 . 10 1 1 A 70 70 GLY H H 70 9.295 8.406 0.889 1 1 829 . 10 1 1 A 70 70 GLY CA C 70 46.552 59.491 -12.939 1 1 830 . 10 1 1 A 70 70 GLY N N 70 108.643 117.226 -8.583 1 1 832 . 10 1 1 A 71 71 VAL HA H 71 3.538 4.827 -1.289 1 1 840 . 10 1 1 A 71 71 VAL CA C 71 65.623 62.821 2.802 1 1 841 . 10 1 1 A 71 71 VAL CB C 71 30.251 32.021 -1.770 1 1 844 . 10 1 1 A 71 71 VAL N N 71 110.808 136.218 -25.410 1 1 845 . 10 1 1 A 72 72 CYS H H 72 8.022 8.291 -0.269 1 1 846 . 10 1 1 A 72 72 CYS HA H 72 3.469 4.800 -1.331 1 1 849 . 10 1 1 A 72 72 CYS CA C 72 62.733 57.789 4.944 1 1 850 . 10 1 1 A 72 72 CYS CB C 72 27.163 63.178 -36.015 1 1 851 . 10 1 1 A 72 72 CYS N N 72 109.483 113.962 -4.479 1 1 852 . 10 1 1 A 73 73 SER H H 73 7.996 8.178 -0.182 1 1 853 . 10 1 1 A 73 73 SER HA H 73 4.439 4.012 0.427 1 1 856 . 10 1 1 A 73 73 SER CA C 73 62.145 59.292 2.853 1 1 857 . 10 1 1 A 73 73 SER CB C 73 66.013 29.315 36.698 1 1 858 . 10 1 1 A 73 73 SER N N 73 118.630 123.365 -4.735 1 1 859 . 10 1 1 A 74 74 LYS H H 74 10.186 7.897 2.289 1 1 860 . 10 1 1 A 74 74 LYS HA H 74 4.172 3.973 0.199 1 1 867 . 10 1 1 A 74 74 LYS CA C 74 59.848 58.387 1.461 1 1 868 . 10 1 1 A 74 74 LYS CB C 74 34.278 41.465 -7.187 1 1 870 . 10 1 1 A 74 74 LYS N N 74 123.341 119.769 3.572 1 1 871 . 10 1 1 A 75 75 ASP H H 75 7.542 8.232 -0.690 1 1 872 . 10 1 1 A 75 75 ASP HA H 75 3.538 3.942 -0.404 1 1 875 . 10 1 1 A 75 75 ASP CA C 75 52.472 59.896 -7.424 1 1 876 . 10 1 1 A 75 75 ASP CB C 75 42.360 29.288 13.072 1 1 877 . 10 1 1 A 75 75 ASP N N 75 112.035 119.594 -7.559 1 1 878 . 10 1 1 A 76 76 VAL H H 76 8.128 8.384 -0.256 1 1 879 . 10 1 1 A 76 76 VAL HA H 76 4.106 4.027 0.079 1 1 887 . 10 1 1 A 76 76 VAL CA C 76 65.179 59.168 6.011 1 1 888 . 10 1 1 A 76 76 VAL CB C 76 32.174 29.037 3.137 1 1 891 . 10 1 1 A 76 76 VAL N N 76 117.992 120.600 -2.608 1 1 892 . 10 1 1 A 77 77 TRP H H 77 6.869 7.999 -1.130 1 1 893 . 10 1 1 A 77 77 TRP HA H 77 4.509 4.107 0.402 1 1 899 . 10 1 1 A 77 77 TRP CA C 77 59.207 57.762 1.445 1 1 900 . 10 1 1 A 77 77 TRP CB C 77 28.941 41.401 -12.460 1 1 901 . 10 1 1 A 77 77 TRP N N 77 123.077 121.512 1.565 1 1 903 . 10 1 1 A 78 78 GLU H H 78 8.593 8.420 0.173 1 1 904 . 10 1 1 A 78 78 GLU HA H 78 4.318 3.900 0.418 1 1 909 . 10 1 1 A 78 78 GLU CA C 78 60.038 59.100 0.938 1 1 910 . 10 1 1 A 78 78 GLU CB C 78 31.178 28.353 2.825 1 1 912 . 10 1 1 A 78 78 GLU N N 78 121.505 117.881 3.624 1 1 913 . 10 1 1 A 79 79 PHE H H 79 8.071 8.122 -0.051 1 1 914 . 10 1 1 A 79 79 PHE HA H 79 4.986 4.081 0.905 1 1 919 . 10 1 1 A 79 79 PHE CA C 79 58.749 58.640 0.109 1 1 920 . 10 1 1 A 79 79 PHE CB C 79 39.732 28.874 10.858 1 1 921 . 10 1 1 A 79 79 PHE N N 79 118.384 118.135 0.249 1 1 922 . 10 1 1 A 80 80 LEU H H 80 9.309 7.896 1.413 1 1 923 . 10 1 1 A 80 80 LEU HA H 80 3.970 4.447 -0.477 1 1 933 . 10 1 1 A 80 80 LEU CA C 80 59.307 56.428 2.879 1 1 934 . 10 1 1 A 80 80 LEU CB C 80 43.257 38.229 5.028 1 1 937 . 10 1 1 A 80 80 LEU N N 80 122.915 118.383 4.532 1 1 938 . 10 1 1 A 81 81 GLU H H 81 8.282 8.047 0.235 1 1 939 . 10 1 1 A 81 81 GLU HA H 81 3.832 3.585 0.247 1 1 944 . 10 1 1 A 81 81 GLU CA C 81 62.069 65.208 -3.139 1 1 945 . 10 1 1 A 81 81 GLU CB C 81 30.249 38.185 -7.936 1 1 947 . 10 1 1 A 81 81 GLU N N 81 119.345 120.341 -0.996 1 1 948 . 10 1 1 A 82 82 LEU H H 82 8.236 7.941 0.295 1 1 949 . 10 1 1 A 82 82 LEU HA H 82 4.187 4.396 -0.209 1 1 959 . 10 1 1 A 82 82 LEU CA C 82 58.348 58.871 -0.523 1 1 960 . 10 1 1 A 82 82 LEU CB C 82 42.827 31.873 10.954 1 1 963 . 10 1 1 A 82 82 LEU N N 82 120.013 119.216 0.797 1 1 964 . 10 1 1 A 83 83 GLN H H 83 7.949 8.158 -0.209 1 1 965 . 10 1 1 A 83 83 GLN HA H 83 3.812 3.971 -0.159 1 1 968 . 10 1 1 A 83 83 GLN CA C 83 60.248 58.003 2.245 1 1 969 . 10 1 1 A 83 83 GLN CB C 83 33.537 41.449 -7.912 1 1 970 . 10 1 1 A 83 83 GLN N N 83 116.443 120.832 -4.389 1 1 971 . 10 1 1 A 84 84 ILE H H 84 8.407 7.873 0.534 1 1 972 . 10 1 1 A 84 84 ILE HA H 84 3.644 4.269 -0.625 1 1 982 . 10 1 1 A 84 84 ILE CA C 84 67.288 58.893 8.395 1 1 983 . 10 1 1 A 84 84 ILE CB C 84 38.305 30.352 7.953 1 1 987 . 10 1 1 A 84 84 ILE N N 84 120.422 117.219 3.203 1 1 988 . 10 1 1 A 85 85 GLU H H 85 7.741 8.040 -0.299 1 1 989 . 10 1 1 A 85 85 GLU HA H 85 3.811 5.003 -1.192 1 1 994 . 10 1 1 A 85 85 GLU CA C 85 59.862 52.548 7.314 1 1 995 . 10 1 1 A 85 85 GLU CB C 85 30.360 45.434 -15.074 1 1 997 . 10 1 1 A 85 85 GLU N N 85 115.705 116.315 -0.610 1 1 998 . 10 1 1 A 86 86 GLU H H 86 7.818 8.695 -0.877 1 1 999 . 10 1 1 A 86 86 GLU HA H 86 4.274 4.736 -0.462 1 1 1004 . 10 1 1 A 86 86 GLU CA C 86 58.068 55.638 2.430 1 1 1005 . 10 1 1 A 86 86 GLU CB C 86 31.424 33.693 -2.269 1 1 1007 . 10 1 1 A 86 86 GLU N N 86 114.297 118.413 -4.116 1 1 1008 . 10 1 1 A 87 87 ILE H H 87 8.753 8.437 0.316 1 1 1019 . 10 1 1 A 87 87 ILE CA C 87 62.660 44.700 17.960 1 1 1024 . 10 1 1 A 87 87 ILE N N 87 118.890 109.634 9.256 1 1 1025 . 10 1 1 A 88 88 TYR H H 88 8.059 8.864 -0.805 1 1 1026 . 10 1 1 A 88 88 TYR HA H 88 5.447 4.169 1.278 1 1 1033 . 10 1 1 A 88 88 TYR CA C 88 55.285 58.155 -2.870 1 1 1034 . 10 1 1 A 88 88 TYR CB C 88 40.687 32.366 8.321 1 1 1035 . 10 1 1 A 88 88 TYR N N 88 119.252 125.573 -6.321 1 1 1036 . 10 1 1 A 89 89 PRO HA H 89 4.410 3.981 0.429 1 1 1043 . 10 1 1 A 89 89 PRO CA C 89 66.374 59.529 6.845 1 1 1044 . 10 1 1 A 89 89 PRO CB C 89 31.377 29.140 2.237 1 1 1047 . 10 1 1 A 90 90 GLU H H 90 9.234 8.255 0.979 1 1 1048 . 10 1 1 A 90 90 GLU HA H 90 4.379 4.015 0.364 1 1 1053 . 10 1 1 A 90 90 GLU CA C 90 59.098 58.719 0.379 1 1 1054 . 10 1 1 A 90 90 GLU CB C 90 29.461 28.128 1.333 1 1 1056 . 10 1 1 A 90 90 GLU N N 90 117.574 118.103 -0.529 1 1 1057 . 10 1 1 A 91 91 GLU H H 91 7.966 8.044 -0.078 1 1 1058 . 10 1 1 A 91 91 GLU HA H 91 4.890 4.058 0.832 1 1 1063 . 10 1 1 A 91 91 GLU CA C 91 55.324 59.030 -3.706 1 1 1064 . 10 1 1 A 91 91 GLU CB C 91 31.590 29.161 2.429 1 1 1066 . 10 1 1 A 91 91 GLU N N 91 119.310 119.941 -0.631 1 1 1067 . 10 1 1 A 92 92 GLU H H 92 7.263 8.203 -0.940 1 1 1068 . 10 1 1 A 92 92 GLU HA H 92 3.789 3.911 -0.122 1 1 1073 . 10 1 1 A 92 92 GLU CA C 92 60.628 57.957 2.671 1 1 1074 . 10 1 1 A 92 92 GLU CB C 92 30.531 41.506 -10.975 1 1 1076 . 10 1 1 A 92 92 GLU N N 92 121.332 120.157 1.175 1 1 1077 . 10 1 1 A 93 93 GLU H H 93 8.646 8.066 0.580 1 1 1078 . 10 1 1 A 93 93 GLU HA H 93 4.127 4.090 0.037 1 1 1083 . 10 1 1 A 93 93 GLU CA C 93 60.528 55.403 5.125 1 1 1084 . 10 1 1 A 93 93 GLU CB C 93 29.744 18.253 11.491 1 1 1086 . 10 1 1 A 93 93 GLU N N 93 118.207 121.335 -3.128 1 1 1087 . 10 1 1 A 94 94 ILE H H 94 7.766 8.318 -0.552 1 1 1088 . 10 1 1 A 94 94 ILE HA H 94 3.976 3.905 0.071 1 1 1098 . 10 1 1 A 94 94 ILE CA C 94 64.361 58.199 6.162 1 1 1099 . 10 1 1 A 94 94 ILE CB C 94 38.921 41.442 -2.521 1 1 1103 . 10 1 1 A 94 94 ILE N N 94 119.072 118.181 0.891 1 1 1104 . 10 1 1 A 95 95 LEU H H 95 8.340 8.019 0.321 1 1 1105 . 10 1 1 A 95 95 LEU HA H 95 4.300 4.164 0.136 1 1 1115 . 10 1 1 A 95 95 LEU CA C 95 57.905 59.476 -1.571 1 1 1116 . 10 1 1 A 95 95 LEU CB C 95 42.144 29.226 12.918 1 1 1119 . 10 1 1 A 95 95 LEU N N 95 121.325 117.510 3.815 1 1 1120 . 10 1 1 A 96 96 LYS H H 96 8.899 7.905 0.994 1 1 1121 . 10 1 1 A 96 96 LYS HA H 96 4.075 4.026 0.049 1 1 1126 . 10 1 1 A 96 96 LYS CA C 96 61.707 57.662 4.045 1 1 1127 . 10 1 1 A 96 96 LYS CB C 96 32.910 41.836 -8.926 1 1 1128 . 10 1 1 A 96 96 LYS N N 96 120.018 122.229 -2.211 1 1 1129 . 10 1 1 A 97 97 LYS H H 97 7.808 8.072 -0.264 1 1 1130 . 10 1 1 A 97 97 LYS HA H 97 4.045 4.304 -0.259 1 1 1139 . 10 1 1 A 97 97 LYS CA C 97 60.198 55.800 4.398 1 1 1140 . 10 1 1 A 97 97 LYS CB C 97 32.600 41.296 -8.696 1 1 1143 . 10 1 1 A 97 97 LYS N N 97 121.016 115.879 5.137 1 1 1144 . 10 1 1 A 98 98 ALA H H 98 7.814 8.297 -0.483 1 1 1145 . 10 1 1 A 98 98 ALA HA H 98 4.320 4.771 -0.451 1 1 1149 . 10 1 1 A 98 98 ALA CA C 98 55.260 54.303 0.957 1 1 1150 . 10 1 1 A 98 98 ALA CB C 98 19.468 39.446 -19.978 1 1 1151 . 10 1 1 A 98 98 ALA N N 98 122.102 116.448 5.654 1 1 1152 . 10 1 1 A 99 99 LEU H H 99 8.212 7.903 0.309 1 1 1153 . 10 1 1 A 99 99 LEU HA H 99 4.187 4.726 -0.539 1 1 1160 . 10 1 1 A 99 99 LEU CA C 99 58.398 56.772 1.626 1 1 1161 . 10 1 1 A 99 99 LEU CB C 99 42.720 36.879 5.841 1 1 1164 . 10 1 1 A 99 99 LEU N N 99 118.467 115.713 2.754 1 1 1165 . 10 1 1 A 100 100 ARG H H 100 7.738 7.449 0.289 1 1 1166 . 10 1 1 A 100 100 ARG HA H 100 3.894 5.081 -1.187 1 1 1173 . 10 1 1 A 100 100 ARG CA C 100 60.135 52.681 7.454 1 1 1174 . 10 1 1 A 100 100 ARG CB C 100 30.187 45.169 -14.982 1 1 1177 . 10 1 1 A 100 100 ARG N N 100 119.100 117.288 1.812 1 1 1178 . 10 1 1 A 101 101 ASP H H 101 8.186 7.940 0.246 1 1 1179 . 10 1 1 A 101 101 ASP HA H 101 4.424 4.863 -0.439 1 1 1182 . 10 1 1 A 101 101 ASP CA C 101 57.902 51.082 6.820 1 1 1183 . 10 1 1 A 101 101 ASP CB C 101 40.033 40.876 -0.843 1 1 1184 . 10 1 1 A 101 101 ASP N N 101 121.899 118.982 2.917 1 1 1185 . 10 1 1 A 102 102 LEU H H 102 8.730 8.833 -0.103 1 1 1186 . 10 1 1 A 102 102 LEU HA H 102 4.373 4.007 0.366 1 1 1195 . 10 1 1 A 102 102 LEU CA C 102 58.218 58.060 0.158 1 1 1196 . 10 1 1 A 102 102 LEU CB C 102 42.839 29.823 13.016 1 1 1199 . 10 1 1 A 102 102 LEU N N 102 124.505 124.114 0.391 1 1 1200 . 10 1 1 A 103 103 LYS HA H 103 3.726 4.315 -0.589 1 1 1209 . 10 1 1 A 103 103 LYS CA C 103 59.760 56.128 3.632 1 1 1210 . 10 1 1 A 103 103 LYS CB C 103 32.822 32.921 -0.099 1 1 1214 . 10 1 1 A 104 104 ARG H H 104 7.409 7.959 -0.550 1 1 1222 . 10 1 1 A 104 104 ARG CA C 104 56.298 45.177 11.121 1 1 1226 . 10 1 1 A 104 104 ARG N N 104 115.912 105.838 10.074 1 1 1227 . 10 1 1 A 105 105 GLY H H 105 8.046 7.850 0.196 1 1 1230 . 10 1 1 A 105 105 GLY CA C 105 46.309 55.784 -9.475 1 1 1231 . 10 1 1 A 105 105 GLY N N 105 108.860 118.397 -9.537 1 1 1232 . 10 1 1 A 106 106 LYS H H 106 8.033 8.417 -0.384 1 1 1233 . 10 1 1 A 106 106 LYS HA H 106 4.394 4.272 0.122 1 1 1242 . 10 1 1 A 106 106 LYS CA C 106 55.822 55.339 0.483 1 1 1243 . 10 1 1 A 106 106 LYS CB C 106 33.449 42.590 -9.141 1 1 1246 . 10 1 1 A 106 106 LYS N N 106 121.082 117.993 3.089 1 1 1247 . 10 1 1 A 107 107 LYS H H 107 8.271 8.495 -0.224 1 1 1248 . 10 1 1 A 107 107 LYS HA H 107 4.329 4.418 -0.089 1 1 1255 . 10 1 1 A 107 107 LYS CA C 107 56.673 59.214 -2.541 1 1 1256 . 10 1 1 A 107 107 LYS CB C 107 33.341 64.232 -30.891 1 1 1258 . 10 1 1 A 107 107 LYS N N 107 121.869 115.008 6.861 1 1 1259 . 10 1 1 A 108 108 LEU H H 108 8.481 7.417 1.064 1 1 1260 . 10 1 1 A 108 108 LEU HA H 108 4.637 5.071 -0.434 1 1 1269 . 10 1 1 A 108 108 LEU CA C 108 53.819 54.753 -0.934 1 1 1270 . 10 1 1 A 108 108 LEU CB C 108 45.135 35.259 9.876 1 1 1272 . 10 1 1 A 108 108 LEU N N 108 124.360 117.263 7.097 1 1 1273 . 10 1 1 A 109 109 LYS H H 109 8.657 8.832 -0.175 1 1 1274 . 10 1 1 A 109 109 LYS HA H 109 4.565 4.504 0.061 1 1 1283 . 10 1 1 A 109 109 LYS CA C 109 55.511 59.138 -3.627 1 1 1284 . 10 1 1 A 109 109 LYS CB C 109 32.029 64.039 -32.010 1 1 1287 . 10 1 1 A 109 109 LYS N N 109 123.165 118.109 5.056 1 1 1288 . 10 1 1 A 110 110 PRO HA H 110 4.232 3.596 0.636 1 1 1295 . 10 1 1 A 110 110 PRO CA C 110 66.732 66.651 0.081 1 1 1296 . 10 1 1 A 110 110 PRO CB C 110 32.481 31.578 0.903 1 1 1299 . 10 1 1 A 111 111 GLU HA H 111 4.221 3.919 0.302 1 1 1304 . 10 1 1 A 111 111 GLU CA C 111 59.819 59.827 -0.008 1 1 1305 . 10 1 1 A 111 111 GLU CB C 111 29.250 29.153 0.097 1 1 1307 . 10 1 1 A 112 112 ILE H H 112 7.233 8.263 -1.030 1 1 1308 . 10 1 1 A 112 112 ILE HA H 112 3.848 4.073 -0.225 1 1 1318 . 10 1 1 A 112 112 ILE CA C 112 62.635 59.151 3.484 1 1 1319 . 10 1 1 A 112 112 ILE CB C 112 37.159 29.319 7.840 1 1 1323 . 10 1 1 A 112 112 ILE N N 112 120.783 118.106 2.677 1 1 1324 . 10 1 1 A 113 113 LYS H H 113 8.268 7.860 0.408 1 1 1325 . 10 1 1 A 113 113 LYS HA H 113 3.849 3.668 0.181 1 1 1328 . 10 1 1 A 113 113 LYS CA C 113 60.248 64.908 -4.660 1 1 1329 . 10 1 1 A 113 113 LYS CB C 113 32.668 37.494 -4.826 1 1 1330 . 10 1 1 A 113 113 LYS N N 113 121.680 121.692 -0.012 1 1 1331 . 10 1 1 A 114 114 GLY H H 114 8.460 8.306 0.154 1 1 1334 . 10 1 1 A 114 114 GLY CA C 114 47.600 61.219 -13.619 1 1 1335 . 10 1 1 A 114 114 GLY N N 114 105.413 115.443 -10.030 1 1 1336 . 10 1 1 A 115 115 LYS H H 115 7.352 7.903 -0.551 1 1 1337 . 10 1 1 A 115 115 LYS HA H 115 4.189 4.432 -0.243 1 1 1346 . 10 1 1 A 115 115 LYS CA C 115 59.689 57.230 2.459 1 1 1347 . 10 1 1 A 115 115 LYS CB C 115 33.428 40.749 -7.321 1 1 1351 . 10 1 1 A 115 115 LYS N N 115 121.599 122.075 -0.476 1 1 1352 . 10 1 1 A 116 116 LEU H H 116 8.046 8.001 0.045 1 1 1353 . 10 1 1 A 116 116 LEU HA H 116 4.153 3.865 0.288 1 1 1363 . 10 1 1 A 116 116 LEU CA C 116 57.698 64.928 -7.230 1 1 1364 . 10 1 1 A 116 116 LEU CB C 116 42.070 31.608 10.462 1 1 1366 . 10 1 1 A 116 116 LEU N N 116 118.827 118.933 -0.106 1 1 1367 . 10 1 1 A 117 117 SER H H 117 8.321 7.550 0.771 1 1 1368 . 10 1 1 A 117 117 SER HA H 117 4.334 4.194 0.140 1 1 1371 . 10 1 1 A 117 117 SER CA C 117 61.467 54.319 7.148 1 1 1372 . 10 1 1 A 117 117 SER CB C 117 63.613 42.059 21.554 1 1 1373 . 10 1 1 A 117 117 SER N N 117 114.829 116.494 -1.665 1 1 1374 . 10 1 1 A 118 118 ARG H H 118 7.001 7.821 -0.820 1 1 1375 . 10 1 1 A 118 118 ARG HA H 118 4.403 3.880 0.523 1 1 1382 . 10 1 1 A 118 118 ARG CA C 118 56.734 57.039 -0.305 1 1 1383 . 10 1 1 A 118 118 ARG CB C 118 31.115 27.296 3.819 1 1 1385 . 10 1 1 A 118 118 ARG N N 118 118.114 114.256 3.858 1 1 1386 . 10 1 1 A 119 119 LEU H H 119 7.365 8.291 -0.926 1 1 1387 . 10 1 1 A 119 119 LEU HA H 119 4.253 4.877 -0.624 1 1 1397 . 10 1 1 A 119 119 LEU CA C 119 54.639 57.750 -3.111 1 1 1398 . 10 1 1 A 119 119 LEU CB C 119 41.700 31.526 10.174 1 1 1401 . 10 1 1 A 119 119 LEU N N 119 119.181 117.438 1.743 1 1 1402 . 10 1 1 A 120 120 ARG H H 120 8.766 8.639 0.127 1 1 1403 . 10 1 1 A 120 120 ARG HA H 120 4.374 4.475 -0.101 1 1 1410 . 10 1 1 A 120 120 ARG CA C 120 56.426 59.451 -3.025 1 1 1411 . 10 1 1 A 120 120 ARG CB C 120 32.414 63.812 -31.398 1 1 1414 . 10 1 1 A 120 120 ARG N N 120 122.099 120.717 1.382 1 1 1415 . 10 1 1 A 121 121 LEU H H 121 8.312 8.815 -0.503 1 1 1416 . 10 1 1 A 121 121 LEU HA H 121 4.407 3.703 0.704 1 1 1426 . 10 1 1 A 121 121 LEU CA C 121 56.028 65.804 -9.776 1 1 1427 . 10 1 1 A 121 121 LEU CB C 121 43.122 31.582 11.540 1 1 1430 . 10 1 1 A 121 121 LEU N N 121 118.761 123.383 -4.622 1 1 1431 . 10 1 1 A 122 122 PHE H H 122 7.143 8.422 -1.279 1 1 1432 . 10 1 1 A 122 122 PHE HA H 122 5.201 4.101 1.100 1 1 1439 . 10 1 1 A 122 122 PHE CA C 122 53.047 59.143 -6.096 1 1 1440 . 10 1 1 A 122 122 PHE CB C 122 40.844 29.458 11.386 1 1 1441 . 10 1 1 A 122 122 PHE N N 122 112.750 120.908 -8.158 1 1 1442 . 10 1 1 A 123 123 PRO HA H 123 3.908 3.986 -0.078 1 1 1449 . 10 1 1 A 123 123 PRO CA C 123 65.478 59.179 6.299 1 1 1450 . 10 1 1 A 123 123 PRO CB C 123 33.248 29.273 3.975 1 1 1452 . 10 1 1 A 124 124 LEU H H 124 7.208 8.147 -0.939 1 1 1453 . 10 1 1 A 124 124 LEU HA H 124 4.673 4.090 0.583 1 1 1463 . 10 1 1 A 124 124 LEU CA C 124 53.307 57.636 -4.329 1 1 1464 . 10 1 1 A 124 124 LEU CB C 124 42.853 41.425 1.428 1 1 1468 . 10 1 1 A 124 124 LEU N N 124 113.875 121.586 -7.711 1 1 1469 . 10 1 1 A 125 125 SER H H 125 8.990 8.144 0.846 1 1 1470 . 10 1 1 A 125 125 SER HA H 125 4.533 4.009 0.524 1 1 1473 . 10 1 1 A 125 125 SER CA C 125 59.198 59.522 -0.324 1 1 1474 . 10 1 1 A 125 125 SER CB C 125 64.578 29.692 34.886 1 1 1475 . 10 1 1 A 125 125 SER N N 125 117.894 119.512 -1.618 1 1 1476 . 10 1 1 A 126 126 SER H H 126 8.618 7.834 0.784 1 1 1477 . 10 1 1 A 126 126 SER HA H 126 4.614 3.998 0.616 1 1 1480 . 10 1 1 A 126 126 SER CA C 126 58.730 59.643 -0.913 1 1 1481 . 10 1 1 A 126 126 SER CB C 126 64.367 32.352 32.015 1 1 1482 . 10 1 1 A 126 126 SER N N 126 118.602 118.812 -0.210 1 1 1483 . 10 1 1 A 127 127 SER HA H 127 4.530 3.786 0.744 1 1 1486 . 10 1 1 A 127 127 SER CA C 127 58.954 65.697 -6.743 1 1 1487 . 10 1 1 A 127 127 SER CB C 127 64.379 31.480 32.899 1 1 1488 . 10 1 1 A 128 128 ALA H H 128 8.345 8.036 0.309 1 1 1489 . 10 1 1 A 128 128 ALA HA H 128 4.432 3.956 0.476 1 1 1493 . 10 1 1 A 128 128 ALA CA C 128 52.963 59.206 -6.243 1 1 1494 . 10 1 1 A 128 128 ALA CB C 128 19.924 29.806 -9.882 1 1 1495 . 10 1 1 A 128 128 ALA N N 128 126.185 122.145 4.040 1 1 1496 . 10 1 1 A 129 129 GLU H H 129 8.329 7.942 0.387 1 1 1497 . 10 1 1 A 129 129 GLU HA H 129 4.353 4.089 0.264 1 1 1502 . 10 1 1 A 129 129 GLU CA C 129 57.111 58.650 -1.539 1 1 1503 . 10 1 1 A 129 129 GLU CB C 129 30.949 28.595 2.354 1 1 1504 . 10 1 1 A 129 129 GLU N N 129 120.842 118.626 2.216 1 1 1505 . 10 1 1 A 130 130 LYS H H 130 7.947 8.019 -0.072 1 1 1506 . 10 1 1 A 130 130 LYS HA H 130 3.835 4.043 -0.208 1 1 1515 . 10 1 1 A 130 130 LYS CA C 130 57.756 59.714 -1.958 1 1 1516 . 10 1 1 A 130 130 LYS CB C 130 33.156 32.069 1.087 1 1 826 . 11 1 1 A 70 70 GLY H H 70 9.295 8.393 0.902 1 1 829 . 11 1 1 A 70 70 GLY CA C 70 46.552 59.751 -13.199 1 1 830 . 11 1 1 A 70 70 GLY N N 70 108.643 117.158 -8.515 1 1 832 . 11 1 1 A 71 71 VAL HA H 71 3.538 4.822 -1.284 1 1 840 . 11 1 1 A 71 71 VAL CA C 71 65.623 62.793 2.830 1 1 841 . 11 1 1 A 71 71 VAL CB C 71 30.251 31.968 -1.717 1 1 844 . 11 1 1 A 71 71 VAL N N 71 110.808 136.642 -25.834 1 1 845 . 11 1 1 A 72 72 CYS H H 72 8.022 8.926 -0.904 1 1 846 . 11 1 1 A 72 72 CYS HA H 72 3.469 5.120 -1.651 1 1 849 . 11 1 1 A 72 72 CYS CA C 72 62.733 57.364 5.369 1 1 850 . 11 1 1 A 72 72 CYS CB C 72 27.163 64.430 -37.267 1 1 851 . 11 1 1 A 72 72 CYS N N 72 109.483 119.063 -9.580 1 1 852 . 11 1 1 A 73 73 SER H H 73 7.996 8.168 -0.172 1 1 853 . 11 1 1 A 73 73 SER HA H 73 4.439 4.074 0.365 1 1 856 . 11 1 1 A 73 73 SER CA C 73 62.145 59.293 2.852 1 1 857 . 11 1 1 A 73 73 SER CB C 73 66.013 29.532 36.481 1 1 858 . 11 1 1 A 73 73 SER N N 73 118.630 122.264 -3.634 1 1 859 . 11 1 1 A 74 74 LYS H H 74 10.186 7.919 2.267 1 1 860 . 11 1 1 A 74 74 LYS HA H 74 4.172 3.941 0.231 1 1 867 . 11 1 1 A 74 74 LYS CA C 74 59.848 58.350 1.498 1 1 868 . 11 1 1 A 74 74 LYS CB C 74 34.278 41.440 -7.162 1 1 870 . 11 1 1 A 74 74 LYS N N 74 123.341 119.498 3.843 1 1 871 . 11 1 1 A 75 75 ASP H H 75 7.542 8.225 -0.683 1 1 872 . 11 1 1 A 75 75 ASP HA H 75 3.538 4.123 -0.585 1 1 875 . 11 1 1 A 75 75 ASP CA C 75 52.472 59.249 -6.777 1 1 876 . 11 1 1 A 75 75 ASP CB C 75 42.360 29.206 13.154 1 1 877 . 11 1 1 A 75 75 ASP N N 75 112.035 119.445 -7.410 1 1 878 . 11 1 1 A 76 76 VAL H H 76 8.128 7.936 0.192 1 1 879 . 11 1 1 A 76 76 VAL HA H 76 4.106 3.986 0.120 1 1 887 . 11 1 1 A 76 76 VAL CA C 76 65.179 59.051 6.128 1 1 888 . 11 1 1 A 76 76 VAL CB C 76 32.174 29.155 3.019 1 1 891 . 11 1 1 A 76 76 VAL N N 76 117.992 119.836 -1.844 1 1 892 . 11 1 1 A 77 77 TRP H H 77 6.869 8.040 -1.171 1 1 893 . 11 1 1 A 77 77 TRP HA H 77 4.509 4.101 0.408 1 1 899 . 11 1 1 A 77 77 TRP CA C 77 59.207 57.718 1.489 1 1 900 . 11 1 1 A 77 77 TRP CB C 77 28.941 41.515 -12.574 1 1 901 . 11 1 1 A 77 77 TRP N N 77 123.077 121.461 1.616 1 1 903 . 11 1 1 A 78 78 GLU H H 78 8.593 8.392 0.201 1 1 904 . 11 1 1 A 78 78 GLU HA H 78 4.318 3.894 0.424 1 1 909 . 11 1 1 A 78 78 GLU CA C 78 60.038 59.075 0.963 1 1 910 . 11 1 1 A 78 78 GLU CB C 78 31.178 28.307 2.871 1 1 912 . 11 1 1 A 78 78 GLU N N 78 121.505 117.751 3.754 1 1 913 . 11 1 1 A 79 79 PHE H H 79 8.071 8.083 -0.012 1 1 914 . 11 1 1 A 79 79 PHE HA H 79 4.986 4.062 0.924 1 1 919 . 11 1 1 A 79 79 PHE CA C 79 58.749 58.826 -0.077 1 1 920 . 11 1 1 A 79 79 PHE CB C 79 39.732 29.015 10.717 1 1 921 . 11 1 1 A 79 79 PHE N N 79 118.384 118.132 0.252 1 1 922 . 11 1 1 A 80 80 LEU H H 80 9.309 7.933 1.376 1 1 923 . 11 1 1 A 80 80 LEU HA H 80 3.970 4.446 -0.476 1 1 933 . 11 1 1 A 80 80 LEU CA C 80 59.307 56.422 2.885 1 1 934 . 11 1 1 A 80 80 LEU CB C 80 43.257 38.228 5.029 1 1 937 . 11 1 1 A 80 80 LEU N N 80 122.915 118.369 4.546 1 1 938 . 11 1 1 A 81 81 GLU H H 81 8.282 8.056 0.226 1 1 939 . 11 1 1 A 81 81 GLU HA H 81 3.832 3.593 0.239 1 1 944 . 11 1 1 A 81 81 GLU CA C 81 62.069 65.140 -3.071 1 1 945 . 11 1 1 A 81 81 GLU CB C 81 30.249 38.156 -7.907 1 1 947 . 11 1 1 A 81 81 GLU N N 81 119.345 120.337 -0.992 1 1 948 . 11 1 1 A 82 82 LEU H H 82 8.236 7.895 0.341 1 1 949 . 11 1 1 A 82 82 LEU HA H 82 4.187 4.393 -0.206 1 1 959 . 11 1 1 A 82 82 LEU CA C 82 58.348 58.877 -0.529 1 1 960 . 11 1 1 A 82 82 LEU CB C 82 42.827 31.889 10.938 1 1 963 . 11 1 1 A 82 82 LEU N N 82 120.013 119.361 0.652 1 1 964 . 11 1 1 A 83 83 GLN H H 83 7.949 8.135 -0.186 1 1 965 . 11 1 1 A 83 83 GLN HA H 83 3.812 3.955 -0.143 1 1 968 . 11 1 1 A 83 83 GLN CA C 83 60.248 57.958 2.290 1 1 969 . 11 1 1 A 83 83 GLN CB C 83 33.537 41.668 -8.131 1 1 970 . 11 1 1 A 83 83 GLN N N 83 116.443 120.838 -4.395 1 1 971 . 11 1 1 A 84 84 ILE H H 84 8.407 7.902 0.505 1 1 972 . 11 1 1 A 84 84 ILE HA H 84 3.644 4.271 -0.627 1 1 982 . 11 1 1 A 84 84 ILE CA C 84 67.288 58.911 8.377 1 1 983 . 11 1 1 A 84 84 ILE CB C 84 38.305 30.307 7.998 1 1 987 . 11 1 1 A 84 84 ILE N N 84 120.422 117.362 3.060 1 1 988 . 11 1 1 A 85 85 GLU H H 85 7.741 8.015 -0.274 1 1 989 . 11 1 1 A 85 85 GLU HA H 85 3.811 4.998 -1.187 1 1 994 . 11 1 1 A 85 85 GLU CA C 85 59.862 52.547 7.315 1 1 995 . 11 1 1 A 85 85 GLU CB C 85 30.360 45.487 -15.127 1 1 997 . 11 1 1 A 85 85 GLU N N 85 115.705 116.426 -0.721 1 1 998 . 11 1 1 A 86 86 GLU H H 86 7.818 8.630 -0.812 1 1 999 . 11 1 1 A 86 86 GLU HA H 86 4.274 4.706 -0.432 1 1 1004 . 11 1 1 A 86 86 GLU CA C 86 58.068 55.595 2.473 1 1 1005 . 11 1 1 A 86 86 GLU CB C 86 31.424 33.812 -2.388 1 1 1007 . 11 1 1 A 86 86 GLU N N 86 114.297 118.380 -4.083 1 1 1008 . 11 1 1 A 87 87 ILE H H 87 8.753 8.474 0.279 1 1 1019 . 11 1 1 A 87 87 ILE CA C 87 62.660 44.759 17.901 1 1 1024 . 11 1 1 A 87 87 ILE N N 87 118.890 109.370 9.520 1 1 1025 . 11 1 1 A 88 88 TYR H H 88 8.059 8.800 -0.741 1 1 1026 . 11 1 1 A 88 88 TYR HA H 88 5.447 4.153 1.294 1 1 1033 . 11 1 1 A 88 88 TYR CA C 88 55.285 58.465 -3.180 1 1 1034 . 11 1 1 A 88 88 TYR CB C 88 40.687 32.087 8.600 1 1 1035 . 11 1 1 A 88 88 TYR N N 88 119.252 124.895 -5.643 1 1 1036 . 11 1 1 A 89 89 PRO HA H 89 4.410 4.074 0.336 1 1 1043 . 11 1 1 A 89 89 PRO CA C 89 66.374 59.235 7.139 1 1 1044 . 11 1 1 A 89 89 PRO CB C 89 31.377 29.278 2.099 1 1 1047 . 11 1 1 A 90 90 GLU H H 90 9.234 8.206 1.028 1 1 1048 . 11 1 1 A 90 90 GLU HA H 90 4.379 4.025 0.354 1 1 1053 . 11 1 1 A 90 90 GLU CA C 90 59.098 58.724 0.374 1 1 1054 . 11 1 1 A 90 90 GLU CB C 90 29.461 28.120 1.341 1 1 1056 . 11 1 1 A 90 90 GLU N N 90 117.574 118.153 -0.579 1 1 1057 . 11 1 1 A 91 91 GLU H H 91 7.966 8.132 -0.166 1 1 1058 . 11 1 1 A 91 91 GLU HA H 91 4.890 4.047 0.843 1 1 1063 . 11 1 1 A 91 91 GLU CA C 91 55.324 59.043 -3.719 1 1 1064 . 11 1 1 A 91 91 GLU CB C 91 31.590 29.304 2.286 1 1 1066 . 11 1 1 A 91 91 GLU N N 91 119.310 119.593 -0.283 1 1 1067 . 11 1 1 A 92 92 GLU H H 92 7.263 7.860 -0.597 1 1 1068 . 11 1 1 A 92 92 GLU HA H 92 3.789 3.978 -0.189 1 1 1073 . 11 1 1 A 92 92 GLU CA C 92 60.628 57.943 2.685 1 1 1074 . 11 1 1 A 92 92 GLU CB C 92 30.531 41.560 -11.029 1 1 1076 . 11 1 1 A 92 92 GLU N N 92 121.332 120.508 0.824 1 1 1077 . 11 1 1 A 93 93 GLU H H 93 8.646 7.885 0.761 1 1 1078 . 11 1 1 A 93 93 GLU HA H 93 4.127 4.086 0.041 1 1 1083 . 11 1 1 A 93 93 GLU CA C 93 60.528 55.388 5.140 1 1 1084 . 11 1 1 A 93 93 GLU CB C 93 29.744 18.246 11.498 1 1 1086 . 11 1 1 A 93 93 GLU N N 93 118.207 121.370 -3.163 1 1 1087 . 11 1 1 A 94 94 ILE H H 94 7.766 8.305 -0.539 1 1 1088 . 11 1 1 A 94 94 ILE HA H 94 3.976 3.917 0.059 1 1 1098 . 11 1 1 A 94 94 ILE CA C 94 64.361 58.155 6.206 1 1 1099 . 11 1 1 A 94 94 ILE CB C 94 38.921 41.398 -2.477 1 1 1103 . 11 1 1 A 94 94 ILE N N 94 119.072 118.151 0.921 1 1 1104 . 11 1 1 A 95 95 LEU H H 95 8.340 8.082 0.258 1 1 1105 . 11 1 1 A 95 95 LEU HA H 95 4.300 4.128 0.172 1 1 1115 . 11 1 1 A 95 95 LEU CA C 95 57.905 59.498 -1.593 1 1 1116 . 11 1 1 A 95 95 LEU CB C 95 42.144 29.227 12.917 1 1 1119 . 11 1 1 A 95 95 LEU N N 95 121.325 117.764 3.561 1 1 1120 . 11 1 1 A 96 96 LYS H H 96 8.899 8.025 0.874 1 1 1121 . 11 1 1 A 96 96 LYS HA H 96 4.075 4.024 0.051 1 1 1126 . 11 1 1 A 96 96 LYS CA C 96 61.707 57.936 3.771 1 1 1127 . 11 1 1 A 96 96 LYS CB C 96 32.910 41.685 -8.775 1 1 1128 . 11 1 1 A 96 96 LYS N N 96 120.018 122.089 -2.071 1 1 1129 . 11 1 1 A 97 97 LYS H H 97 7.808 8.031 -0.223 1 1 1130 . 11 1 1 A 97 97 LYS HA H 97 4.045 4.306 -0.261 1 1 1139 . 11 1 1 A 97 97 LYS CA C 97 60.198 56.211 3.987 1 1 1140 . 11 1 1 A 97 97 LYS CB C 97 32.600 41.219 -8.619 1 1 1143 . 11 1 1 A 97 97 LYS N N 97 121.016 115.579 5.437 1 1 1144 . 11 1 1 A 98 98 ALA H H 98 7.814 8.274 -0.460 1 1 1145 . 11 1 1 A 98 98 ALA HA H 98 4.320 4.691 -0.371 1 1 1149 . 11 1 1 A 98 98 ALA CA C 98 55.260 54.480 0.780 1 1 1150 . 11 1 1 A 98 98 ALA CB C 98 19.468 39.424 -19.956 1 1 1151 . 11 1 1 A 98 98 ALA N N 98 122.102 116.770 5.332 1 1 1152 . 11 1 1 A 99 99 LEU H H 99 8.212 7.800 0.412 1 1 1153 . 11 1 1 A 99 99 LEU HA H 99 4.187 4.780 -0.593 1 1 1160 . 11 1 1 A 99 99 LEU CA C 99 58.398 56.630 1.768 1 1 1161 . 11 1 1 A 99 99 LEU CB C 99 42.720 36.771 5.949 1 1 1164 . 11 1 1 A 99 99 LEU N N 99 118.467 115.627 2.840 1 1 1165 . 11 1 1 A 100 100 ARG H H 100 7.738 7.538 0.200 1 1 1166 . 11 1 1 A 100 100 ARG HA H 100 3.894 5.212 -1.318 1 1 1173 . 11 1 1 A 100 100 ARG CA C 100 60.135 52.837 7.298 1 1 1174 . 11 1 1 A 100 100 ARG CB C 100 30.187 45.792 -15.605 1 1 1177 . 11 1 1 A 100 100 ARG N N 100 119.100 117.860 1.240 1 1 1178 . 11 1 1 A 101 101 ASP H H 101 8.186 8.048 0.138 1 1 1179 . 11 1 1 A 101 101 ASP HA H 101 4.424 4.984 -0.560 1 1 1182 . 11 1 1 A 101 101 ASP CA C 101 57.902 51.736 6.166 1 1 1183 . 11 1 1 A 101 101 ASP CB C 101 40.033 40.673 -0.640 1 1 1184 . 11 1 1 A 101 101 ASP N N 101 121.899 116.952 4.947 1 1 1185 . 11 1 1 A 102 102 LEU H H 102 8.730 8.853 -0.123 1 1 1186 . 11 1 1 A 102 102 LEU HA H 102 4.373 4.256 0.117 1 1 1195 . 11 1 1 A 102 102 LEU CA C 102 58.218 57.659 0.559 1 1 1196 . 11 1 1 A 102 102 LEU CB C 102 42.839 29.633 13.206 1 1 1199 . 11 1 1 A 102 102 LEU N N 102 124.505 121.981 2.524 1 1 1200 . 11 1 1 A 103 103 LYS HA H 103 3.726 4.352 -0.626 1 1 1209 . 11 1 1 A 103 103 LYS CA C 103 59.760 56.126 3.634 1 1 1210 . 11 1 1 A 103 103 LYS CB C 103 32.822 33.002 -0.180 1 1 1214 . 11 1 1 A 104 104 ARG H H 104 7.409 8.012 -0.603 1 1 1222 . 11 1 1 A 104 104 ARG CA C 104 56.298 45.279 11.019 1 1 1226 . 11 1 1 A 104 104 ARG N N 104 115.912 106.132 9.780 1 1 1227 . 11 1 1 A 105 105 GLY H H 105 8.046 7.725 0.321 1 1 1230 . 11 1 1 A 105 105 GLY CA C 105 46.309 55.285 -8.976 1 1 1231 . 11 1 1 A 105 105 GLY N N 105 108.860 115.837 -6.977 1 1 1232 . 11 1 1 A 106 106 LYS H H 106 8.033 8.388 -0.355 1 1 1233 . 11 1 1 A 106 106 LYS HA H 106 4.394 4.220 0.174 1 1 1242 . 11 1 1 A 106 106 LYS CA C 106 55.822 55.060 0.762 1 1 1243 . 11 1 1 A 106 106 LYS CB C 106 33.449 43.014 -9.565 1 1 1246 . 11 1 1 A 106 106 LYS N N 106 121.082 118.906 2.176 1 1 1247 . 11 1 1 A 107 107 LYS H H 107 8.271 8.602 -0.331 1 1 1248 . 11 1 1 A 107 107 LYS HA H 107 4.329 4.484 -0.155 1 1 1255 . 11 1 1 A 107 107 LYS CA C 107 56.673 58.956 -2.283 1 1 1256 . 11 1 1 A 107 107 LYS CB C 107 33.341 64.411 -31.070 1 1 1258 . 11 1 1 A 107 107 LYS N N 107 121.869 114.337 7.532 1 1 1259 . 11 1 1 A 108 108 LEU H H 108 8.481 7.437 1.044 1 1 1260 . 11 1 1 A 108 108 LEU HA H 108 4.637 4.985 -0.348 1 1 1269 . 11 1 1 A 108 108 LEU CA C 108 53.819 54.551 -0.732 1 1 1270 . 11 1 1 A 108 108 LEU CB C 108 45.135 35.796 9.339 1 1 1272 . 11 1 1 A 108 108 LEU N N 108 124.360 117.353 7.007 1 1 1273 . 11 1 1 A 109 109 LYS H H 109 8.657 9.100 -0.443 1 1 1274 . 11 1 1 A 109 109 LYS HA H 109 4.565 4.593 -0.028 1 1 1283 . 11 1 1 A 109 109 LYS CA C 109 55.511 57.753 -2.242 1 1 1284 . 11 1 1 A 109 109 LYS CB C 109 32.029 65.181 -33.152 1 1 1287 . 11 1 1 A 109 109 LYS N N 109 123.165 115.846 7.319 1 1 1288 . 11 1 1 A 110 110 PRO HA H 110 4.232 3.611 0.621 1 1 1295 . 11 1 1 A 110 110 PRO CA C 110 66.732 66.488 0.244 1 1 1296 . 11 1 1 A 110 110 PRO CB C 110 32.481 31.450 1.031 1 1 1299 . 11 1 1 A 111 111 GLU HA H 111 4.221 3.873 0.348 1 1 1304 . 11 1 1 A 111 111 GLU CA C 111 59.819 59.831 -0.012 1 1 1305 . 11 1 1 A 111 111 GLU CB C 111 29.250 29.128 0.122 1 1 1307 . 11 1 1 A 112 112 ILE H H 112 7.233 7.713 -0.480 1 1 1308 . 11 1 1 A 112 112 ILE HA H 112 3.848 4.076 -0.228 1 1 1318 . 11 1 1 A 112 112 ILE CA C 112 62.635 59.260 3.375 1 1 1319 . 11 1 1 A 112 112 ILE CB C 112 37.159 29.294 7.865 1 1 1323 . 11 1 1 A 112 112 ILE N N 112 120.783 118.195 2.588 1 1 1324 . 11 1 1 A 113 113 LYS H H 113 8.268 8.020 0.248 1 1 1325 . 11 1 1 A 113 113 LYS HA H 113 3.849 3.676 0.173 1 1 1328 . 11 1 1 A 113 113 LYS CA C 113 60.248 65.236 -4.988 1 1 1329 . 11 1 1 A 113 113 LYS CB C 113 32.668 37.501 -4.833 1 1 1330 . 11 1 1 A 113 113 LYS N N 113 121.680 121.664 0.016 1 1 1331 . 11 1 1 A 114 114 GLY H H 114 8.460 8.373 0.087 1 1 1334 . 11 1 1 A 114 114 GLY CA C 114 47.600 61.099 -13.499 1 1 1335 . 11 1 1 A 114 114 GLY N N 114 105.413 116.492 -11.079 1 1 1336 . 11 1 1 A 115 115 LYS H H 115 7.352 7.576 -0.224 1 1 1337 . 11 1 1 A 115 115 LYS HA H 115 4.189 4.503 -0.314 1 1 1346 . 11 1 1 A 115 115 LYS CA C 115 59.689 57.093 2.596 1 1 1347 . 11 1 1 A 115 115 LYS CB C 115 33.428 41.076 -7.648 1 1 1351 . 11 1 1 A 115 115 LYS N N 115 121.599 121.272 0.327 1 1 1352 . 11 1 1 A 116 116 LEU H H 116 8.046 8.186 -0.140 1 1 1353 . 11 1 1 A 116 116 LEU HA H 116 4.153 3.867 0.286 1 1 1363 . 11 1 1 A 116 116 LEU CA C 116 57.698 64.862 -7.164 1 1 1364 . 11 1 1 A 116 116 LEU CB C 116 42.070 31.582 10.488 1 1 1366 . 11 1 1 A 116 116 LEU N N 116 118.827 119.116 -0.289 1 1 1367 . 11 1 1 A 117 117 SER H H 117 8.321 7.511 0.810 1 1 1368 . 11 1 1 A 117 117 SER HA H 117 4.334 4.211 0.123 1 1 1371 . 11 1 1 A 117 117 SER CA C 117 61.467 54.173 7.294 1 1 1372 . 11 1 1 A 117 117 SER CB C 117 63.613 41.692 21.921 1 1 1373 . 11 1 1 A 117 117 SER N N 117 114.829 115.853 -1.024 1 1 1374 . 11 1 1 A 118 118 ARG H H 118 7.001 7.812 -0.811 1 1 1375 . 11 1 1 A 118 118 ARG HA H 118 4.403 3.853 0.550 1 1 1382 . 11 1 1 A 118 118 ARG CA C 118 56.734 56.996 -0.262 1 1 1383 . 11 1 1 A 118 118 ARG CB C 118 31.115 27.269 3.846 1 1 1385 . 11 1 1 A 118 118 ARG N N 118 118.114 114.194 3.920 1 1 1386 . 11 1 1 A 119 119 LEU H H 119 7.365 8.248 -0.883 1 1 1387 . 11 1 1 A 119 119 LEU HA H 119 4.253 4.902 -0.649 1 1 1397 . 11 1 1 A 119 119 LEU CA C 119 54.639 58.077 -3.438 1 1 1398 . 11 1 1 A 119 119 LEU CB C 119 41.700 31.874 9.826 1 1 1401 . 11 1 1 A 119 119 LEU N N 119 119.181 117.288 1.893 1 1 1402 . 11 1 1 A 120 120 ARG H H 120 8.766 8.848 -0.082 1 1 1403 . 11 1 1 A 120 120 ARG HA H 120 4.374 4.485 -0.111 1 1 1410 . 11 1 1 A 120 120 ARG CA C 120 56.426 58.609 -2.183 1 1 1411 . 11 1 1 A 120 120 ARG CB C 120 32.414 64.000 -31.586 1 1 1414 . 11 1 1 A 120 120 ARG N N 120 122.099 119.352 2.747 1 1 1415 . 11 1 1 A 121 121 LEU H H 121 8.312 8.754 -0.442 1 1 1416 . 11 1 1 A 121 121 LEU HA H 121 4.407 3.561 0.846 1 1 1426 . 11 1 1 A 121 121 LEU CA C 121 56.028 66.964 -10.936 1 1 1427 . 11 1 1 A 121 121 LEU CB C 121 43.122 32.037 11.085 1 1 1430 . 11 1 1 A 121 121 LEU N N 121 118.761 124.211 -5.450 1 1 1431 . 11 1 1 A 122 122 PHE H H 122 7.143 8.347 -1.204 1 1 1432 . 11 1 1 A 122 122 PHE HA H 122 5.201 4.086 1.115 1 1 1439 . 11 1 1 A 122 122 PHE CA C 122 53.047 59.235 -6.188 1 1 1440 . 11 1 1 A 122 122 PHE CB C 122 40.844 29.346 11.498 1 1 1441 . 11 1 1 A 122 122 PHE N N 122 112.750 120.035 -7.285 1 1 1442 . 11 1 1 A 123 123 PRO HA H 123 3.908 3.983 -0.075 1 1 1449 . 11 1 1 A 123 123 PRO CA C 123 65.478 59.152 6.326 1 1 1450 . 11 1 1 A 123 123 PRO CB C 123 33.248 29.310 3.938 1 1 1452 . 11 1 1 A 124 124 LEU H H 124 7.208 7.914 -0.706 1 1 1453 . 11 1 1 A 124 124 LEU HA H 124 4.673 4.076 0.597 1 1 1463 . 11 1 1 A 124 124 LEU CA C 124 53.307 57.653 -4.346 1 1 1464 . 11 1 1 A 124 124 LEU CB C 124 42.853 41.556 1.297 1 1 1468 . 11 1 1 A 124 124 LEU N N 124 113.875 121.444 -7.569 1 1 1469 . 11 1 1 A 125 125 SER H H 125 8.990 8.041 0.949 1 1 1470 . 11 1 1 A 125 125 SER HA H 125 4.533 4.007 0.526 1 1 1473 . 11 1 1 A 125 125 SER CA C 125 59.198 59.527 -0.329 1 1 1474 . 11 1 1 A 125 125 SER CB C 125 64.578 29.589 34.989 1 1 1475 . 11 1 1 A 125 125 SER N N 125 117.894 119.709 -1.815 1 1 1476 . 11 1 1 A 126 126 SER H H 126 8.618 7.815 0.803 1 1 1477 . 11 1 1 A 126 126 SER HA H 126 4.614 3.989 0.625 1 1 1480 . 11 1 1 A 126 126 SER CA C 126 58.730 59.718 -0.988 1 1 1481 . 11 1 1 A 126 126 SER CB C 126 64.367 32.336 32.031 1 1 1482 . 11 1 1 A 126 126 SER N N 126 118.602 118.832 -0.230 1 1 1483 . 11 1 1 A 127 127 SER HA H 127 4.530 3.778 0.752 1 1 1486 . 11 1 1 A 127 127 SER CA C 127 58.954 65.767 -6.813 1 1 1487 . 11 1 1 A 127 127 SER CB C 127 64.379 31.464 32.915 1 1 1488 . 11 1 1 A 128 128 ALA H H 128 8.345 8.126 0.219 1 1 1489 . 11 1 1 A 128 128 ALA HA H 128 4.432 3.964 0.468 1 1 1493 . 11 1 1 A 128 128 ALA CA C 128 52.963 59.162 -6.199 1 1 1494 . 11 1 1 A 128 128 ALA CB C 128 19.924 29.734 -9.810 1 1 1495 . 11 1 1 A 128 128 ALA N N 128 126.185 122.133 4.052 1 1 1496 . 11 1 1 A 129 129 GLU H H 129 8.329 7.950 0.379 1 1 1497 . 11 1 1 A 129 129 GLU HA H 129 4.353 4.081 0.272 1 1 1502 . 11 1 1 A 129 129 GLU CA C 129 57.111 58.638 -1.527 1 1 1503 . 11 1 1 A 129 129 GLU CB C 129 30.949 28.561 2.388 1 1 1504 . 11 1 1 A 129 129 GLU N N 129 120.842 118.630 2.212 1 1 1505 . 11 1 1 A 130 130 LYS H H 130 7.947 7.982 -0.035 1 1 1506 . 11 1 1 A 130 130 LYS HA H 130 3.835 4.046 -0.211 1 1 1515 . 11 1 1 A 130 130 LYS CA C 130 57.756 59.748 -1.992 1 1 1516 . 11 1 1 A 130 130 LYS CB C 130 33.156 32.083 1.073 1 1 826 . 12 1 1 A 70 70 GLY H H 70 9.295 8.649 0.646 1 1 829 . 12 1 1 A 70 70 GLY CA C 70 46.552 58.102 -11.550 1 1 830 . 12 1 1 A 70 70 GLY N N 70 108.643 118.012 -9.369 1 1 832 . 12 1 1 A 71 71 VAL HA H 71 3.538 4.792 -1.254 1 1 840 . 12 1 1 A 71 71 VAL CA C 71 65.623 62.684 2.939 1 1 841 . 12 1 1 A 71 71 VAL CB C 71 30.251 32.273 -2.022 1 1 844 . 12 1 1 A 71 71 VAL N N 71 110.808 136.593 -25.785 1 1 845 . 12 1 1 A 72 72 CYS H H 72 8.022 8.867 -0.845 1 1 846 . 12 1 1 A 72 72 CYS HA H 72 3.469 4.724 -1.255 1 1 849 . 12 1 1 A 72 72 CYS CA C 72 62.733 58.189 4.544 1 1 850 . 12 1 1 A 72 72 CYS CB C 72 27.163 63.600 -36.437 1 1 851 . 12 1 1 A 72 72 CYS N N 72 109.483 119.210 -9.727 1 1 852 . 12 1 1 A 73 73 SER H H 73 7.996 8.179 -0.183 1 1 853 . 12 1 1 A 73 73 SER HA H 73 4.439 4.046 0.393 1 1 856 . 12 1 1 A 73 73 SER CA C 73 62.145 59.329 2.816 1 1 857 . 12 1 1 A 73 73 SER CB C 73 66.013 29.340 36.673 1 1 858 . 12 1 1 A 73 73 SER N N 73 118.630 122.260 -3.630 1 1 859 . 12 1 1 A 74 74 LYS H H 74 10.186 7.926 2.260 1 1 860 . 12 1 1 A 74 74 LYS HA H 74 4.172 3.983 0.189 1 1 867 . 12 1 1 A 74 74 LYS CA C 74 59.848 58.387 1.461 1 1 868 . 12 1 1 A 74 74 LYS CB C 74 34.278 41.467 -7.189 1 1 870 . 12 1 1 A 74 74 LYS N N 74 123.341 119.515 3.826 1 1 871 . 12 1 1 A 75 75 ASP H H 75 7.542 8.249 -0.707 1 1 872 . 12 1 1 A 75 75 ASP HA H 75 3.538 3.933 -0.395 1 1 875 . 12 1 1 A 75 75 ASP CA C 75 52.472 59.858 -7.386 1 1 876 . 12 1 1 A 75 75 ASP CB C 75 42.360 29.290 13.070 1 1 877 . 12 1 1 A 75 75 ASP N N 75 112.035 119.686 -7.651 1 1 878 . 12 1 1 A 76 76 VAL H H 76 8.128 8.406 -0.278 1 1 879 . 12 1 1 A 76 76 VAL HA H 76 4.106 4.023 0.083 1 1 887 . 12 1 1 A 76 76 VAL CA C 76 65.179 59.148 6.031 1 1 888 . 12 1 1 A 76 76 VAL CB C 76 32.174 29.124 3.050 1 1 891 . 12 1 1 A 76 76 VAL N N 76 117.992 120.555 -2.563 1 1 892 . 12 1 1 A 77 77 TRP H H 77 6.869 7.921 -1.052 1 1 893 . 12 1 1 A 77 77 TRP HA H 77 4.509 4.100 0.409 1 1 899 . 12 1 1 A 77 77 TRP CA C 77 59.207 57.713 1.494 1 1 900 . 12 1 1 A 77 77 TRP CB C 77 28.941 41.366 -12.425 1 1 901 . 12 1 1 A 77 77 TRP N N 77 123.077 121.156 1.921 1 1 903 . 12 1 1 A 78 78 GLU H H 78 8.593 8.422 0.171 1 1 904 . 12 1 1 A 78 78 GLU HA H 78 4.318 3.895 0.423 1 1 909 . 12 1 1 A 78 78 GLU CA C 78 60.038 59.202 0.836 1 1 910 . 12 1 1 A 78 78 GLU CB C 78 31.178 28.322 2.856 1 1 912 . 12 1 1 A 78 78 GLU N N 78 121.505 117.915 3.590 1 1 913 . 12 1 1 A 79 79 PHE H H 79 8.071 8.162 -0.091 1 1 914 . 12 1 1 A 79 79 PHE HA H 79 4.986 4.077 0.909 1 1 919 . 12 1 1 A 79 79 PHE CA C 79 58.749 58.791 -0.042 1 1 920 . 12 1 1 A 79 79 PHE CB C 79 39.732 28.738 10.994 1 1 921 . 12 1 1 A 79 79 PHE N N 79 118.384 118.144 0.240 1 1 922 . 12 1 1 A 80 80 LEU H H 80 9.309 7.851 1.458 1 1 923 . 12 1 1 A 80 80 LEU HA H 80 3.970 4.445 -0.475 1 1 933 . 12 1 1 A 80 80 LEU CA C 80 59.307 56.527 2.780 1 1 934 . 12 1 1 A 80 80 LEU CB C 80 43.257 38.300 4.957 1 1 937 . 12 1 1 A 80 80 LEU N N 80 122.915 118.480 4.435 1 1 938 . 12 1 1 A 81 81 GLU H H 81 8.282 8.014 0.268 1 1 939 . 12 1 1 A 81 81 GLU HA H 81 3.832 3.576 0.256 1 1 944 . 12 1 1 A 81 81 GLU CA C 81 62.069 65.195 -3.126 1 1 945 . 12 1 1 A 81 81 GLU CB C 81 30.249 38.133 -7.884 1 1 947 . 12 1 1 A 81 81 GLU N N 81 119.345 120.512 -1.167 1 1 948 . 12 1 1 A 82 82 LEU H H 82 8.236 7.940 0.296 1 1 949 . 12 1 1 A 82 82 LEU HA H 82 4.187 4.429 -0.242 1 1 959 . 12 1 1 A 82 82 LEU CA C 82 58.348 58.640 -0.292 1 1 960 . 12 1 1 A 82 82 LEU CB C 82 42.827 31.987 10.840 1 1 963 . 12 1 1 A 82 82 LEU N N 82 120.013 119.324 0.689 1 1 964 . 12 1 1 A 83 83 GLN H H 83 7.949 7.894 0.055 1 1 965 . 12 1 1 A 83 83 GLN HA H 83 3.812 3.955 -0.143 1 1 968 . 12 1 1 A 83 83 GLN CA C 83 60.248 58.090 2.158 1 1 969 . 12 1 1 A 83 83 GLN CB C 83 33.537 41.524 -7.987 1 1 970 . 12 1 1 A 83 83 GLN N N 83 116.443 120.404 -3.961 1 1 971 . 12 1 1 A 84 84 ILE H H 84 8.407 8.819 -0.412 1 1 972 . 12 1 1 A 84 84 ILE HA H 84 3.644 4.086 -0.442 1 1 982 . 12 1 1 A 84 84 ILE CA C 84 67.288 58.761 8.527 1 1 983 . 12 1 1 A 84 84 ILE CB C 84 38.305 29.046 9.259 1 1 987 . 12 1 1 A 84 84 ILE N N 84 120.422 117.885 2.537 1 1 988 . 12 1 1 A 85 85 GLU H H 85 7.741 8.191 -0.450 1 1 989 . 12 1 1 A 85 85 GLU HA H 85 3.811 4.944 -1.133 1 1 994 . 12 1 1 A 85 85 GLU CA C 85 59.862 52.900 6.962 1 1 995 . 12 1 1 A 85 85 GLU CB C 85 30.360 46.091 -15.731 1 1 997 . 12 1 1 A 85 85 GLU N N 85 115.705 116.628 -0.923 1 1 998 . 12 1 1 A 86 86 GLU H H 86 7.818 8.703 -0.885 1 1 999 . 12 1 1 A 86 86 GLU HA H 86 4.274 4.698 -0.424 1 1 1004 . 12 1 1 A 86 86 GLU CA C 86 58.068 55.837 2.231 1 1 1005 . 12 1 1 A 86 86 GLU CB C 86 31.424 33.476 -2.052 1 1 1007 . 12 1 1 A 86 86 GLU N N 86 114.297 118.485 -4.188 1 1 1008 . 12 1 1 A 87 87 ILE H H 87 8.753 8.435 0.318 1 1 1019 . 12 1 1 A 87 87 ILE CA C 87 62.660 44.701 17.959 1 1 1024 . 12 1 1 A 87 87 ILE N N 87 118.890 110.213 8.677 1 1 1025 . 12 1 1 A 88 88 TYR H H 88 8.059 8.860 -0.801 1 1 1026 . 12 1 1 A 88 88 TYR HA H 88 5.447 4.166 1.281 1 1 1033 . 12 1 1 A 88 88 TYR CA C 88 55.285 58.203 -2.918 1 1 1034 . 12 1 1 A 88 88 TYR CB C 88 40.687 32.364 8.323 1 1 1035 . 12 1 1 A 88 88 TYR N N 88 119.252 125.582 -6.330 1 1 1036 . 12 1 1 A 89 89 PRO HA H 89 4.410 3.985 0.425 1 1 1043 . 12 1 1 A 89 89 PRO CA C 89 66.374 59.526 6.848 1 1 1044 . 12 1 1 A 89 89 PRO CB C 89 31.377 29.122 2.255 1 1 1047 . 12 1 1 A 90 90 GLU H H 90 9.234 8.307 0.927 1 1 1048 . 12 1 1 A 90 90 GLU HA H 90 4.379 4.007 0.372 1 1 1053 . 12 1 1 A 90 90 GLU CA C 90 59.098 58.663 0.435 1 1 1054 . 12 1 1 A 90 90 GLU CB C 90 29.461 28.276 1.185 1 1 1056 . 12 1 1 A 90 90 GLU N N 90 117.574 118.066 -0.492 1 1 1057 . 12 1 1 A 91 91 GLU H H 91 7.966 8.082 -0.116 1 1 1058 . 12 1 1 A 91 91 GLU HA H 91 4.890 4.078 0.812 1 1 1063 . 12 1 1 A 91 91 GLU CA C 91 55.324 59.014 -3.690 1 1 1064 . 12 1 1 A 91 91 GLU CB C 91 31.590 29.259 2.331 1 1 1066 . 12 1 1 A 91 91 GLU N N 91 119.310 119.999 -0.689 1 1 1067 . 12 1 1 A 92 92 GLU H H 92 7.263 8.121 -0.858 1 1 1068 . 12 1 1 A 92 92 GLU HA H 92 3.789 3.938 -0.149 1 1 1073 . 12 1 1 A 92 92 GLU CA C 92 60.628 57.917 2.711 1 1 1074 . 12 1 1 A 92 92 GLU CB C 92 30.531 41.608 -11.077 1 1 1076 . 12 1 1 A 92 92 GLU N N 92 121.332 120.139 1.193 1 1 1077 . 12 1 1 A 93 93 GLU H H 93 8.646 8.005 0.641 1 1 1078 . 12 1 1 A 93 93 GLU HA H 93 4.127 4.088 0.039 1 1 1083 . 12 1 1 A 93 93 GLU CA C 93 60.528 55.347 5.181 1 1 1084 . 12 1 1 A 93 93 GLU CB C 93 29.744 18.276 11.468 1 1 1086 . 12 1 1 A 93 93 GLU N N 93 118.207 121.679 -3.472 1 1 1087 . 12 1 1 A 94 94 ILE H H 94 7.766 8.265 -0.499 1 1 1088 . 12 1 1 A 94 94 ILE HA H 94 3.976 3.918 0.058 1 1 1098 . 12 1 1 A 94 94 ILE CA C 94 64.361 58.153 6.208 1 1 1099 . 12 1 1 A 94 94 ILE CB C 94 38.921 41.410 -2.489 1 1 1103 . 12 1 1 A 94 94 ILE N N 94 119.072 118.142 0.930 1 1 1104 . 12 1 1 A 95 95 LEU H H 95 8.340 8.048 0.292 1 1 1105 . 12 1 1 A 95 95 LEU HA H 95 4.300 4.142 0.158 1 1 1115 . 12 1 1 A 95 95 LEU CA C 95 57.905 59.492 -1.587 1 1 1116 . 12 1 1 A 95 95 LEU CB C 95 42.144 29.219 12.925 1 1 1119 . 12 1 1 A 95 95 LEU N N 95 121.325 117.773 3.552 1 1 1120 . 12 1 1 A 96 96 LYS H H 96 8.899 7.963 0.936 1 1 1121 . 12 1 1 A 96 96 LYS HA H 96 4.075 4.027 0.048 1 1 1126 . 12 1 1 A 96 96 LYS CA C 96 61.707 57.816 3.891 1 1 1127 . 12 1 1 A 96 96 LYS CB C 96 32.910 41.681 -8.771 1 1 1128 . 12 1 1 A 96 96 LYS N N 96 120.018 122.078 -2.060 1 1 1129 . 12 1 1 A 97 97 LYS H H 97 7.808 8.038 -0.230 1 1 1130 . 12 1 1 A 97 97 LYS HA H 97 4.045 4.326 -0.281 1 1 1139 . 12 1 1 A 97 97 LYS CA C 97 60.198 56.026 4.172 1 1 1140 . 12 1 1 A 97 97 LYS CB C 97 32.600 41.310 -8.710 1 1 1143 . 12 1 1 A 97 97 LYS N N 97 121.016 115.618 5.398 1 1 1144 . 12 1 1 A 98 98 ALA H H 98 7.814 8.281 -0.467 1 1 1145 . 12 1 1 A 98 98 ALA HA H 98 4.320 4.751 -0.431 1 1 1149 . 12 1 1 A 98 98 ALA CA C 98 55.260 54.325 0.935 1 1 1150 . 12 1 1 A 98 98 ALA CB C 98 19.468 39.510 -20.042 1 1 1151 . 12 1 1 A 98 98 ALA N N 98 122.102 116.714 5.388 1 1 1152 . 12 1 1 A 99 99 LEU H H 99 8.212 7.861 0.351 1 1 1153 . 12 1 1 A 99 99 LEU HA H 99 4.187 4.788 -0.601 1 1 1160 . 12 1 1 A 99 99 LEU CA C 99 58.398 57.091 1.307 1 1 1161 . 12 1 1 A 99 99 LEU CB C 99 42.720 37.246 5.474 1 1 1164 . 12 1 1 A 99 99 LEU N N 99 118.467 115.650 2.817 1 1 1165 . 12 1 1 A 100 100 ARG H H 100 7.738 7.415 0.323 1 1 1166 . 12 1 1 A 100 100 ARG HA H 100 3.894 5.169 -1.275 1 1 1173 . 12 1 1 A 100 100 ARG CA C 100 60.135 52.769 7.366 1 1 1174 . 12 1 1 A 100 100 ARG CB C 100 30.187 45.204 -15.017 1 1 1177 . 12 1 1 A 100 100 ARG N N 100 119.100 116.831 2.269 1 1 1178 . 12 1 1 A 101 101 ASP H H 101 8.186 8.499 -0.313 1 1 1179 . 12 1 1 A 101 101 ASP HA H 101 4.424 4.874 -0.450 1 1 1182 . 12 1 1 A 101 101 ASP CA C 101 57.902 51.642 6.260 1 1 1183 . 12 1 1 A 101 101 ASP CB C 101 40.033 40.300 -0.267 1 1 1184 . 12 1 1 A 101 101 ASP N N 101 121.899 117.511 4.388 1 1 1185 . 12 1 1 A 102 102 LEU H H 102 8.730 8.750 -0.020 1 1 1186 . 12 1 1 A 102 102 LEU HA H 102 4.373 4.027 0.346 1 1 1195 . 12 1 1 A 102 102 LEU CA C 102 58.218 57.890 0.328 1 1 1196 . 12 1 1 A 102 102 LEU CB C 102 42.839 29.650 13.189 1 1 1199 . 12 1 1 A 102 102 LEU N N 102 124.505 122.320 2.185 1 1 1200 . 12 1 1 A 103 103 LYS HA H 103 3.726 4.088 -0.362 1 1 1209 . 12 1 1 A 103 103 LYS CA C 103 59.760 55.703 4.057 1 1 1210 . 12 1 1 A 103 103 LYS CB C 103 32.822 32.182 0.640 1 1 1214 . 12 1 1 A 104 104 ARG H H 104 7.409 7.827 -0.418 1 1 1222 . 12 1 1 A 104 104 ARG CA C 104 56.298 45.133 11.165 1 1 1226 . 12 1 1 A 104 104 ARG N N 104 115.912 105.793 10.119 1 1 1227 . 12 1 1 A 105 105 GLY H H 105 8.046 7.128 0.918 1 1 1230 . 12 1 1 A 105 105 GLY CA C 105 46.309 55.440 -9.131 1 1 1231 . 12 1 1 A 105 105 GLY N N 105 108.860 117.378 -8.518 1 1 1232 . 12 1 1 A 106 106 LYS H H 106 8.033 8.401 -0.368 1 1 1233 . 12 1 1 A 106 106 LYS HA H 106 4.394 4.404 -0.010 1 1 1242 . 12 1 1 A 106 106 LYS CA C 106 55.822 55.350 0.472 1 1 1243 . 12 1 1 A 106 106 LYS CB C 106 33.449 42.771 -9.322 1 1 1246 . 12 1 1 A 106 106 LYS N N 106 121.082 117.935 3.147 1 1 1247 . 12 1 1 A 107 107 LYS H H 107 8.271 8.687 -0.416 1 1 1248 . 12 1 1 A 107 107 LYS HA H 107 4.329 4.750 -0.421 1 1 1255 . 12 1 1 A 107 107 LYS CA C 107 56.673 59.270 -2.597 1 1 1256 . 12 1 1 A 107 107 LYS CB C 107 33.341 64.381 -31.040 1 1 1258 . 12 1 1 A 107 107 LYS N N 107 121.869 114.947 6.922 1 1 1259 . 12 1 1 A 108 108 LEU H H 108 8.481 7.493 0.988 1 1 1260 . 12 1 1 A 108 108 LEU HA H 108 4.637 5.014 -0.377 1 1 1269 . 12 1 1 A 108 108 LEU CA C 108 53.819 54.493 -0.674 1 1 1270 . 12 1 1 A 108 108 LEU CB C 108 45.135 35.942 9.193 1 1 1272 . 12 1 1 A 108 108 LEU N N 108 124.360 118.291 6.069 1 1 1273 . 12 1 1 A 109 109 LYS H H 109 8.657 8.893 -0.236 1 1 1274 . 12 1 1 A 109 109 LYS HA H 109 4.565 4.492 0.073 1 1 1283 . 12 1 1 A 109 109 LYS CA C 109 55.511 59.025 -3.514 1 1 1284 . 12 1 1 A 109 109 LYS CB C 109 32.029 64.129 -32.100 1 1 1287 . 12 1 1 A 109 109 LYS N N 109 123.165 117.015 6.150 1 1 1288 . 12 1 1 A 110 110 PRO HA H 110 4.232 3.574 0.658 1 1 1295 . 12 1 1 A 110 110 PRO CA C 110 66.732 66.803 -0.071 1 1 1296 . 12 1 1 A 110 110 PRO CB C 110 32.481 31.585 0.896 1 1 1299 . 12 1 1 A 111 111 GLU HA H 111 4.221 3.918 0.303 1 1 1304 . 12 1 1 A 111 111 GLU CA C 111 59.819 59.887 -0.068 1 1 1305 . 12 1 1 A 111 111 GLU CB C 111 29.250 29.184 0.066 1 1 1307 . 12 1 1 A 112 112 ILE H H 112 7.233 8.164 -0.931 1 1 1308 . 12 1 1 A 112 112 ILE HA H 112 3.848 4.087 -0.239 1 1 1318 . 12 1 1 A 112 112 ILE CA C 112 62.635 59.293 3.342 1 1 1319 . 12 1 1 A 112 112 ILE CB C 112 37.159 29.328 7.831 1 1 1323 . 12 1 1 A 112 112 ILE N N 112 120.783 118.187 2.596 1 1 1324 . 12 1 1 A 113 113 LYS H H 113 8.268 8.072 0.196 1 1 1325 . 12 1 1 A 113 113 LYS HA H 113 3.849 3.744 0.105 1 1 1328 . 12 1 1 A 113 113 LYS CA C 113 60.248 65.297 -5.049 1 1 1329 . 12 1 1 A 113 113 LYS CB C 113 32.668 37.344 -4.676 1 1 1330 . 12 1 1 A 113 113 LYS N N 113 121.680 121.811 -0.131 1 1 1331 . 12 1 1 A 114 114 GLY H H 114 8.460 8.443 0.017 1 1 1334 . 12 1 1 A 114 114 GLY CA C 114 47.600 61.458 -13.858 1 1 1335 . 12 1 1 A 114 114 GLY N N 114 105.413 115.326 -9.913 1 1 1336 . 12 1 1 A 115 115 LYS H H 115 7.352 8.059 -0.707 1 1 1337 . 12 1 1 A 115 115 LYS HA H 115 4.189 4.384 -0.195 1 1 1346 . 12 1 1 A 115 115 LYS CA C 115 59.689 57.247 2.442 1 1 1347 . 12 1 1 A 115 115 LYS CB C 115 33.428 40.233 -6.805 1 1 1351 . 12 1 1 A 115 115 LYS N N 115 121.599 122.539 -0.940 1 1 1352 . 12 1 1 A 116 116 LEU H H 116 8.046 7.757 0.289 1 1 1353 . 12 1 1 A 116 116 LEU HA H 116 4.153 3.781 0.372 1 1 1363 . 12 1 1 A 116 116 LEU CA C 116 57.698 65.495 -7.797 1 1 1364 . 12 1 1 A 116 116 LEU CB C 116 42.070 31.462 10.608 1 1 1366 . 12 1 1 A 116 116 LEU N N 116 118.827 115.103 3.724 1 1 1367 . 12 1 1 A 117 117 SER H H 117 8.321 7.570 0.751 1 1 1368 . 12 1 1 A 117 117 SER HA H 117 4.334 4.215 0.119 1 1 1371 . 12 1 1 A 117 117 SER CA C 117 61.467 54.298 7.169 1 1 1372 . 12 1 1 A 117 117 SER CB C 117 63.613 41.976 21.637 1 1 1373 . 12 1 1 A 117 117 SER N N 117 114.829 118.315 -3.486 1 1 1374 . 12 1 1 A 118 118 ARG H H 118 7.001 7.623 -0.622 1 1 1375 . 12 1 1 A 118 118 ARG HA H 118 4.403 3.858 0.545 1 1 1382 . 12 1 1 A 118 118 ARG CA C 118 56.734 57.038 -0.304 1 1 1383 . 12 1 1 A 118 118 ARG CB C 118 31.115 27.276 3.839 1 1 1385 . 12 1 1 A 118 118 ARG N N 118 118.114 114.287 3.827 1 1 1386 . 12 1 1 A 119 119 LEU H H 119 7.365 8.262 -0.897 1 1 1387 . 12 1 1 A 119 119 LEU HA H 119 4.253 4.881 -0.628 1 1 1397 . 12 1 1 A 119 119 LEU CA C 119 54.639 57.741 -3.102 1 1 1398 . 12 1 1 A 119 119 LEU CB C 119 41.700 31.384 10.316 1 1 1401 . 12 1 1 A 119 119 LEU N N 119 119.181 117.417 1.764 1 1 1402 . 12 1 1 A 120 120 ARG H H 120 8.766 8.644 0.122 1 1 1403 . 12 1 1 A 120 120 ARG HA H 120 4.374 4.455 -0.081 1 1 1410 . 12 1 1 A 120 120 ARG CA C 120 56.426 59.230 -2.804 1 1 1411 . 12 1 1 A 120 120 ARG CB C 120 32.414 63.619 -31.205 1 1 1414 . 12 1 1 A 120 120 ARG N N 120 122.099 119.863 2.236 1 1 1415 . 12 1 1 A 121 121 LEU H H 121 8.312 8.715 -0.403 1 1 1416 . 12 1 1 A 121 121 LEU HA H 121 4.407 3.558 0.849 1 1 1426 . 12 1 1 A 121 121 LEU CA C 121 56.028 66.988 -10.960 1 1 1427 . 12 1 1 A 121 121 LEU CB C 121 43.122 31.966 11.156 1 1 1430 . 12 1 1 A 121 121 LEU N N 121 118.761 124.060 -5.299 1 1 1431 . 12 1 1 A 122 122 PHE H H 122 7.143 8.359 -1.216 1 1 1432 . 12 1 1 A 122 122 PHE HA H 122 5.201 4.073 1.128 1 1 1439 . 12 1 1 A 122 122 PHE CA C 122 53.047 59.248 -6.201 1 1 1440 . 12 1 1 A 122 122 PHE CB C 122 40.844 29.319 11.525 1 1 1441 . 12 1 1 A 122 122 PHE N N 122 112.750 120.108 -7.358 1 1 1442 . 12 1 1 A 123 123 PRO HA H 123 3.908 4.001 -0.093 1 1 1449 . 12 1 1 A 123 123 PRO CA C 123 65.478 59.117 6.361 1 1 1450 . 12 1 1 A 123 123 PRO CB C 123 33.248 29.390 3.858 1 1 1452 . 12 1 1 A 124 124 LEU H H 124 7.208 8.012 -0.804 1 1 1453 . 12 1 1 A 124 124 LEU HA H 124 4.673 4.104 0.569 1 1 1463 . 12 1 1 A 124 124 LEU CA C 124 53.307 57.717 -4.410 1 1 1464 . 12 1 1 A 124 124 LEU CB C 124 42.853 41.593 1.260 1 1 1468 . 12 1 1 A 124 124 LEU N N 124 113.875 120.979 -7.104 1 1 1469 . 12 1 1 A 125 125 SER H H 125 8.990 8.215 0.775 1 1 1470 . 12 1 1 A 125 125 SER HA H 125 4.533 3.923 0.610 1 1 1473 . 12 1 1 A 125 125 SER CA C 125 59.198 59.649 -0.451 1 1 1474 . 12 1 1 A 125 125 SER CB C 125 64.578 29.180 35.398 1 1 1475 . 12 1 1 A 125 125 SER N N 125 117.894 119.712 -1.818 1 1 1476 . 12 1 1 A 126 126 SER H H 126 8.618 7.678 0.940 1 1 1477 . 12 1 1 A 126 126 SER HA H 126 4.614 4.008 0.606 1 1 1480 . 12 1 1 A 126 126 SER CA C 126 58.730 59.362 -0.632 1 1 1481 . 12 1 1 A 126 126 SER CB C 126 64.367 32.228 32.139 1 1 1482 . 12 1 1 A 126 126 SER N N 126 118.602 119.838 -1.236 1 1 1483 . 12 1 1 A 127 127 SER HA H 127 4.530 3.789 0.741 1 1 1486 . 12 1 1 A 127 127 SER CA C 127 58.954 65.608 -6.654 1 1 1487 . 12 1 1 A 127 127 SER CB C 127 64.379 31.575 32.804 1 1 1488 . 12 1 1 A 128 128 ALA H H 128 8.345 8.504 -0.159 1 1 1489 . 12 1 1 A 128 128 ALA HA H 128 4.432 3.990 0.442 1 1 1493 . 12 1 1 A 128 128 ALA CA C 128 52.963 58.693 -5.730 1 1 1494 . 12 1 1 A 128 128 ALA CB C 128 19.924 29.930 -10.006 1 1 1495 . 12 1 1 A 128 128 ALA N N 128 126.185 120.767 5.418 1 1 1496 . 12 1 1 A 129 129 GLU H H 129 8.329 7.699 0.630 1 1 1497 . 12 1 1 A 129 129 GLU HA H 129 4.353 4.055 0.298 1 1 1502 . 12 1 1 A 129 129 GLU CA C 129 57.111 58.644 -1.533 1 1 1503 . 12 1 1 A 129 129 GLU CB C 129 30.949 28.468 2.481 1 1 1504 . 12 1 1 A 129 129 GLU N N 129 120.842 118.712 2.130 1 1 1505 . 12 1 1 A 130 130 LYS H H 130 7.947 8.017 -0.070 1 1 1506 . 12 1 1 A 130 130 LYS HA H 130 3.835 4.024 -0.189 1 1 1515 . 12 1 1 A 130 130 LYS CA C 130 57.756 59.660 -1.904 1 1 1516 . 12 1 1 A 130 130 LYS CB C 130 33.156 32.121 1.035 1 1 826 . 13 1 1 A 70 70 GLY H H 70 9.295 8.188 1.107 1 1 829 . 13 1 1 A 70 70 GLY CA C 70 46.552 58.356 -11.804 1 1 830 . 13 1 1 A 70 70 GLY N N 70 108.643 118.304 -9.661 1 1 832 . 13 1 1 A 71 71 VAL HA H 71 3.538 4.832 -1.294 1 1 840 . 13 1 1 A 71 71 VAL CA C 71 65.623 62.737 2.886 1 1 841 . 13 1 1 A 71 71 VAL CB C 71 30.251 32.069 -1.818 1 1 844 . 13 1 1 A 71 71 VAL N N 71 110.808 136.335 -25.527 1 1 845 . 13 1 1 A 72 72 CYS H H 72 8.022 8.883 -0.861 1 1 846 . 13 1 1 A 72 72 CYS HA H 72 3.469 4.655 -1.186 1 1 849 . 13 1 1 A 72 72 CYS CA C 72 62.733 58.045 4.688 1 1 850 . 13 1 1 A 72 72 CYS CB C 72 27.163 63.539 -36.376 1 1 851 . 13 1 1 A 72 72 CYS N N 72 109.483 119.131 -9.648 1 1 852 . 13 1 1 A 73 73 SER H H 73 7.996 8.417 -0.421 1 1 853 . 13 1 1 A 73 73 SER HA H 73 4.439 4.114 0.325 1 1 856 . 13 1 1 A 73 73 SER CA C 73 62.145 59.356 2.789 1 1 857 . 13 1 1 A 73 73 SER CB C 73 66.013 29.360 36.653 1 1 858 . 13 1 1 A 73 73 SER N N 73 118.630 121.296 -2.666 1 1 859 . 13 1 1 A 74 74 LYS H H 74 10.186 7.955 2.231 1 1 860 . 13 1 1 A 74 74 LYS HA H 74 4.172 3.980 0.192 1 1 867 . 13 1 1 A 74 74 LYS CA C 74 59.848 58.384 1.464 1 1 868 . 13 1 1 A 74 74 LYS CB C 74 34.278 41.454 -7.176 1 1 870 . 13 1 1 A 74 74 LYS N N 74 123.341 117.501 5.840 1 1 871 . 13 1 1 A 75 75 ASP H H 75 7.542 8.211 -0.669 1 1 872 . 13 1 1 A 75 75 ASP HA H 75 3.538 3.939 -0.401 1 1 875 . 13 1 1 A 75 75 ASP CA C 75 52.472 59.919 -7.447 1 1 876 . 13 1 1 A 75 75 ASP CB C 75 42.360 29.257 13.103 1 1 877 . 13 1 1 A 75 75 ASP N N 75 112.035 119.592 -7.557 1 1 878 . 13 1 1 A 76 76 VAL H H 76 8.128 8.365 -0.237 1 1 879 . 13 1 1 A 76 76 VAL HA H 76 4.106 4.026 0.080 1 1 887 . 13 1 1 A 76 76 VAL CA C 76 65.179 59.178 6.001 1 1 888 . 13 1 1 A 76 76 VAL CB C 76 32.174 29.158 3.016 1 1 891 . 13 1 1 A 76 76 VAL N N 76 117.992 120.695 -2.703 1 1 892 . 13 1 1 A 77 77 TRP H H 77 6.869 7.977 -1.108 1 1 893 . 13 1 1 A 77 77 TRP HA H 77 4.509 4.102 0.407 1 1 899 . 13 1 1 A 77 77 TRP CA C 77 59.207 57.762 1.445 1 1 900 . 13 1 1 A 77 77 TRP CB C 77 28.941 41.404 -12.463 1 1 901 . 13 1 1 A 77 77 TRP N N 77 123.077 121.302 1.775 1 1 903 . 13 1 1 A 78 78 GLU H H 78 8.593 8.388 0.205 1 1 904 . 13 1 1 A 78 78 GLU HA H 78 4.318 3.890 0.428 1 1 909 . 13 1 1 A 78 78 GLU CA C 78 60.038 59.232 0.806 1 1 910 . 13 1 1 A 78 78 GLU CB C 78 31.178 28.294 2.884 1 1 912 . 13 1 1 A 78 78 GLU N N 78 121.505 117.679 3.826 1 1 913 . 13 1 1 A 79 79 PHE H H 79 8.071 8.151 -0.080 1 1 914 . 13 1 1 A 79 79 PHE HA H 79 4.986 4.068 0.918 1 1 919 . 13 1 1 A 79 79 PHE CA C 79 58.749 58.761 -0.012 1 1 920 . 13 1 1 A 79 79 PHE CB C 79 39.732 28.965 10.767 1 1 921 . 13 1 1 A 79 79 PHE N N 79 118.384 118.127 0.257 1 1 922 . 13 1 1 A 80 80 LEU H H 80 9.309 7.864 1.445 1 1 923 . 13 1 1 A 80 80 LEU HA H 80 3.970 4.441 -0.471 1 1 933 . 13 1 1 A 80 80 LEU CA C 80 59.307 56.429 2.878 1 1 934 . 13 1 1 A 80 80 LEU CB C 80 43.257 38.227 5.030 1 1 937 . 13 1 1 A 80 80 LEU N N 80 122.915 118.375 4.540 1 1 938 . 13 1 1 A 81 81 GLU H H 81 8.282 8.036 0.246 1 1 939 . 13 1 1 A 81 81 GLU HA H 81 3.832 3.553 0.279 1 1 944 . 13 1 1 A 81 81 GLU CA C 81 62.069 65.299 -3.230 1 1 945 . 13 1 1 A 81 81 GLU CB C 81 30.249 38.109 -7.860 1 1 947 . 13 1 1 A 81 81 GLU N N 81 119.345 120.429 -1.084 1 1 948 . 13 1 1 A 82 82 LEU H H 82 8.236 7.899 0.337 1 1 949 . 13 1 1 A 82 82 LEU HA H 82 4.187 4.451 -0.264 1 1 959 . 13 1 1 A 82 82 LEU CA C 82 58.348 58.580 -0.232 1 1 960 . 13 1 1 A 82 82 LEU CB C 82 42.827 32.036 10.791 1 1 963 . 13 1 1 A 82 82 LEU N N 82 120.013 119.118 0.895 1 1 964 . 13 1 1 A 83 83 GLN H H 83 7.949 7.892 0.057 1 1 965 . 13 1 1 A 83 83 GLN HA H 83 3.812 4.027 -0.215 1 1 968 . 13 1 1 A 83 83 GLN CA C 83 60.248 58.025 2.223 1 1 969 . 13 1 1 A 83 83 GLN CB C 83 33.537 41.580 -8.043 1 1 970 . 13 1 1 A 83 83 GLN N N 83 116.443 120.306 -3.863 1 1 971 . 13 1 1 A 84 84 ILE H H 84 8.407 8.796 -0.389 1 1 972 . 13 1 1 A 84 84 ILE HA H 84 3.644 4.121 -0.477 1 1 982 . 13 1 1 A 84 84 ILE CA C 84 67.288 58.588 8.700 1 1 983 . 13 1 1 A 84 84 ILE CB C 84 38.305 29.020 9.285 1 1 987 . 13 1 1 A 84 84 ILE N N 84 120.422 117.703 2.719 1 1 988 . 13 1 1 A 85 85 GLU H H 85 7.741 8.252 -0.511 1 1 989 . 13 1 1 A 85 85 GLU HA H 85 3.811 4.928 -1.117 1 1 994 . 13 1 1 A 85 85 GLU CA C 85 59.862 53.077 6.785 1 1 995 . 13 1 1 A 85 85 GLU CB C 85 30.360 46.003 -15.643 1 1 997 . 13 1 1 A 85 85 GLU N N 85 115.705 116.652 -0.947 1 1 998 . 13 1 1 A 86 86 GLU H H 86 7.818 8.702 -0.884 1 1 999 . 13 1 1 A 86 86 GLU HA H 86 4.274 4.697 -0.423 1 1 1004 . 13 1 1 A 86 86 GLU CA C 86 58.068 55.838 2.230 1 1 1005 . 13 1 1 A 86 86 GLU CB C 86 31.424 33.286 -1.862 1 1 1007 . 13 1 1 A 86 86 GLU N N 86 114.297 118.631 -4.334 1 1 1008 . 13 1 1 A 87 87 ILE H H 87 8.753 8.437 0.316 1 1 1019 . 13 1 1 A 87 87 ILE CA C 87 62.660 44.604 18.056 1 1 1024 . 13 1 1 A 87 87 ILE N N 87 118.890 110.042 8.848 1 1 1025 . 13 1 1 A 88 88 TYR H H 88 8.059 8.861 -0.802 1 1 1026 . 13 1 1 A 88 88 TYR HA H 88 5.447 4.176 1.271 1 1 1033 . 13 1 1 A 88 88 TYR CA C 88 55.285 58.204 -2.919 1 1 1034 . 13 1 1 A 88 88 TYR CB C 88 40.687 32.368 8.319 1 1 1035 . 13 1 1 A 88 88 TYR N N 88 119.252 125.567 -6.315 1 1 1036 . 13 1 1 A 89 89 PRO HA H 89 4.410 3.976 0.434 1 1 1043 . 13 1 1 A 89 89 PRO CA C 89 66.374 59.520 6.854 1 1 1044 . 13 1 1 A 89 89 PRO CB C 89 31.377 29.131 2.246 1 1 1047 . 13 1 1 A 90 90 GLU H H 90 9.234 8.247 0.987 1 1 1048 . 13 1 1 A 90 90 GLU HA H 90 4.379 4.008 0.371 1 1 1053 . 13 1 1 A 90 90 GLU CA C 90 59.098 58.715 0.383 1 1 1054 . 13 1 1 A 90 90 GLU CB C 90 29.461 28.154 1.307 1 1 1056 . 13 1 1 A 90 90 GLU N N 90 117.574 118.100 -0.526 1 1 1057 . 13 1 1 A 91 91 GLU H H 91 7.966 8.117 -0.151 1 1 1058 . 13 1 1 A 91 91 GLU HA H 91 4.890 4.078 0.812 1 1 1063 . 13 1 1 A 91 91 GLU CA C 91 55.324 58.953 -3.629 1 1 1064 . 13 1 1 A 91 91 GLU CB C 91 31.590 29.278 2.312 1 1 1066 . 13 1 1 A 91 91 GLU N N 91 119.310 119.740 -0.430 1 1 1067 . 13 1 1 A 92 92 GLU H H 92 7.263 8.219 -0.956 1 1 1068 . 13 1 1 A 92 92 GLU HA H 92 3.789 3.876 -0.087 1 1 1073 . 13 1 1 A 92 92 GLU CA C 92 60.628 57.901 2.727 1 1 1074 . 13 1 1 A 92 92 GLU CB C 92 30.531 41.562 -11.031 1 1 1076 . 13 1 1 A 92 92 GLU N N 92 121.332 120.417 0.915 1 1 1077 . 13 1 1 A 93 93 GLU H H 93 8.646 8.121 0.525 1 1 1078 . 13 1 1 A 93 93 GLU HA H 93 4.127 4.082 0.045 1 1 1083 . 13 1 1 A 93 93 GLU CA C 93 60.528 55.398 5.130 1 1 1084 . 13 1 1 A 93 93 GLU CB C 93 29.744 18.187 11.557 1 1 1086 . 13 1 1 A 93 93 GLU N N 93 118.207 121.301 -3.094 1 1 1087 . 13 1 1 A 94 94 ILE H H 94 7.766 8.348 -0.582 1 1 1088 . 13 1 1 A 94 94 ILE HA H 94 3.976 3.901 0.075 1 1 1098 . 13 1 1 A 94 94 ILE CA C 94 64.361 58.197 6.164 1 1 1099 . 13 1 1 A 94 94 ILE CB C 94 38.921 41.503 -2.582 1 1 1103 . 13 1 1 A 94 94 ILE N N 94 119.072 118.174 0.898 1 1 1104 . 13 1 1 A 95 95 LEU H H 95 8.340 8.048 0.292 1 1 1105 . 13 1 1 A 95 95 LEU HA H 95 4.300 4.129 0.171 1 1 1115 . 13 1 1 A 95 95 LEU CA C 95 57.905 59.439 -1.534 1 1 1116 . 13 1 1 A 95 95 LEU CB C 95 42.144 29.192 12.952 1 1 1119 . 13 1 1 A 95 95 LEU N N 95 121.325 117.567 3.758 1 1 1120 . 13 1 1 A 96 96 LYS H H 96 8.899 7.998 0.901 1 1 1121 . 13 1 1 A 96 96 LYS HA H 96 4.075 3.993 0.082 1 1 1126 . 13 1 1 A 96 96 LYS CA C 96 61.707 58.048 3.659 1 1 1127 . 13 1 1 A 96 96 LYS CB C 96 32.910 41.642 -8.732 1 1 1128 . 13 1 1 A 96 96 LYS N N 96 120.018 122.074 -2.056 1 1 1129 . 13 1 1 A 97 97 LYS H H 97 7.808 8.000 -0.192 1 1 1130 . 13 1 1 A 97 97 LYS HA H 97 4.045 4.305 -0.260 1 1 1139 . 13 1 1 A 97 97 LYS CA C 97 60.198 56.107 4.091 1 1 1140 . 13 1 1 A 97 97 LYS CB C 97 32.600 41.206 -8.606 1 1 1143 . 13 1 1 A 97 97 LYS N N 97 121.016 115.681 5.335 1 1 1144 . 13 1 1 A 98 98 ALA H H 98 7.814 8.289 -0.475 1 1 1145 . 13 1 1 A 98 98 ALA HA H 98 4.320 4.723 -0.403 1 1 1149 . 13 1 1 A 98 98 ALA CA C 98 55.260 54.500 0.760 1 1 1150 . 13 1 1 A 98 98 ALA CB C 98 19.468 39.624 -20.156 1 1 1151 . 13 1 1 A 98 98 ALA N N 98 122.102 116.650 5.452 1 1 1152 . 13 1 1 A 99 99 LEU H H 99 8.212 7.810 0.402 1 1 1153 . 13 1 1 A 99 99 LEU HA H 99 4.187 4.817 -0.630 1 1 1160 . 13 1 1 A 99 99 LEU CA C 99 58.398 56.716 1.682 1 1 1161 . 13 1 1 A 99 99 LEU CB C 99 42.720 36.857 5.863 1 1 1164 . 13 1 1 A 99 99 LEU N N 99 118.467 115.668 2.799 1 1 1165 . 13 1 1 A 100 100 ARG H H 100 7.738 7.468 0.270 1 1 1166 . 13 1 1 A 100 100 ARG HA H 100 3.894 5.302 -1.408 1 1 1173 . 13 1 1 A 100 100 ARG CA C 100 60.135 52.866 7.269 1 1 1174 . 13 1 1 A 100 100 ARG CB C 100 30.187 45.402 -15.215 1 1 1177 . 13 1 1 A 100 100 ARG N N 100 119.100 116.956 2.144 1 1 1178 . 13 1 1 A 101 101 ASP H H 101 8.186 8.477 -0.291 1 1 1179 . 13 1 1 A 101 101 ASP HA H 101 4.424 4.870 -0.446 1 1 1182 . 13 1 1 A 101 101 ASP CA C 101 57.902 51.306 6.596 1 1 1183 . 13 1 1 A 101 101 ASP CB C 101 40.033 40.846 -0.813 1 1 1184 . 13 1 1 A 101 101 ASP N N 101 121.899 120.261 1.638 1 1 1185 . 13 1 1 A 102 102 LEU H H 102 8.730 8.856 -0.126 1 1 1186 . 13 1 1 A 102 102 LEU HA H 102 4.373 4.075 0.298 1 1 1195 . 13 1 1 A 102 102 LEU CA C 102 58.218 57.936 0.282 1 1 1196 . 13 1 1 A 102 102 LEU CB C 102 42.839 29.747 13.092 1 1 1199 . 13 1 1 A 102 102 LEU N N 102 124.505 124.109 0.396 1 1 1200 . 13 1 1 A 103 103 LYS HA H 103 3.726 4.066 -0.340 1 1 1209 . 13 1 1 A 103 103 LYS CA C 103 59.760 55.756 4.004 1 1 1210 . 13 1 1 A 103 103 LYS CB C 103 32.822 32.207 0.615 1 1 1214 . 13 1 1 A 104 104 ARG H H 104 7.409 7.702 -0.293 1 1 1222 . 13 1 1 A 104 104 ARG CA C 104 56.298 44.995 11.303 1 1 1226 . 13 1 1 A 104 104 ARG N N 104 115.912 105.520 10.392 1 1 1227 . 13 1 1 A 105 105 GLY H H 105 8.046 7.056 0.990 1 1 1230 . 13 1 1 A 105 105 GLY CA C 105 46.309 55.319 -9.010 1 1 1231 . 13 1 1 A 105 105 GLY N N 105 108.860 117.930 -9.070 1 1 1232 . 13 1 1 A 106 106 LYS H H 106 8.033 8.593 -0.560 1 1 1233 . 13 1 1 A 106 106 LYS HA H 106 4.394 4.257 0.137 1 1 1242 . 13 1 1 A 106 106 LYS CA C 106 55.822 55.685 0.137 1 1 1243 . 13 1 1 A 106 106 LYS CB C 106 33.449 42.152 -8.703 1 1 1246 . 13 1 1 A 106 106 LYS N N 106 121.082 122.210 -1.128 1 1 1247 . 13 1 1 A 107 107 LYS H H 107 8.271 9.202 -0.931 1 1 1248 . 13 1 1 A 107 107 LYS HA H 107 4.329 4.581 -0.252 1 1 1255 . 13 1 1 A 107 107 LYS CA C 107 56.673 59.402 -2.729 1 1 1256 . 13 1 1 A 107 107 LYS CB C 107 33.341 64.116 -30.775 1 1 1258 . 13 1 1 A 107 107 LYS N N 107 121.869 119.193 2.676 1 1 1259 . 13 1 1 A 108 108 LEU H H 108 8.481 7.521 0.960 1 1 1260 . 13 1 1 A 108 108 LEU HA H 108 4.637 4.861 -0.224 1 1 1269 . 13 1 1 A 108 108 LEU CA C 108 53.819 54.425 -0.606 1 1 1270 . 13 1 1 A 108 108 LEU CB C 108 45.135 36.905 8.230 1 1 1272 . 13 1 1 A 108 108 LEU N N 108 124.360 120.143 4.217 1 1 1273 . 13 1 1 A 109 109 LYS H H 109 8.657 9.248 -0.591 1 1 1274 . 13 1 1 A 109 109 LYS HA H 109 4.565 4.527 0.038 1 1 1283 . 13 1 1 A 109 109 LYS CA C 109 55.511 58.931 -3.420 1 1 1284 . 13 1 1 A 109 109 LYS CB C 109 32.029 63.990 -31.961 1 1 1287 . 13 1 1 A 109 109 LYS N N 109 123.165 116.789 6.376 1 1 1288 . 13 1 1 A 110 110 PRO HA H 110 4.232 3.612 0.620 1 1 1295 . 13 1 1 A 110 110 PRO CA C 110 66.732 66.440 0.292 1 1 1296 . 13 1 1 A 110 110 PRO CB C 110 32.481 31.431 1.050 1 1 1299 . 13 1 1 A 111 111 GLU HA H 111 4.221 3.909 0.312 1 1 1304 . 13 1 1 A 111 111 GLU CA C 111 59.819 59.730 0.089 1 1 1305 . 13 1 1 A 111 111 GLU CB C 111 29.250 29.116 0.134 1 1 1307 . 13 1 1 A 112 112 ILE H H 112 7.233 8.169 -0.936 1 1 1308 . 13 1 1 A 112 112 ILE HA H 112 3.848 4.081 -0.233 1 1 1318 . 13 1 1 A 112 112 ILE CA C 112 62.635 59.141 3.494 1 1 1319 . 13 1 1 A 112 112 ILE CB C 112 37.159 29.267 7.892 1 1 1323 . 13 1 1 A 112 112 ILE N N 112 120.783 118.175 2.608 1 1 1324 . 13 1 1 A 113 113 LYS H H 113 8.268 8.257 0.011 1 1 1325 . 13 1 1 A 113 113 LYS HA H 113 3.849 3.666 0.183 1 1 1328 . 13 1 1 A 113 113 LYS CA C 113 60.248 65.240 -4.992 1 1 1329 . 13 1 1 A 113 113 LYS CB C 113 32.668 37.544 -4.876 1 1 1330 . 13 1 1 A 113 113 LYS N N 113 121.680 121.677 0.003 1 1 1331 . 13 1 1 A 114 114 GLY H H 114 8.460 8.204 0.256 1 1 1334 . 13 1 1 A 114 114 GLY CA C 114 47.600 61.131 -13.531 1 1 1335 . 13 1 1 A 114 114 GLY N N 114 105.413 116.433 -11.020 1 1 1336 . 13 1 1 A 115 115 LYS H H 115 7.352 7.664 -0.312 1 1 1337 . 13 1 1 A 115 115 LYS HA H 115 4.189 4.530 -0.341 1 1 1346 . 13 1 1 A 115 115 LYS CA C 115 59.689 57.128 2.561 1 1 1347 . 13 1 1 A 115 115 LYS CB C 115 33.428 41.000 -7.572 1 1 1351 . 13 1 1 A 115 115 LYS N N 115 121.599 121.774 -0.175 1 1 1352 . 13 1 1 A 116 116 LEU H H 116 8.046 8.171 -0.125 1 1 1353 . 13 1 1 A 116 116 LEU HA H 116 4.153 3.878 0.275 1 1 1363 . 13 1 1 A 116 116 LEU CA C 116 57.698 64.861 -7.163 1 1 1364 . 13 1 1 A 116 116 LEU CB C 116 42.070 31.606 10.464 1 1 1366 . 13 1 1 A 116 116 LEU N N 116 118.827 119.031 -0.204 1 1 1367 . 13 1 1 A 117 117 SER H H 117 8.321 7.477 0.844 1 1 1368 . 13 1 1 A 117 117 SER HA H 117 4.334 4.222 0.112 1 1 1371 . 13 1 1 A 117 117 SER CA C 117 61.467 54.173 7.294 1 1 1372 . 13 1 1 A 117 117 SER CB C 117 63.613 41.684 21.929 1 1 1373 . 13 1 1 A 117 117 SER N N 117 114.829 115.855 -1.026 1 1 1374 . 13 1 1 A 118 118 ARG H H 118 7.001 7.835 -0.834 1 1 1375 . 13 1 1 A 118 118 ARG HA H 118 4.403 3.881 0.522 1 1 1382 . 13 1 1 A 118 118 ARG CA C 118 56.734 56.957 -0.223 1 1 1383 . 13 1 1 A 118 118 ARG CB C 118 31.115 27.261 3.854 1 1 1385 . 13 1 1 A 118 118 ARG N N 118 118.114 114.176 3.938 1 1 1386 . 13 1 1 A 119 119 LEU H H 119 7.365 8.315 -0.950 1 1 1387 . 13 1 1 A 119 119 LEU HA H 119 4.253 4.854 -0.601 1 1 1397 . 13 1 1 A 119 119 LEU CA C 119 54.639 57.749 -3.110 1 1 1398 . 13 1 1 A 119 119 LEU CB C 119 41.700 31.526 10.174 1 1 1401 . 13 1 1 A 119 119 LEU N N 119 119.181 117.359 1.822 1 1 1402 . 13 1 1 A 120 120 ARG H H 120 8.766 8.654 0.112 1 1 1403 . 13 1 1 A 120 120 ARG HA H 120 4.374 4.423 -0.049 1 1 1410 . 13 1 1 A 120 120 ARG CA C 120 56.426 59.308 -2.882 1 1 1411 . 13 1 1 A 120 120 ARG CB C 120 32.414 63.682 -31.268 1 1 1414 . 13 1 1 A 120 120 ARG N N 120 122.099 120.264 1.835 1 1 1415 . 13 1 1 A 121 121 LEU H H 121 8.312 8.718 -0.406 1 1 1416 . 13 1 1 A 121 121 LEU HA H 121 4.407 3.553 0.854 1 1 1426 . 13 1 1 A 121 121 LEU CA C 121 56.028 66.996 -10.968 1 1 1427 . 13 1 1 A 121 121 LEU CB C 121 43.122 32.059 11.063 1 1 1430 . 13 1 1 A 121 121 LEU N N 121 118.761 124.421 -5.660 1 1 1431 . 13 1 1 A 122 122 PHE H H 122 7.143 8.216 -1.073 1 1 1432 . 13 1 1 A 122 122 PHE HA H 122 5.201 4.106 1.095 1 1 1439 . 13 1 1 A 122 122 PHE CA C 122 53.047 59.174 -6.127 1 1 1440 . 13 1 1 A 122 122 PHE CB C 122 40.844 29.425 11.419 1 1 1441 . 13 1 1 A 122 122 PHE N N 122 112.750 119.593 -6.843 1 1 1442 . 13 1 1 A 123 123 PRO HA H 123 3.908 3.958 -0.050 1 1 1449 . 13 1 1 A 123 123 PRO CA C 123 65.478 59.208 6.270 1 1 1450 . 13 1 1 A 123 123 PRO CB C 123 33.248 29.293 3.955 1 1 1452 . 13 1 1 A 124 124 LEU H H 124 7.208 8.054 -0.846 1 1 1453 . 13 1 1 A 124 124 LEU HA H 124 4.673 4.074 0.599 1 1 1463 . 13 1 1 A 124 124 LEU CA C 124 53.307 57.733 -4.426 1 1 1464 . 13 1 1 A 124 124 LEU CB C 124 42.853 41.480 1.373 1 1 1468 . 13 1 1 A 124 124 LEU N N 124 113.875 121.180 -7.305 1 1 1469 . 13 1 1 A 125 125 SER H H 125 8.990 8.133 0.857 1 1 1470 . 13 1 1 A 125 125 SER HA H 125 4.533 3.930 0.603 1 1 1473 . 13 1 1 A 125 125 SER CA C 125 59.198 59.607 -0.409 1 1 1474 . 13 1 1 A 125 125 SER CB C 125 64.578 29.195 35.383 1 1 1475 . 13 1 1 A 125 125 SER N N 125 117.894 119.625 -1.731 1 1 1476 . 13 1 1 A 126 126 SER H H 126 8.618 7.610 1.008 1 1 1477 . 13 1 1 A 126 126 SER HA H 126 4.614 4.003 0.611 1 1 1480 . 13 1 1 A 126 126 SER CA C 126 58.730 59.387 -0.657 1 1 1481 . 13 1 1 A 126 126 SER CB C 126 64.367 32.266 32.101 1 1 1482 . 13 1 1 A 126 126 SER N N 126 118.602 119.541 -0.939 1 1 1483 . 13 1 1 A 127 127 SER HA H 127 4.530 3.791 0.739 1 1 1486 . 13 1 1 A 127 127 SER CA C 127 58.954 65.555 -6.601 1 1 1487 . 13 1 1 A 127 127 SER CB C 127 64.379 31.598 32.781 1 1 1488 . 13 1 1 A 128 128 ALA H H 128 8.345 8.446 -0.101 1 1 1489 . 13 1 1 A 128 128 ALA HA H 128 4.432 3.996 0.436 1 1 1493 . 13 1 1 A 128 128 ALA CA C 128 52.963 58.696 -5.733 1 1 1494 . 13 1 1 A 128 128 ALA CB C 128 19.924 29.958 -10.034 1 1 1495 . 13 1 1 A 128 128 ALA N N 128 126.185 120.826 5.359 1 1 1496 . 13 1 1 A 129 129 GLU H H 129 8.329 7.723 0.606 1 1 1497 . 13 1 1 A 129 129 GLU HA H 129 4.353 4.053 0.300 1 1 1502 . 13 1 1 A 129 129 GLU CA C 129 57.111 58.660 -1.549 1 1 1503 . 13 1 1 A 129 129 GLU CB C 129 30.949 28.579 2.370 1 1 1504 . 13 1 1 A 129 129 GLU N N 129 120.842 118.716 2.126 1 1 1505 . 13 1 1 A 130 130 LYS H H 130 7.947 8.091 -0.144 1 1 1506 . 13 1 1 A 130 130 LYS HA H 130 3.835 4.021 -0.186 1 1 1515 . 13 1 1 A 130 130 LYS CA C 130 57.756 59.670 -1.914 1 1 1516 . 13 1 1 A 130 130 LYS CB C 130 33.156 32.066 1.090 1 1 826 . 14 1 1 A 70 70 GLY H H 70 9.295 8.658 0.637 1 1 829 . 14 1 1 A 70 70 GLY CA C 70 46.552 59.507 -12.955 1 1 830 . 14 1 1 A 70 70 GLY N N 70 108.643 117.855 -9.212 1 1 832 . 14 1 1 A 71 71 VAL HA H 71 3.538 4.844 -1.306 1 1 840 . 14 1 1 A 71 71 VAL CA C 71 65.623 62.842 2.781 1 1 841 . 14 1 1 A 71 71 VAL CB C 71 30.251 31.920 -1.669 1 1 844 . 14 1 1 A 71 71 VAL N N 71 110.808 136.578 -25.770 1 1 845 . 14 1 1 A 72 72 CYS H H 72 8.022 8.954 -0.932 1 1 846 . 14 1 1 A 72 72 CYS HA H 72 3.469 5.143 -1.674 1 1 849 . 14 1 1 A 72 72 CYS CA C 72 62.733 57.394 5.339 1 1 850 . 14 1 1 A 72 72 CYS CB C 72 27.163 64.486 -37.323 1 1 851 . 14 1 1 A 72 72 CYS N N 72 109.483 119.403 -9.920 1 1 852 . 14 1 1 A 73 73 SER H H 73 7.996 8.183 -0.187 1 1 853 . 14 1 1 A 73 73 SER HA H 73 4.439 4.088 0.351 1 1 856 . 14 1 1 A 73 73 SER CA C 73 62.145 59.309 2.836 1 1 857 . 14 1 1 A 73 73 SER CB C 73 66.013 29.542 36.471 1 1 858 . 14 1 1 A 73 73 SER N N 73 118.630 122.275 -3.645 1 1 859 . 14 1 1 A 74 74 LYS H H 74 10.186 7.940 2.246 1 1 860 . 14 1 1 A 74 74 LYS HA H 74 4.172 3.975 0.197 1 1 867 . 14 1 1 A 74 74 LYS CA C 74 59.848 58.429 1.419 1 1 868 . 14 1 1 A 74 74 LYS CB C 74 34.278 41.457 -7.179 1 1 870 . 14 1 1 A 74 74 LYS N N 74 123.341 119.519 3.822 1 1 871 . 14 1 1 A 75 75 ASP H H 75 7.542 8.266 -0.724 1 1 872 . 14 1 1 A 75 75 ASP HA H 75 3.538 4.137 -0.599 1 1 875 . 14 1 1 A 75 75 ASP CA C 75 52.472 59.264 -6.792 1 1 876 . 14 1 1 A 75 75 ASP CB C 75 42.360 29.234 13.126 1 1 877 . 14 1 1 A 75 75 ASP N N 75 112.035 119.453 -7.418 1 1 878 . 14 1 1 A 76 76 VAL H H 76 8.128 7.972 0.156 1 1 879 . 14 1 1 A 76 76 VAL HA H 76 4.106 3.992 0.114 1 1 887 . 14 1 1 A 76 76 VAL CA C 76 65.179 59.059 6.120 1 1 888 . 14 1 1 A 76 76 VAL CB C 76 32.174 29.162 3.012 1 1 891 . 14 1 1 A 76 76 VAL N N 76 117.992 119.854 -1.862 1 1 892 . 14 1 1 A 77 77 TRP H H 77 6.869 8.068 -1.199 1 1 893 . 14 1 1 A 77 77 TRP HA H 77 4.509 4.134 0.375 1 1 899 . 14 1 1 A 77 77 TRP CA C 77 59.207 57.705 1.502 1 1 900 . 14 1 1 A 77 77 TRP CB C 77 28.941 41.639 -12.698 1 1 901 . 14 1 1 A 77 77 TRP N N 77 123.077 121.494 1.583 1 1 903 . 14 1 1 A 78 78 GLU H H 78 8.593 8.341 0.252 1 1 904 . 14 1 1 A 78 78 GLU HA H 78 4.318 3.918 0.400 1 1 909 . 14 1 1 A 78 78 GLU CA C 78 60.038 59.109 0.929 1 1 910 . 14 1 1 A 78 78 GLU CB C 78 31.178 28.326 2.852 1 1 912 . 14 1 1 A 78 78 GLU N N 78 121.505 118.314 3.191 1 1 913 . 14 1 1 A 79 79 PHE H H 79 8.071 8.072 -0.001 1 1 914 . 14 1 1 A 79 79 PHE HA H 79 4.986 4.065 0.921 1 1 919 . 14 1 1 A 79 79 PHE CA C 79 58.749 58.792 -0.043 1 1 920 . 14 1 1 A 79 79 PHE CB C 79 39.732 28.913 10.819 1 1 921 . 14 1 1 A 79 79 PHE N N 79 118.384 118.158 0.226 1 1 922 . 14 1 1 A 80 80 LEU H H 80 9.309 7.939 1.370 1 1 923 . 14 1 1 A 80 80 LEU HA H 80 3.970 4.444 -0.474 1 1 933 . 14 1 1 A 80 80 LEU CA C 80 59.307 56.428 2.879 1 1 934 . 14 1 1 A 80 80 LEU CB C 80 43.257 38.220 5.037 1 1 937 . 14 1 1 A 80 80 LEU N N 80 122.915 118.379 4.536 1 1 938 . 14 1 1 A 81 81 GLU H H 81 8.282 8.003 0.279 1 1 939 . 14 1 1 A 81 81 GLU HA H 81 3.832 3.732 0.100 1 1 944 . 14 1 1 A 81 81 GLU CA C 81 62.069 65.161 -3.092 1 1 945 . 14 1 1 A 81 81 GLU CB C 81 30.249 38.105 -7.856 1 1 947 . 14 1 1 A 81 81 GLU N N 81 119.345 120.344 -0.999 1 1 948 . 14 1 1 A 82 82 LEU H H 82 8.236 7.941 0.295 1 1 949 . 14 1 1 A 82 82 LEU HA H 82 4.187 4.378 -0.191 1 1 959 . 14 1 1 A 82 82 LEU CA C 82 58.348 58.603 -0.255 1 1 960 . 14 1 1 A 82 82 LEU CB C 82 42.827 31.997 10.830 1 1 963 . 14 1 1 A 82 82 LEU N N 82 120.013 119.375 0.638 1 1 964 . 14 1 1 A 83 83 GLN H H 83 7.949 7.973 -0.024 1 1 965 . 14 1 1 A 83 83 GLN HA H 83 3.812 3.917 -0.105 1 1 968 . 14 1 1 A 83 83 GLN CA C 83 60.248 58.159 2.089 1 1 969 . 14 1 1 A 83 83 GLN CB C 83 33.537 41.442 -7.905 1 1 970 . 14 1 1 A 83 83 GLN N N 83 116.443 120.247 -3.804 1 1 971 . 14 1 1 A 84 84 ILE H H 84 8.407 8.661 -0.254 1 1 972 . 14 1 1 A 84 84 ILE HA H 84 3.644 4.104 -0.460 1 1 982 . 14 1 1 A 84 84 ILE CA C 84 67.288 58.817 8.471 1 1 983 . 14 1 1 A 84 84 ILE CB C 84 38.305 29.159 9.146 1 1 987 . 14 1 1 A 84 84 ILE N N 84 120.422 117.856 2.566 1 1 988 . 14 1 1 A 85 85 GLU H H 85 7.741 8.187 -0.446 1 1 989 . 14 1 1 A 85 85 GLU HA H 85 3.811 4.940 -1.129 1 1 994 . 14 1 1 A 85 85 GLU CA C 85 59.862 52.900 6.962 1 1 995 . 14 1 1 A 85 85 GLU CB C 85 30.360 46.072 -15.712 1 1 997 . 14 1 1 A 85 85 GLU N N 85 115.705 116.712 -1.007 1 1 998 . 14 1 1 A 86 86 GLU H H 86 7.818 8.709 -0.891 1 1 999 . 14 1 1 A 86 86 GLU HA H 86 4.274 4.767 -0.493 1 1 1004 . 14 1 1 A 86 86 GLU CA C 86 58.068 55.808 2.260 1 1 1005 . 14 1 1 A 86 86 GLU CB C 86 31.424 33.648 -2.224 1 1 1007 . 14 1 1 A 86 86 GLU N N 86 114.297 118.420 -4.123 1 1 1008 . 14 1 1 A 87 87 ILE H H 87 8.753 8.469 0.284 1 1 1019 . 14 1 1 A 87 87 ILE CA C 87 62.660 44.623 18.037 1 1 1024 . 14 1 1 A 87 87 ILE N N 87 118.890 109.926 8.964 1 1 1025 . 14 1 1 A 88 88 TYR H H 88 8.059 8.863 -0.804 1 1 1026 . 14 1 1 A 88 88 TYR HA H 88 5.447 4.144 1.303 1 1 1033 . 14 1 1 A 88 88 TYR CA C 88 55.285 58.217 -2.932 1 1 1034 . 14 1 1 A 88 88 TYR CB C 88 40.687 32.187 8.500 1 1 1035 . 14 1 1 A 88 88 TYR N N 88 119.252 125.504 -6.252 1 1 1036 . 14 1 1 A 89 89 PRO HA H 89 4.410 3.980 0.430 1 1 1043 . 14 1 1 A 89 89 PRO CA C 89 66.374 59.497 6.877 1 1 1044 . 14 1 1 A 89 89 PRO CB C 89 31.377 29.173 2.204 1 1 1047 . 14 1 1 A 90 90 GLU H H 90 9.234 8.255 0.979 1 1 1048 . 14 1 1 A 90 90 GLU HA H 90 4.379 4.034 0.345 1 1 1053 . 14 1 1 A 90 90 GLU CA C 90 59.098 58.714 0.384 1 1 1054 . 14 1 1 A 90 90 GLU CB C 90 29.461 28.037 1.424 1 1 1056 . 14 1 1 A 90 90 GLU N N 90 117.574 118.061 -0.487 1 1 1057 . 14 1 1 A 91 91 GLU H H 91 7.966 7.575 0.391 1 1 1058 . 14 1 1 A 91 91 GLU HA H 91 4.890 4.081 0.809 1 1 1063 . 14 1 1 A 91 91 GLU CA C 91 55.324 58.992 -3.668 1 1 1064 . 14 1 1 A 91 91 GLU CB C 91 31.590 29.278 2.312 1 1 1066 . 14 1 1 A 91 91 GLU N N 91 119.310 119.653 -0.343 1 1 1067 . 14 1 1 A 92 92 GLU H H 92 7.263 8.097 -0.834 1 1 1068 . 14 1 1 A 92 92 GLU HA H 92 3.789 3.936 -0.147 1 1 1073 . 14 1 1 A 92 92 GLU CA C 92 60.628 57.912 2.716 1 1 1074 . 14 1 1 A 92 92 GLU CB C 92 30.531 41.508 -10.977 1 1 1076 . 14 1 1 A 92 92 GLU N N 92 121.332 120.353 0.979 1 1 1077 . 14 1 1 A 93 93 GLU H H 93 8.646 7.918 0.728 1 1 1078 . 14 1 1 A 93 93 GLU HA H 93 4.127 4.103 0.024 1 1 1083 . 14 1 1 A 93 93 GLU CA C 93 60.528 55.397 5.131 1 1 1084 . 14 1 1 A 93 93 GLU CB C 93 29.744 18.262 11.482 1 1 1086 . 14 1 1 A 93 93 GLU N N 93 118.207 121.760 -3.553 1 1 1087 . 14 1 1 A 94 94 ILE H H 94 7.766 8.260 -0.494 1 1 1088 . 14 1 1 A 94 94 ILE HA H 94 3.976 3.906 0.070 1 1 1098 . 14 1 1 A 94 94 ILE CA C 94 64.361 58.202 6.159 1 1 1099 . 14 1 1 A 94 94 ILE CB C 94 38.921 41.446 -2.525 1 1 1103 . 14 1 1 A 94 94 ILE N N 94 119.072 118.178 0.894 1 1 1104 . 14 1 1 A 95 95 LEU H H 95 8.340 8.072 0.268 1 1 1105 . 14 1 1 A 95 95 LEU HA H 95 4.300 4.137 0.163 1 1 1115 . 14 1 1 A 95 95 LEU CA C 95 57.905 59.438 -1.533 1 1 1116 . 14 1 1 A 95 95 LEU CB C 95 42.144 29.203 12.941 1 1 1119 . 14 1 1 A 95 95 LEU N N 95 121.325 117.492 3.833 1 1 1120 . 14 1 1 A 96 96 LYS H H 96 8.899 7.938 0.961 1 1 1121 . 14 1 1 A 96 96 LYS HA H 96 4.075 4.029 0.046 1 1 1126 . 14 1 1 A 96 96 LYS CA C 96 61.707 57.741 3.966 1 1 1127 . 14 1 1 A 96 96 LYS CB C 96 32.910 41.797 -8.887 1 1 1128 . 14 1 1 A 96 96 LYS N N 96 120.018 122.237 -2.219 1 1 1129 . 14 1 1 A 97 97 LYS H H 97 7.808 8.087 -0.279 1 1 1130 . 14 1 1 A 97 97 LYS HA H 97 4.045 4.309 -0.264 1 1 1139 . 14 1 1 A 97 97 LYS CA C 97 60.198 55.688 4.510 1 1 1140 . 14 1 1 A 97 97 LYS CB C 97 32.600 41.066 -8.466 1 1 1143 . 14 1 1 A 97 97 LYS N N 97 121.016 116.185 4.831 1 1 1144 . 14 1 1 A 98 98 ALA H H 98 7.814 8.361 -0.547 1 1 1145 . 14 1 1 A 98 98 ALA HA H 98 4.320 4.759 -0.439 1 1 1149 . 14 1 1 A 98 98 ALA CA C 98 55.260 54.282 0.978 1 1 1150 . 14 1 1 A 98 98 ALA CB C 98 19.468 39.359 -19.891 1 1 1151 . 14 1 1 A 98 98 ALA N N 98 122.102 116.347 5.755 1 1 1152 . 14 1 1 A 99 99 LEU H H 99 8.212 7.852 0.360 1 1 1153 . 14 1 1 A 99 99 LEU HA H 99 4.187 4.756 -0.569 1 1 1160 . 14 1 1 A 99 99 LEU CA C 99 58.398 56.776 1.622 1 1 1161 . 14 1 1 A 99 99 LEU CB C 99 42.720 36.829 5.891 1 1 1164 . 14 1 1 A 99 99 LEU N N 99 118.467 115.720 2.747 1 1 1165 . 14 1 1 A 100 100 ARG H H 100 7.738 7.526 0.212 1 1 1166 . 14 1 1 A 100 100 ARG HA H 100 3.894 5.184 -1.290 1 1 1173 . 14 1 1 A 100 100 ARG CA C 100 60.135 52.766 7.369 1 1 1174 . 14 1 1 A 100 100 ARG CB C 100 30.187 45.439 -15.252 1 1 1177 . 14 1 1 A 100 100 ARG N N 100 119.100 117.014 2.086 1 1 1178 . 14 1 1 A 101 101 ASP H H 101 8.186 8.124 0.062 1 1 1179 . 14 1 1 A 101 101 ASP HA H 101 4.424 4.926 -0.502 1 1 1182 . 14 1 1 A 101 101 ASP CA C 101 57.902 52.067 5.835 1 1 1183 . 14 1 1 A 101 101 ASP CB C 101 40.033 39.886 0.147 1 1 1184 . 14 1 1 A 101 101 ASP N N 101 121.899 117.625 4.274 1 1 1185 . 14 1 1 A 102 102 LEU H H 102 8.730 8.968 -0.238 1 1 1186 . 14 1 1 A 102 102 LEU HA H 102 4.373 4.042 0.331 1 1 1195 . 14 1 1 A 102 102 LEU CA C 102 58.218 58.394 -0.176 1 1 1196 . 14 1 1 A 102 102 LEU CB C 102 42.839 28.820 14.019 1 1 1199 . 14 1 1 A 102 102 LEU N N 102 124.505 120.644 3.861 1 1 1200 . 14 1 1 A 103 103 LYS HA H 103 3.726 4.326 -0.600 1 1 1209 . 14 1 1 A 103 103 LYS CA C 103 59.760 56.175 3.585 1 1 1210 . 14 1 1 A 103 103 LYS CB C 103 32.822 33.035 -0.213 1 1 1214 . 14 1 1 A 104 104 ARG H H 104 7.409 7.886 -0.477 1 1 1222 . 14 1 1 A 104 104 ARG CA C 104 56.298 45.181 11.117 1 1 1226 . 14 1 1 A 104 104 ARG N N 104 115.912 105.743 10.169 1 1 1227 . 14 1 1 A 105 105 GLY H H 105 8.046 7.860 0.186 1 1 1230 . 14 1 1 A 105 105 GLY CA C 105 46.309 55.791 -9.482 1 1 1231 . 14 1 1 A 105 105 GLY N N 105 108.860 118.413 -9.553 1 1 1232 . 14 1 1 A 106 106 LYS H H 106 8.033 8.459 -0.426 1 1 1233 . 14 1 1 A 106 106 LYS HA H 106 4.394 4.240 0.154 1 1 1242 . 14 1 1 A 106 106 LYS CA C 106 55.822 55.403 0.419 1 1 1243 . 14 1 1 A 106 106 LYS CB C 106 33.449 42.614 -9.165 1 1 1246 . 14 1 1 A 106 106 LYS N N 106 121.082 117.837 3.245 1 1 1247 . 14 1 1 A 107 107 LYS H H 107 8.271 9.177 -0.906 1 1 1248 . 14 1 1 A 107 107 LYS HA H 107 4.329 4.229 0.100 1 1 1255 . 14 1 1 A 107 107 LYS CA C 107 56.673 59.447 -2.774 1 1 1256 . 14 1 1 A 107 107 LYS CB C 107 33.341 63.664 -30.323 1 1 1258 . 14 1 1 A 107 107 LYS N N 107 121.869 114.082 7.787 1 1 1259 . 14 1 1 A 108 108 LEU H H 108 8.481 7.484 0.997 1 1 1260 . 14 1 1 A 108 108 LEU HA H 108 4.637 4.843 -0.206 1 1 1269 . 14 1 1 A 108 108 LEU CA C 108 53.819 54.439 -0.620 1 1 1270 . 14 1 1 A 108 108 LEU CB C 108 45.135 37.304 7.831 1 1 1272 . 14 1 1 A 108 108 LEU N N 108 124.360 120.149 4.211 1 1 1273 . 14 1 1 A 109 109 LYS H H 109 8.657 9.007 -0.350 1 1 1274 . 14 1 1 A 109 109 LYS HA H 109 4.565 4.519 0.046 1 1 1283 . 14 1 1 A 109 109 LYS CA C 109 55.511 59.127 -3.616 1 1 1284 . 14 1 1 A 109 109 LYS CB C 109 32.029 63.996 -31.967 1 1 1287 . 14 1 1 A 109 109 LYS N N 109 123.165 117.820 5.345 1 1 1288 . 14 1 1 A 110 110 PRO HA H 110 4.232 3.593 0.639 1 1 1295 . 14 1 1 A 110 110 PRO CA C 110 66.732 66.770 -0.038 1 1 1296 . 14 1 1 A 110 110 PRO CB C 110 32.481 31.596 0.885 1 1 1299 . 14 1 1 A 111 111 GLU HA H 111 4.221 3.928 0.293 1 1 1304 . 14 1 1 A 111 111 GLU CA C 111 59.819 59.901 -0.082 1 1 1305 . 14 1 1 A 111 111 GLU CB C 111 29.250 29.236 0.014 1 1 1307 . 14 1 1 A 112 112 ILE H H 112 7.233 8.167 -0.934 1 1 1308 . 14 1 1 A 112 112 ILE HA H 112 3.848 4.085 -0.237 1 1 1318 . 14 1 1 A 112 112 ILE CA C 112 62.635 59.198 3.437 1 1 1319 . 14 1 1 A 112 112 ILE CB C 112 37.159 29.331 7.828 1 1 1323 . 14 1 1 A 112 112 ILE N N 112 120.783 118.174 2.609 1 1 1324 . 14 1 1 A 113 113 LYS H H 113 8.268 8.235 0.033 1 1 1325 . 14 1 1 A 113 113 LYS HA H 113 3.849 3.707 0.142 1 1 1328 . 14 1 1 A 113 113 LYS CA C 113 60.248 65.285 -5.037 1 1 1329 . 14 1 1 A 113 113 LYS CB C 113 32.668 37.389 -4.721 1 1 1330 . 14 1 1 A 113 113 LYS N N 113 121.680 121.867 -0.187 1 1 1331 . 14 1 1 A 114 114 GLY H H 114 8.460 8.399 0.061 1 1 1334 . 14 1 1 A 114 114 GLY CA C 114 47.600 61.097 -13.497 1 1 1335 . 14 1 1 A 114 114 GLY N N 114 105.413 115.192 -9.779 1 1 1336 . 14 1 1 A 115 115 LYS H H 115 7.352 7.643 -0.291 1 1 1337 . 14 1 1 A 115 115 LYS HA H 115 4.189 4.530 -0.341 1 1 1346 . 14 1 1 A 115 115 LYS CA C 115 59.689 57.128 2.561 1 1 1347 . 14 1 1 A 115 115 LYS CB C 115 33.428 40.996 -7.568 1 1 1351 . 14 1 1 A 115 115 LYS N N 115 121.599 122.458 -0.859 1 1 1352 . 14 1 1 A 116 116 LEU H H 116 8.046 8.248 -0.202 1 1 1353 . 14 1 1 A 116 116 LEU HA H 116 4.153 3.875 0.278 1 1 1363 . 14 1 1 A 116 116 LEU CA C 116 57.698 64.877 -7.179 1 1 1364 . 14 1 1 A 116 116 LEU CB C 116 42.070 31.596 10.474 1 1 1366 . 14 1 1 A 116 116 LEU N N 116 118.827 119.030 -0.203 1 1 1367 . 14 1 1 A 117 117 SER H H 117 8.321 7.481 0.840 1 1 1368 . 14 1 1 A 117 117 SER HA H 117 4.334 4.214 0.120 1 1 1371 . 14 1 1 A 117 117 SER CA C 117 61.467 54.172 7.295 1 1 1372 . 14 1 1 A 117 117 SER CB C 117 63.613 41.767 21.846 1 1 1373 . 14 1 1 A 117 117 SER N N 117 114.829 115.852 -1.023 1 1 1374 . 14 1 1 A 118 118 ARG H H 118 7.001 7.834 -0.833 1 1 1375 . 14 1 1 A 118 118 ARG HA H 118 4.403 3.879 0.524 1 1 1382 . 14 1 1 A 118 118 ARG CA C 118 56.734 56.956 -0.222 1 1 1383 . 14 1 1 A 118 118 ARG CB C 118 31.115 27.239 3.876 1 1 1385 . 14 1 1 A 118 118 ARG N N 118 118.114 114.169 3.945 1 1 1386 . 14 1 1 A 119 119 LEU H H 119 7.365 8.277 -0.912 1 1 1387 . 14 1 1 A 119 119 LEU HA H 119 4.253 4.885 -0.632 1 1 1397 . 14 1 1 A 119 119 LEU CA C 119 54.639 57.748 -3.109 1 1 1398 . 14 1 1 A 119 119 LEU CB C 119 41.700 31.442 10.258 1 1 1401 . 14 1 1 A 119 119 LEU N N 119 119.181 117.358 1.823 1 1 1402 . 14 1 1 A 120 120 ARG H H 120 8.766 8.643 0.123 1 1 1403 . 14 1 1 A 120 120 ARG HA H 120 4.374 4.428 -0.054 1 1 1410 . 14 1 1 A 120 120 ARG CA C 120 56.426 59.264 -2.838 1 1 1411 . 14 1 1 A 120 120 ARG CB C 120 32.414 63.749 -31.335 1 1 1414 . 14 1 1 A 120 120 ARG N N 120 122.099 120.136 1.963 1 1 1415 . 14 1 1 A 121 121 LEU H H 121 8.312 8.724 -0.412 1 1 1416 . 14 1 1 A 121 121 LEU HA H 121 4.407 3.557 0.850 1 1 1426 . 14 1 1 A 121 121 LEU CA C 121 56.028 67.029 -11.001 1 1 1427 . 14 1 1 A 121 121 LEU CB C 121 43.122 31.956 11.166 1 1 1430 . 14 1 1 A 121 121 LEU N N 121 118.761 123.958 -5.197 1 1 1431 . 14 1 1 A 122 122 PHE H H 122 7.143 8.355 -1.212 1 1 1432 . 14 1 1 A 122 122 PHE HA H 122 5.201 4.077 1.124 1 1 1439 . 14 1 1 A 122 122 PHE CA C 122 53.047 59.139 -6.092 1 1 1440 . 14 1 1 A 122 122 PHE CB C 122 40.844 29.365 11.479 1 1 1441 . 14 1 1 A 122 122 PHE N N 122 112.750 120.135 -7.385 1 1 1442 . 14 1 1 A 123 123 PRO HA H 123 3.908 3.977 -0.069 1 1 1449 . 14 1 1 A 123 123 PRO CA C 123 65.478 59.227 6.251 1 1 1450 . 14 1 1 A 123 123 PRO CB C 123 33.248 29.319 3.929 1 1 1452 . 14 1 1 A 124 124 LEU H H 124 7.208 7.952 -0.744 1 1 1453 . 14 1 1 A 124 124 LEU HA H 124 4.673 4.059 0.614 1 1 1463 . 14 1 1 A 124 124 LEU CA C 124 53.307 57.687 -4.380 1 1 1464 . 14 1 1 A 124 124 LEU CB C 124 42.853 41.981 0.872 1 1 1468 . 14 1 1 A 124 124 LEU N N 124 113.875 121.193 -7.318 1 1 1469 . 14 1 1 A 125 125 SER H H 125 8.990 8.101 0.889 1 1 1470 . 14 1 1 A 125 125 SER HA H 125 4.533 3.954 0.579 1 1 1473 . 14 1 1 A 125 125 SER CA C 125 59.198 59.778 -0.580 1 1 1474 . 14 1 1 A 125 125 SER CB C 125 64.578 29.207 35.371 1 1 1475 . 14 1 1 A 125 125 SER N N 125 117.894 119.849 -1.955 1 1 1476 . 14 1 1 A 126 126 SER H H 126 8.618 7.638 0.980 1 1 1477 . 14 1 1 A 126 126 SER HA H 126 4.614 3.952 0.662 1 1 1480 . 14 1 1 A 126 126 SER CA C 126 58.730 60.779 -2.049 1 1 1481 . 14 1 1 A 126 126 SER CB C 126 64.367 32.397 31.970 1 1 1482 . 14 1 1 A 126 126 SER N N 126 118.602 119.027 -0.425 1 1 1483 . 14 1 1 A 127 127 SER HA H 127 4.530 3.780 0.750 1 1 1486 . 14 1 1 A 127 127 SER CA C 127 58.954 65.666 -6.712 1 1 1487 . 14 1 1 A 127 127 SER CB C 127 64.379 31.539 32.840 1 1 1488 . 14 1 1 A 128 128 ALA H H 128 8.345 8.418 -0.073 1 1 1489 . 14 1 1 A 128 128 ALA HA H 128 4.432 3.946 0.486 1 1 1493 . 14 1 1 A 128 128 ALA CA C 128 52.963 59.077 -6.114 1 1 1494 . 14 1 1 A 128 128 ALA CB C 128 19.924 29.730 -9.806 1 1 1495 . 14 1 1 A 128 128 ALA N N 128 126.185 122.144 4.041 1 1 1496 . 14 1 1 A 129 129 GLU H H 129 8.329 7.955 0.374 1 1 1497 . 14 1 1 A 129 129 GLU HA H 129 4.353 4.069 0.284 1 1 1502 . 14 1 1 A 129 129 GLU CA C 129 57.111 58.686 -1.575 1 1 1503 . 14 1 1 A 129 129 GLU CB C 129 30.949 28.538 2.411 1 1 1504 . 14 1 1 A 129 129 GLU N N 129 120.842 118.631 2.211 1 1 1505 . 14 1 1 A 130 130 LYS H H 130 7.947 7.962 -0.015 1 1 1506 . 14 1 1 A 130 130 LYS HA H 130 3.835 4.033 -0.198 1 1 1515 . 14 1 1 A 130 130 LYS CA C 130 57.756 59.678 -1.922 1 1 1516 . 14 1 1 A 130 130 LYS CB C 130 33.156 32.100 1.056 1 1 826 . 15 1 1 A 70 70 GLY H H 70 9.295 8.227 1.068 1 1 829 . 15 1 1 A 70 70 GLY CA C 70 46.552 58.221 -11.669 1 1 830 . 15 1 1 A 70 70 GLY N N 70 108.643 116.235 -7.592 1 1 832 . 15 1 1 A 71 71 VAL HA H 71 3.538 4.821 -1.283 1 1 840 . 15 1 1 A 71 71 VAL CA C 71 65.623 62.764 2.859 1 1 841 . 15 1 1 A 71 71 VAL CB C 71 30.251 32.611 -2.360 1 1 844 . 15 1 1 A 71 71 VAL N N 71 110.808 136.325 -25.517 1 1 845 . 15 1 1 A 72 72 CYS H H 72 8.022 8.291 -0.269 1 1 846 . 15 1 1 A 72 72 CYS HA H 72 3.469 4.751 -1.282 1 1 849 . 15 1 1 A 72 72 CYS CA C 72 62.733 57.882 4.851 1 1 850 . 15 1 1 A 72 72 CYS CB C 72 27.163 63.039 -35.876 1 1 851 . 15 1 1 A 72 72 CYS N N 72 109.483 114.372 -4.889 1 1 852 . 15 1 1 A 73 73 SER H H 73 7.996 8.214 -0.218 1 1 853 . 15 1 1 A 73 73 SER HA H 73 4.439 4.032 0.407 1 1 856 . 15 1 1 A 73 73 SER CA C 73 62.145 59.315 2.830 1 1 857 . 15 1 1 A 73 73 SER CB C 73 66.013 29.303 36.710 1 1 858 . 15 1 1 A 73 73 SER N N 73 118.630 123.396 -4.766 1 1 859 . 15 1 1 A 74 74 LYS H H 74 10.186 7.909 2.277 1 1 860 . 15 1 1 A 74 74 LYS HA H 74 4.172 3.993 0.179 1 1 867 . 15 1 1 A 74 74 LYS CA C 74 59.848 58.398 1.450 1 1 868 . 15 1 1 A 74 74 LYS CB C 74 34.278 41.477 -7.199 1 1 870 . 15 1 1 A 74 74 LYS N N 74 123.341 119.784 3.557 1 1 871 . 15 1 1 A 75 75 ASP H H 75 7.542 8.259 -0.717 1 1 872 . 15 1 1 A 75 75 ASP HA H 75 3.538 3.945 -0.407 1 1 875 . 15 1 1 A 75 75 ASP CA C 75 52.472 59.896 -7.424 1 1 876 . 15 1 1 A 75 75 ASP CB C 75 42.360 29.231 13.129 1 1 877 . 15 1 1 A 75 75 ASP N N 75 112.035 119.599 -7.564 1 1 878 . 15 1 1 A 76 76 VAL H H 76 8.128 8.436 -0.308 1 1 879 . 15 1 1 A 76 76 VAL HA H 76 4.106 4.031 0.075 1 1 887 . 15 1 1 A 76 76 VAL CA C 76 65.179 59.184 5.995 1 1 888 . 15 1 1 A 76 76 VAL CB C 76 32.174 29.066 3.108 1 1 891 . 15 1 1 A 76 76 VAL N N 76 117.992 120.631 -2.639 1 1 892 . 15 1 1 A 77 77 TRP H H 77 6.869 7.994 -1.125 1 1 893 . 15 1 1 A 77 77 TRP HA H 77 4.509 4.115 0.394 1 1 899 . 15 1 1 A 77 77 TRP CA C 77 59.207 57.750 1.457 1 1 900 . 15 1 1 A 77 77 TRP CB C 77 28.941 41.410 -12.469 1 1 901 . 15 1 1 A 77 77 TRP N N 77 123.077 121.370 1.707 1 1 903 . 15 1 1 A 78 78 GLU H H 78 8.593 8.431 0.162 1 1 904 . 15 1 1 A 78 78 GLU HA H 78 4.318 3.900 0.418 1 1 909 . 15 1 1 A 78 78 GLU CA C 78 60.038 59.205 0.833 1 1 910 . 15 1 1 A 78 78 GLU CB C 78 31.178 28.323 2.855 1 1 912 . 15 1 1 A 78 78 GLU N N 78 121.505 117.752 3.753 1 1 913 . 15 1 1 A 79 79 PHE H H 79 8.071 8.150 -0.079 1 1 914 . 15 1 1 A 79 79 PHE HA H 79 4.986 4.080 0.906 1 1 919 . 15 1 1 A 79 79 PHE CA C 79 58.749 58.769 -0.020 1 1 920 . 15 1 1 A 79 79 PHE CB C 79 39.732 28.931 10.801 1 1 921 . 15 1 1 A 79 79 PHE N N 79 118.384 118.142 0.242 1 1 922 . 15 1 1 A 80 80 LEU H H 80 9.309 7.882 1.427 1 1 923 . 15 1 1 A 80 80 LEU HA H 80 3.970 4.444 -0.474 1 1 933 . 15 1 1 A 80 80 LEU CA C 80 59.307 56.462 2.845 1 1 934 . 15 1 1 A 80 80 LEU CB C 80 43.257 38.229 5.028 1 1 937 . 15 1 1 A 80 80 LEU N N 80 122.915 118.380 4.535 1 1 938 . 15 1 1 A 81 81 GLU H H 81 8.282 7.955 0.327 1 1 939 . 15 1 1 A 81 81 GLU HA H 81 3.832 3.566 0.266 1 1 944 . 15 1 1 A 81 81 GLU CA C 81 62.069 65.229 -3.160 1 1 945 . 15 1 1 A 81 81 GLU CB C 81 30.249 38.088 -7.839 1 1 947 . 15 1 1 A 81 81 GLU N N 81 119.345 120.367 -1.022 1 1 948 . 15 1 1 A 82 82 LEU H H 82 8.236 7.928 0.308 1 1 949 . 15 1 1 A 82 82 LEU HA H 82 4.187 4.374 -0.187 1 1 959 . 15 1 1 A 82 82 LEU CA C 82 58.348 58.731 -0.383 1 1 960 . 15 1 1 A 82 82 LEU CB C 82 42.827 31.958 10.869 1 1 963 . 15 1 1 A 82 82 LEU N N 82 120.013 119.358 0.655 1 1 964 . 15 1 1 A 83 83 GLN H H 83 7.949 8.082 -0.133 1 1 965 . 15 1 1 A 83 83 GLN HA H 83 3.812 3.891 -0.079 1 1 968 . 15 1 1 A 83 83 GLN CA C 83 60.248 58.164 2.084 1 1 969 . 15 1 1 A 83 83 GLN CB C 83 33.537 41.514 -7.977 1 1 970 . 15 1 1 A 83 83 GLN N N 83 116.443 120.298 -3.855 1 1 971 . 15 1 1 A 84 84 ILE H H 84 8.407 8.609 -0.202 1 1 972 . 15 1 1 A 84 84 ILE HA H 84 3.644 4.106 -0.462 1 1 982 . 15 1 1 A 84 84 ILE CA C 84 67.288 58.849 8.439 1 1 983 . 15 1 1 A 84 84 ILE CB C 84 38.305 29.091 9.214 1 1 987 . 15 1 1 A 84 84 ILE N N 84 120.422 117.865 2.557 1 1 988 . 15 1 1 A 85 85 GLU H H 85 7.741 8.205 -0.464 1 1 989 . 15 1 1 A 85 85 GLU HA H 85 3.811 5.011 -1.200 1 1 994 . 15 1 1 A 85 85 GLU CA C 85 59.862 52.710 7.152 1 1 995 . 15 1 1 A 85 85 GLU CB C 85 30.360 46.402 -16.042 1 1 997 . 15 1 1 A 85 85 GLU N N 85 115.705 116.989 -1.284 1 1 998 . 15 1 1 A 86 86 GLU H H 86 7.818 8.714 -0.896 1 1 999 . 15 1 1 A 86 86 GLU HA H 86 4.274 4.702 -0.428 1 1 1004 . 15 1 1 A 86 86 GLU CA C 86 58.068 55.839 2.229 1 1 1005 . 15 1 1 A 86 86 GLU CB C 86 31.424 33.527 -2.103 1 1 1007 . 15 1 1 A 86 86 GLU N N 86 114.297 118.671 -4.374 1 1 1008 . 15 1 1 A 87 87 ILE H H 87 8.753 8.438 0.315 1 1 1019 . 15 1 1 A 87 87 ILE CA C 87 62.660 44.686 17.974 1 1 1024 . 15 1 1 A 87 87 ILE N N 87 118.890 110.224 8.666 1 1 1025 . 15 1 1 A 88 88 TYR H H 88 8.059 8.864 -0.805 1 1 1026 . 15 1 1 A 88 88 TYR HA H 88 5.447 4.169 1.278 1 1 1033 . 15 1 1 A 88 88 TYR CA C 88 55.285 58.207 -2.922 1 1 1034 . 15 1 1 A 88 88 TYR CB C 88 40.687 32.368 8.319 1 1 1035 . 15 1 1 A 88 88 TYR N N 88 119.252 125.576 -6.324 1 1 1036 . 15 1 1 A 89 89 PRO HA H 89 4.410 3.981 0.429 1 1 1043 . 15 1 1 A 89 89 PRO CA C 89 66.374 59.524 6.850 1 1 1044 . 15 1 1 A 89 89 PRO CB C 89 31.377 29.133 2.244 1 1 1047 . 15 1 1 A 90 90 GLU H H 90 9.234 8.248 0.986 1 1 1048 . 15 1 1 A 90 90 GLU HA H 90 4.379 4.013 0.366 1 1 1053 . 15 1 1 A 90 90 GLU CA C 90 59.098 58.716 0.382 1 1 1054 . 15 1 1 A 90 90 GLU CB C 90 29.461 28.158 1.303 1 1 1056 . 15 1 1 A 90 90 GLU N N 90 117.574 118.103 -0.529 1 1 1057 . 15 1 1 A 91 91 GLU H H 91 7.966 8.043 -0.077 1 1 1058 . 15 1 1 A 91 91 GLU HA H 91 4.890 4.075 0.815 1 1 1063 . 15 1 1 A 91 91 GLU CA C 91 55.324 59.063 -3.739 1 1 1064 . 15 1 1 A 91 91 GLU CB C 91 31.590 29.291 2.299 1 1 1066 . 15 1 1 A 91 91 GLU N N 91 119.310 119.861 -0.551 1 1 1067 . 15 1 1 A 92 92 GLU H H 92 7.263 8.184 -0.921 1 1 1068 . 15 1 1 A 92 92 GLU HA H 92 3.789 3.922 -0.133 1 1 1073 . 15 1 1 A 92 92 GLU CA C 92 60.628 57.961 2.667 1 1 1074 . 15 1 1 A 92 92 GLU CB C 92 30.531 41.537 -11.006 1 1 1076 . 15 1 1 A 92 92 GLU N N 92 121.332 120.180 1.152 1 1 1077 . 15 1 1 A 93 93 GLU H H 93 8.646 8.069 0.577 1 1 1078 . 15 1 1 A 93 93 GLU HA H 93 4.127 4.088 0.039 1 1 1083 . 15 1 1 A 93 93 GLU CA C 93 60.528 55.384 5.144 1 1 1084 . 15 1 1 A 93 93 GLU CB C 93 29.744 18.248 11.496 1 1 1086 . 15 1 1 A 93 93 GLU N N 93 118.207 121.317 -3.110 1 1 1087 . 15 1 1 A 94 94 ILE H H 94 7.766 8.332 -0.566 1 1 1088 . 15 1 1 A 94 94 ILE HA H 94 3.976 3.910 0.066 1 1 1098 . 15 1 1 A 94 94 ILE CA C 94 64.361 58.198 6.163 1 1 1099 . 15 1 1 A 94 94 ILE CB C 94 38.921 41.390 -2.469 1 1 1103 . 15 1 1 A 94 94 ILE N N 94 119.072 118.165 0.907 1 1 1104 . 15 1 1 A 95 95 LEU H H 95 8.340 8.096 0.244 1 1 1105 . 15 1 1 A 95 95 LEU HA H 95 4.300 4.142 0.158 1 1 1115 . 15 1 1 A 95 95 LEU CA C 95 57.905 59.451 -1.546 1 1 1116 . 15 1 1 A 95 95 LEU CB C 95 42.144 29.218 12.926 1 1 1119 . 15 1 1 A 95 95 LEU N N 95 121.325 117.645 3.680 1 1 1120 . 15 1 1 A 96 96 LYS H H 96 8.899 7.954 0.945 1 1 1121 . 15 1 1 A 96 96 LYS HA H 96 4.075 4.046 0.029 1 1 1126 . 15 1 1 A 96 96 LYS CA C 96 61.707 57.753 3.954 1 1 1127 . 15 1 1 A 96 96 LYS CB C 96 32.910 41.798 -8.888 1 1 1128 . 15 1 1 A 96 96 LYS N N 96 120.018 122.252 -2.234 1 1 1129 . 15 1 1 A 97 97 LYS H H 97 7.808 8.009 -0.201 1 1 1130 . 15 1 1 A 97 97 LYS HA H 97 4.045 4.314 -0.269 1 1 1139 . 15 1 1 A 97 97 LYS CA C 97 60.198 55.699 4.499 1 1 1140 . 15 1 1 A 97 97 LYS CB C 97 32.600 41.206 -8.606 1 1 1143 . 15 1 1 A 97 97 LYS N N 97 121.016 115.727 5.289 1 1 1144 . 15 1 1 A 98 98 ALA H H 98 7.814 8.320 -0.506 1 1 1145 . 15 1 1 A 98 98 ALA HA H 98 4.320 4.724 -0.404 1 1 1149 . 15 1 1 A 98 98 ALA CA C 98 55.260 54.654 0.606 1 1 1150 . 15 1 1 A 98 98 ALA CB C 98 19.468 39.318 -19.850 1 1 1151 . 15 1 1 A 98 98 ALA N N 98 122.102 116.236 5.866 1 1 1152 . 15 1 1 A 99 99 LEU H H 99 8.212 7.834 0.378 1 1 1153 . 15 1 1 A 99 99 LEU HA H 99 4.187 4.725 -0.538 1 1 1160 . 15 1 1 A 99 99 LEU CA C 99 58.398 56.678 1.720 1 1 1161 . 15 1 1 A 99 99 LEU CB C 99 42.720 36.685 6.035 1 1 1164 . 15 1 1 A 99 99 LEU N N 99 118.467 115.930 2.537 1 1 1165 . 15 1 1 A 100 100 ARG H H 100 7.738 7.634 0.104 1 1 1166 . 15 1 1 A 100 100 ARG HA H 100 3.894 5.205 -1.311 1 1 1173 . 15 1 1 A 100 100 ARG CA C 100 60.135 52.792 7.343 1 1 1174 . 15 1 1 A 100 100 ARG CB C 100 30.187 45.805 -15.618 1 1 1177 . 15 1 1 A 100 100 ARG N N 100 119.100 117.820 1.280 1 1 1178 . 15 1 1 A 101 101 ASP H H 101 8.186 8.533 -0.347 1 1 1179 . 15 1 1 A 101 101 ASP HA H 101 4.424 4.980 -0.556 1 1 1182 . 15 1 1 A 101 101 ASP CA C 101 57.902 51.722 6.180 1 1 1183 . 15 1 1 A 101 101 ASP CB C 101 40.033 40.811 -0.778 1 1 1184 . 15 1 1 A 101 101 ASP N N 101 121.899 116.952 4.947 1 1 1185 . 15 1 1 A 102 102 LEU H H 102 8.730 8.586 0.144 1 1 1186 . 15 1 1 A 102 102 LEU HA H 102 4.373 4.203 0.170 1 1 1195 . 15 1 1 A 102 102 LEU CA C 102 58.218 58.092 0.126 1 1 1196 . 15 1 1 A 102 102 LEU CB C 102 42.839 29.234 13.605 1 1 1199 . 15 1 1 A 102 102 LEU N N 102 124.505 121.071 3.434 1 1 1200 . 15 1 1 A 103 103 LYS HA H 103 3.726 4.341 -0.615 1 1 1209 . 15 1 1 A 103 103 LYS CA C 103 59.760 56.081 3.679 1 1 1210 . 15 1 1 A 103 103 LYS CB C 103 32.822 32.939 -0.117 1 1 1214 . 15 1 1 A 104 104 ARG H H 104 7.409 8.089 -0.680 1 1 1222 . 15 1 1 A 104 104 ARG CA C 104 56.298 45.218 11.080 1 1 1226 . 15 1 1 A 104 104 ARG N N 104 115.912 106.144 9.768 1 1 1227 . 15 1 1 A 105 105 GLY H H 105 8.046 7.639 0.407 1 1 1230 . 15 1 1 A 105 105 GLY CA C 105 46.309 55.340 -9.031 1 1 1231 . 15 1 1 A 105 105 GLY N N 105 108.860 115.637 -6.777 1 1 1232 . 15 1 1 A 106 106 LYS H H 106 8.033 8.510 -0.477 1 1 1233 . 15 1 1 A 106 106 LYS HA H 106 4.394 4.266 0.128 1 1 1242 . 15 1 1 A 106 106 LYS CA C 106 55.822 55.166 0.656 1 1 1243 . 15 1 1 A 106 106 LYS CB C 106 33.449 42.669 -9.220 1 1 1246 . 15 1 1 A 106 106 LYS N N 106 121.082 119.104 1.978 1 1 1247 . 15 1 1 A 107 107 LYS H H 107 8.271 8.472 -0.201 1 1 1248 . 15 1 1 A 107 107 LYS HA H 107 4.329 4.482 -0.153 1 1 1255 . 15 1 1 A 107 107 LYS CA C 107 56.673 59.079 -2.406 1 1 1256 . 15 1 1 A 107 107 LYS CB C 107 33.341 64.270 -30.929 1 1 1258 . 15 1 1 A 107 107 LYS N N 107 121.869 114.504 7.365 1 1 1259 . 15 1 1 A 108 108 LEU H H 108 8.481 7.432 1.049 1 1 1260 . 15 1 1 A 108 108 LEU HA H 108 4.637 5.082 -0.445 1 1 1269 . 15 1 1 A 108 108 LEU CA C 108 53.819 54.615 -0.796 1 1 1270 . 15 1 1 A 108 108 LEU CB C 108 45.135 35.233 9.902 1 1 1272 . 15 1 1 A 108 108 LEU N N 108 124.360 117.935 6.425 1 1 1273 . 15 1 1 A 109 109 LYS H H 109 8.657 8.939 -0.282 1 1 1274 . 15 1 1 A 109 109 LYS HA H 109 4.565 4.519 0.046 1 1 1283 . 15 1 1 A 109 109 LYS CA C 109 55.511 58.846 -3.335 1 1 1284 . 15 1 1 A 109 109 LYS CB C 109 32.029 64.152 -32.123 1 1 1287 . 15 1 1 A 109 109 LYS N N 109 123.165 117.749 5.416 1 1 1288 . 15 1 1 A 110 110 PRO HA H 110 4.232 3.587 0.645 1 1 1295 . 15 1 1 A 110 110 PRO CA C 110 66.732 66.784 -0.052 1 1 1296 . 15 1 1 A 110 110 PRO CB C 110 32.481 31.606 0.875 1 1 1299 . 15 1 1 A 111 111 GLU HA H 111 4.221 3.926 0.295 1 1 1304 . 15 1 1 A 111 111 GLU CA C 111 59.819 59.866 -0.047 1 1 1305 . 15 1 1 A 111 111 GLU CB C 111 29.250 29.154 0.096 1 1 1307 . 15 1 1 A 112 112 ILE H H 112 7.233 8.161 -0.928 1 1 1308 . 15 1 1 A 112 112 ILE HA H 112 3.848 4.080 -0.232 1 1 1318 . 15 1 1 A 112 112 ILE CA C 112 62.635 59.182 3.453 1 1 1319 . 15 1 1 A 112 112 ILE CB C 112 37.159 29.328 7.831 1 1 1323 . 15 1 1 A 112 112 ILE N N 112 120.783 118.200 2.583 1 1 1324 . 15 1 1 A 113 113 LYS H H 113 8.268 8.083 0.185 1 1 1325 . 15 1 1 A 113 113 LYS HA H 113 3.849 3.716 0.133 1 1 1328 . 15 1 1 A 113 113 LYS CA C 113 60.248 65.272 -5.024 1 1 1329 . 15 1 1 A 113 113 LYS CB C 113 32.668 37.299 -4.631 1 1 1330 . 15 1 1 A 113 113 LYS N N 113 121.680 121.795 -0.115 1 1 1331 . 15 1 1 A 114 114 GLY H H 114 8.460 8.374 0.086 1 1 1334 . 15 1 1 A 114 114 GLY CA C 114 47.600 61.419 -13.819 1 1 1335 . 15 1 1 A 114 114 GLY N N 114 105.413 115.331 -9.918 1 1 1336 . 15 1 1 A 115 115 LYS H H 115 7.352 8.014 -0.662 1 1 1337 . 15 1 1 A 115 115 LYS HA H 115 4.189 4.380 -0.191 1 1 1346 . 15 1 1 A 115 115 LYS CA C 115 59.689 57.325 2.364 1 1 1347 . 15 1 1 A 115 115 LYS CB C 115 33.428 40.317 -6.889 1 1 1351 . 15 1 1 A 115 115 LYS N N 115 121.599 122.530 -0.931 1 1 1352 . 15 1 1 A 116 116 LEU H H 116 8.046 8.041 0.005 1 1 1353 . 15 1 1 A 116 116 LEU HA H 116 4.153 3.858 0.295 1 1 1363 . 15 1 1 A 116 116 LEU CA C 116 57.698 64.848 -7.150 1 1 1364 . 15 1 1 A 116 116 LEU CB C 116 42.070 31.593 10.477 1 1 1366 . 15 1 1 A 116 116 LEU N N 116 118.827 118.559 0.268 1 1 1367 . 15 1 1 A 117 117 SER H H 117 8.321 7.539 0.782 1 1 1368 . 15 1 1 A 117 117 SER HA H 117 4.334 4.212 0.122 1 1 1371 . 15 1 1 A 117 117 SER CA C 117 61.467 54.303 7.164 1 1 1372 . 15 1 1 A 117 117 SER CB C 117 63.613 42.080 21.533 1 1 1373 . 15 1 1 A 117 117 SER N N 117 114.829 115.741 -0.912 1 1 1374 . 15 1 1 A 118 118 ARG H H 118 7.001 7.569 -0.568 1 1 1375 . 15 1 1 A 118 118 ARG HA H 118 4.403 3.879 0.524 1 1 1382 . 15 1 1 A 118 118 ARG CA C 118 56.734 57.038 -0.304 1 1 1383 . 15 1 1 A 118 118 ARG CB C 118 31.115 27.303 3.812 1 1 1385 . 15 1 1 A 118 118 ARG N N 118 118.114 114.242 3.872 1 1 1386 . 15 1 1 A 119 119 LEU H H 119 7.365 8.316 -0.951 1 1 1387 . 15 1 1 A 119 119 LEU HA H 119 4.253 4.879 -0.626 1 1 1397 . 15 1 1 A 119 119 LEU CA C 119 54.639 57.751 -3.112 1 1 1398 . 15 1 1 A 119 119 LEU CB C 119 41.700 31.449 10.251 1 1 1401 . 15 1 1 A 119 119 LEU N N 119 119.181 117.428 1.753 1 1 1402 . 15 1 1 A 120 120 ARG H H 120 8.766 8.729 0.037 1 1 1403 . 15 1 1 A 120 120 ARG HA H 120 4.374 4.433 -0.059 1 1 1410 . 15 1 1 A 120 120 ARG CA C 120 56.426 59.204 -2.778 1 1 1411 . 15 1 1 A 120 120 ARG CB C 120 32.414 63.734 -31.320 1 1 1414 . 15 1 1 A 120 120 ARG N N 120 122.099 120.683 1.416 1 1 1415 . 15 1 1 A 121 121 LEU H H 121 8.312 8.727 -0.415 1 1 1416 . 15 1 1 A 121 121 LEU HA H 121 4.407 3.562 0.845 1 1 1426 . 15 1 1 A 121 121 LEU CA C 121 56.028 67.003 -10.975 1 1 1427 . 15 1 1 A 121 121 LEU CB C 121 43.122 31.977 11.145 1 1 1430 . 15 1 1 A 121 121 LEU N N 121 118.761 124.123 -5.362 1 1 1431 . 15 1 1 A 122 122 PHE H H 122 7.143 8.359 -1.216 1 1 1432 . 15 1 1 A 122 122 PHE HA H 122 5.201 4.313 0.888 1 1 1439 . 15 1 1 A 122 122 PHE CA C 122 53.047 59.140 -6.093 1 1 1440 . 15 1 1 A 122 122 PHE CB C 122 40.844 29.369 11.475 1 1 1441 . 15 1 1 A 122 122 PHE N N 122 112.750 120.120 -7.370 1 1 1442 . 15 1 1 A 123 123 PRO HA H 123 3.908 4.008 -0.100 1 1 1449 . 15 1 1 A 123 123 PRO CA C 123 65.478 59.146 6.332 1 1 1450 . 15 1 1 A 123 123 PRO CB C 123 33.248 29.377 3.871 1 1 1452 . 15 1 1 A 124 124 LEU H H 124 7.208 7.995 -0.787 1 1 1453 . 15 1 1 A 124 124 LEU HA H 124 4.673 4.082 0.591 1 1 1463 . 15 1 1 A 124 124 LEU CA C 124 53.307 57.974 -4.667 1 1 1464 . 15 1 1 A 124 124 LEU CB C 124 42.853 42.572 0.281 1 1 1468 . 15 1 1 A 124 124 LEU N N 124 113.875 121.101 -7.226 1 1 1469 . 15 1 1 A 125 125 SER H H 125 8.990 8.062 0.928 1 1 1470 . 15 1 1 A 125 125 SER HA H 125 4.533 3.975 0.558 1 1 1473 . 15 1 1 A 125 125 SER CA C 125 59.198 59.556 -0.358 1 1 1474 . 15 1 1 A 125 125 SER CB C 125 64.578 29.236 35.342 1 1 1475 . 15 1 1 A 125 125 SER N N 125 117.894 119.439 -1.545 1 1 1476 . 15 1 1 A 126 126 SER H H 126 8.618 7.637 0.981 1 1 1477 . 15 1 1 A 126 126 SER HA H 126 4.614 4.009 0.605 1 1 1480 . 15 1 1 A 126 126 SER CA C 126 58.730 59.390 -0.660 1 1 1481 . 15 1 1 A 126 126 SER CB C 126 64.367 32.266 32.101 1 1 1482 . 15 1 1 A 126 126 SER N N 126 118.602 119.817 -1.215 1 1 1483 . 15 1 1 A 127 127 SER HA H 127 4.530 3.797 0.733 1 1 1486 . 15 1 1 A 127 127 SER CA C 127 58.954 65.609 -6.655 1 1 1487 . 15 1 1 A 127 127 SER CB C 127 64.379 31.589 32.790 1 1 1488 . 15 1 1 A 128 128 ALA H H 128 8.345 8.696 -0.351 1 1 1489 . 15 1 1 A 128 128 ALA HA H 128 4.432 4.007 0.425 1 1 1493 . 15 1 1 A 128 128 ALA CA C 128 52.963 58.764 -5.801 1 1 1494 . 15 1 1 A 128 128 ALA CB C 128 19.924 29.994 -10.070 1 1 1495 . 15 1 1 A 128 128 ALA N N 128 126.185 120.785 5.400 1 1 1496 . 15 1 1 A 129 129 GLU H H 129 8.329 7.738 0.591 1 1 1497 . 15 1 1 A 129 129 GLU HA H 129 4.353 4.075 0.278 1 1 1502 . 15 1 1 A 129 129 GLU CA C 129 57.111 58.611 -1.500 1 1 1503 . 15 1 1 A 129 129 GLU CB C 129 30.949 28.577 2.372 1 1 1504 . 15 1 1 A 129 129 GLU N N 129 120.842 118.734 2.108 1 1 1505 . 15 1 1 A 130 130 LYS H H 130 7.947 8.025 -0.078 1 1 1506 . 15 1 1 A 130 130 LYS HA H 130 3.835 4.034 -0.199 1 1 1515 . 15 1 1 A 130 130 LYS CA C 130 57.756 59.697 -1.941 1 1 1516 . 15 1 1 A 130 130 LYS CB C 130 33.156 32.137 1.019 1 1 826 . 16 1 1 A 70 70 GLY H H 70 9.295 8.398 0.897 1 1 829 . 16 1 1 A 70 70 GLY CA C 70 46.552 59.746 -13.194 1 1 830 . 16 1 1 A 70 70 GLY N N 70 108.643 117.158 -8.515 1 1 832 . 16 1 1 A 71 71 VAL HA H 71 3.538 4.803 -1.265 1 1 840 . 16 1 1 A 71 71 VAL CA C 71 65.623 62.752 2.871 1 1 841 . 16 1 1 A 71 71 VAL CB C 71 30.251 31.919 -1.668 1 1 844 . 16 1 1 A 71 71 VAL N N 71 110.808 136.447 -25.639 1 1 845 . 16 1 1 A 72 72 CYS H H 72 8.022 8.958 -0.936 1 1 846 . 16 1 1 A 72 72 CYS HA H 72 3.469 4.844 -1.375 1 1 849 . 16 1 1 A 72 72 CYS CA C 72 62.733 57.471 5.262 1 1 850 . 16 1 1 A 72 72 CYS CB C 72 27.163 64.248 -37.085 1 1 851 . 16 1 1 A 72 72 CYS N N 72 109.483 118.839 -9.356 1 1 852 . 16 1 1 A 73 73 SER H H 73 7.996 8.312 -0.316 1 1 853 . 16 1 1 A 73 73 SER HA H 73 4.439 4.105 0.334 1 1 856 . 16 1 1 A 73 73 SER CA C 73 62.145 59.273 2.872 1 1 857 . 16 1 1 A 73 73 SER CB C 73 66.013 29.305 36.708 1 1 858 . 16 1 1 A 73 73 SER N N 73 118.630 121.366 -2.736 1 1 859 . 16 1 1 A 74 74 LYS H H 74 10.186 7.951 2.235 1 1 860 . 16 1 1 A 74 74 LYS HA H 74 4.172 3.968 0.204 1 1 867 . 16 1 1 A 74 74 LYS CA C 74 59.848 58.380 1.468 1 1 868 . 16 1 1 A 74 74 LYS CB C 74 34.278 41.452 -7.174 1 1 870 . 16 1 1 A 74 74 LYS N N 74 123.341 117.674 5.667 1 1 871 . 16 1 1 A 75 75 ASP H H 75 7.542 8.229 -0.687 1 1 872 . 16 1 1 A 75 75 ASP HA H 75 3.538 3.932 -0.394 1 1 875 . 16 1 1 A 75 75 ASP CA C 75 52.472 59.924 -7.452 1 1 876 . 16 1 1 A 75 75 ASP CB C 75 42.360 29.304 13.056 1 1 877 . 16 1 1 A 75 75 ASP N N 75 112.035 119.590 -7.555 1 1 878 . 16 1 1 A 76 76 VAL H H 76 8.128 8.331 -0.203 1 1 879 . 16 1 1 A 76 76 VAL HA H 76 4.106 4.022 0.084 1 1 887 . 16 1 1 A 76 76 VAL CA C 76 65.179 59.129 6.050 1 1 888 . 16 1 1 A 76 76 VAL CB C 76 32.174 29.041 3.133 1 1 891 . 16 1 1 A 76 76 VAL N N 76 117.992 120.725 -2.733 1 1 892 . 16 1 1 A 77 77 TRP H H 77 6.869 7.973 -1.104 1 1 893 . 16 1 1 A 77 77 TRP HA H 77 4.509 4.096 0.413 1 1 899 . 16 1 1 A 77 77 TRP CA C 77 59.207 57.791 1.416 1 1 900 . 16 1 1 A 77 77 TRP CB C 77 28.941 41.480 -12.539 1 1 901 . 16 1 1 A 77 77 TRP N N 77 123.077 121.348 1.729 1 1 903 . 16 1 1 A 78 78 GLU H H 78 8.593 8.252 0.341 1 1 904 . 16 1 1 A 78 78 GLU HA H 78 4.318 3.902 0.416 1 1 909 . 16 1 1 A 78 78 GLU CA C 78 60.038 59.210 0.828 1 1 910 . 16 1 1 A 78 78 GLU CB C 78 31.178 28.325 2.853 1 1 912 . 16 1 1 A 78 78 GLU N N 78 121.505 117.857 3.648 1 1 913 . 16 1 1 A 79 79 PHE H H 79 8.071 8.166 -0.095 1 1 914 . 16 1 1 A 79 79 PHE HA H 79 4.986 4.070 0.916 1 1 919 . 16 1 1 A 79 79 PHE CA C 79 58.749 58.667 0.082 1 1 920 . 16 1 1 A 79 79 PHE CB C 79 39.732 28.964 10.768 1 1 921 . 16 1 1 A 79 79 PHE N N 79 118.384 118.130 0.254 1 1 922 . 16 1 1 A 80 80 LEU H H 80 9.309 7.900 1.409 1 1 923 . 16 1 1 A 80 80 LEU HA H 80 3.970 4.437 -0.467 1 1 933 . 16 1 1 A 80 80 LEU CA C 80 59.307 56.409 2.898 1 1 934 . 16 1 1 A 80 80 LEU CB C 80 43.257 38.093 5.164 1 1 937 . 16 1 1 A 80 80 LEU N N 80 122.915 118.363 4.552 1 1 938 . 16 1 1 A 81 81 GLU H H 81 8.282 8.030 0.252 1 1 939 . 16 1 1 A 81 81 GLU HA H 81 3.832 3.585 0.247 1 1 944 . 16 1 1 A 81 81 GLU CA C 81 62.069 65.165 -3.096 1 1 945 . 16 1 1 A 81 81 GLU CB C 81 30.249 38.155 -7.906 1 1 947 . 16 1 1 A 81 81 GLU N N 81 119.345 120.530 -1.185 1 1 948 . 16 1 1 A 82 82 LEU H H 82 8.236 7.907 0.329 1 1 949 . 16 1 1 A 82 82 LEU HA H 82 4.187 4.369 -0.182 1 1 959 . 16 1 1 A 82 82 LEU CA C 82 58.348 58.861 -0.513 1 1 960 . 16 1 1 A 82 82 LEU CB C 82 42.827 31.931 10.896 1 1 963 . 16 1 1 A 82 82 LEU N N 82 120.013 119.347 0.666 1 1 964 . 16 1 1 A 83 83 GLN H H 83 7.949 8.219 -0.270 1 1 965 . 16 1 1 A 83 83 GLN HA H 83 3.812 3.961 -0.149 1 1 968 . 16 1 1 A 83 83 GLN CA C 83 60.248 57.963 2.285 1 1 969 . 16 1 1 A 83 83 GLN CB C 83 33.537 41.318 -7.781 1 1 970 . 16 1 1 A 83 83 GLN N N 83 116.443 120.820 -4.377 1 1 971 . 16 1 1 A 84 84 ILE H H 84 8.407 7.673 0.734 1 1 972 . 16 1 1 A 84 84 ILE HA H 84 3.644 4.269 -0.625 1 1 982 . 16 1 1 A 84 84 ILE CA C 84 67.288 58.664 8.624 1 1 983 . 16 1 1 A 84 84 ILE CB C 84 38.305 30.464 7.841 1 1 987 . 16 1 1 A 84 84 ILE N N 84 120.422 117.448 2.974 1 1 988 . 16 1 1 A 85 85 GLU H H 85 7.741 7.893 -0.152 1 1 989 . 16 1 1 A 85 85 GLU HA H 85 3.811 5.012 -1.201 1 1 994 . 16 1 1 A 85 85 GLU CA C 85 59.862 52.830 7.032 1 1 995 . 16 1 1 A 85 85 GLU CB C 85 30.360 44.887 -14.527 1 1 997 . 16 1 1 A 85 85 GLU N N 85 115.705 116.391 -0.686 1 1 998 . 16 1 1 A 86 86 GLU H H 86 7.818 8.644 -0.826 1 1 999 . 16 1 1 A 86 86 GLU HA H 86 4.274 4.707 -0.433 1 1 1004 . 16 1 1 A 86 86 GLU CA C 86 58.068 55.616 2.452 1 1 1005 . 16 1 1 A 86 86 GLU CB C 86 31.424 33.895 -2.471 1 1 1007 . 16 1 1 A 86 86 GLU N N 86 114.297 118.394 -4.097 1 1 1008 . 16 1 1 A 87 87 ILE H H 87 8.753 8.475 0.278 1 1 1019 . 16 1 1 A 87 87 ILE CA C 87 62.660 44.669 17.991 1 1 1024 . 16 1 1 A 87 87 ILE N N 87 118.890 109.527 9.363 1 1 1025 . 16 1 1 A 88 88 TYR H H 88 8.059 8.782 -0.723 1 1 1026 . 16 1 1 A 88 88 TYR HA H 88 5.447 4.212 1.235 1 1 1033 . 16 1 1 A 88 88 TYR CA C 88 55.285 58.755 -3.470 1 1 1034 . 16 1 1 A 88 88 TYR CB C 88 40.687 32.101 8.586 1 1 1035 . 16 1 1 A 88 88 TYR N N 88 119.252 125.158 -5.906 1 1 1036 . 16 1 1 A 89 89 PRO HA H 89 4.410 3.989 0.421 1 1 1043 . 16 1 1 A 89 89 PRO CA C 89 66.374 59.480 6.894 1 1 1044 . 16 1 1 A 89 89 PRO CB C 89 31.377 29.135 2.242 1 1 1047 . 16 1 1 A 90 90 GLU H H 90 9.234 8.253 0.981 1 1 1048 . 16 1 1 A 90 90 GLU HA H 90 4.379 4.012 0.367 1 1 1053 . 16 1 1 A 90 90 GLU CA C 90 59.098 58.720 0.378 1 1 1054 . 16 1 1 A 90 90 GLU CB C 90 29.461 28.137 1.324 1 1 1056 . 16 1 1 A 90 90 GLU N N 90 117.574 118.123 -0.549 1 1 1057 . 16 1 1 A 91 91 GLU H H 91 7.966 8.080 -0.114 1 1 1058 . 16 1 1 A 91 91 GLU HA H 91 4.890 4.075 0.815 1 1 1063 . 16 1 1 A 91 91 GLU CA C 91 55.324 58.958 -3.634 1 1 1064 . 16 1 1 A 91 91 GLU CB C 91 31.590 29.251 2.339 1 1 1066 . 16 1 1 A 91 91 GLU N N 91 119.310 119.725 -0.415 1 1 1067 . 16 1 1 A 92 92 GLU H H 92 7.263 8.184 -0.921 1 1 1068 . 16 1 1 A 92 92 GLU HA H 92 3.789 3.919 -0.130 1 1 1073 . 16 1 1 A 92 92 GLU CA C 92 60.628 57.958 2.670 1 1 1074 . 16 1 1 A 92 92 GLU CB C 92 30.531 41.506 -10.975 1 1 1076 . 16 1 1 A 92 92 GLU N N 92 121.332 120.496 0.836 1 1 1077 . 16 1 1 A 93 93 GLU H H 93 8.646 8.111 0.535 1 1 1078 . 16 1 1 A 93 93 GLU HA H 93 4.127 4.088 0.039 1 1 1083 . 16 1 1 A 93 93 GLU CA C 93 60.528 55.403 5.125 1 1 1084 . 16 1 1 A 93 93 GLU CB C 93 29.744 18.251 11.493 1 1 1086 . 16 1 1 A 93 93 GLU N N 93 118.207 121.339 -3.132 1 1 1087 . 16 1 1 A 94 94 ILE H H 94 7.766 8.307 -0.541 1 1 1088 . 16 1 1 A 94 94 ILE HA H 94 3.976 3.920 0.056 1 1 1098 . 16 1 1 A 94 94 ILE CA C 94 64.361 58.155 6.206 1 1 1099 . 16 1 1 A 94 94 ILE CB C 94 38.921 41.412 -2.491 1 1 1103 . 16 1 1 A 94 94 ILE N N 94 119.072 118.161 0.911 1 1 1104 . 16 1 1 A 95 95 LEU H H 95 8.340 8.042 0.298 1 1 1105 . 16 1 1 A 95 95 LEU HA H 95 4.300 4.149 0.151 1 1 1115 . 16 1 1 A 95 95 LEU CA C 95 57.905 59.502 -1.597 1 1 1116 . 16 1 1 A 95 95 LEU CB C 95 42.144 29.230 12.914 1 1 1119 . 16 1 1 A 95 95 LEU N N 95 121.325 117.780 3.545 1 1 1120 . 16 1 1 A 96 96 LYS H H 96 8.899 7.942 0.957 1 1 1121 . 16 1 1 A 96 96 LYS HA H 96 4.075 4.027 0.048 1 1 1126 . 16 1 1 A 96 96 LYS CA C 96 61.707 57.841 3.866 1 1 1127 . 16 1 1 A 96 96 LYS CB C 96 32.910 41.737 -8.827 1 1 1128 . 16 1 1 A 96 96 LYS N N 96 120.018 122.086 -2.068 1 1 1129 . 16 1 1 A 97 97 LYS H H 97 7.808 8.003 -0.195 1 1 1130 . 16 1 1 A 97 97 LYS HA H 97 4.045 4.325 -0.280 1 1 1139 . 16 1 1 A 97 97 LYS CA C 97 60.198 56.110 4.088 1 1 1140 . 16 1 1 A 97 97 LYS CB C 97 32.600 41.275 -8.675 1 1 1143 . 16 1 1 A 97 97 LYS N N 97 121.016 115.620 5.396 1 1 1144 . 16 1 1 A 98 98 ALA H H 98 7.814 8.263 -0.449 1 1 1145 . 16 1 1 A 98 98 ALA HA H 98 4.320 4.695 -0.375 1 1 1149 . 16 1 1 A 98 98 ALA CA C 98 55.260 54.562 0.698 1 1 1150 . 16 1 1 A 98 98 ALA CB C 98 19.468 39.424 -19.956 1 1 1151 . 16 1 1 A 98 98 ALA N N 98 122.102 116.651 5.451 1 1 1152 . 16 1 1 A 99 99 LEU H H 99 8.212 7.923 0.289 1 1 1153 . 16 1 1 A 99 99 LEU HA H 99 4.187 4.790 -0.603 1 1 1160 . 16 1 1 A 99 99 LEU CA C 99 58.398 56.576 1.822 1 1 1161 . 16 1 1 A 99 99 LEU CB C 99 42.720 36.691 6.029 1 1 1164 . 16 1 1 A 99 99 LEU N N 99 118.467 115.732 2.735 1 1 1165 . 16 1 1 A 100 100 ARG H H 100 7.738 7.469 0.269 1 1 1166 . 16 1 1 A 100 100 ARG HA H 100 3.894 5.180 -1.286 1 1 1173 . 16 1 1 A 100 100 ARG CA C 100 60.135 53.128 7.007 1 1 1174 . 16 1 1 A 100 100 ARG CB C 100 30.187 44.986 -14.799 1 1 1177 . 16 1 1 A 100 100 ARG N N 100 119.100 118.315 0.785 1 1 1178 . 16 1 1 A 101 101 ASP H H 101 8.186 8.513 -0.327 1 1 1179 . 16 1 1 A 101 101 ASP HA H 101 4.424 4.928 -0.504 1 1 1182 . 16 1 1 A 101 101 ASP CA C 101 57.902 52.563 5.339 1 1 1183 . 16 1 1 A 101 101 ASP CB C 101 40.033 39.582 0.451 1 1 1184 . 16 1 1 A 101 101 ASP N N 101 121.899 118.373 3.526 1 1 1185 . 16 1 1 A 102 102 LEU H H 102 8.730 8.666 0.064 1 1 1186 . 16 1 1 A 102 102 LEU HA H 102 4.373 4.166 0.207 1 1 1195 . 16 1 1 A 102 102 LEU CA C 102 58.218 58.125 0.093 1 1 1196 . 16 1 1 A 102 102 LEU CB C 102 42.839 29.150 13.689 1 1 1199 . 16 1 1 A 102 102 LEU N N 102 124.505 120.963 3.542 1 1 1200 . 16 1 1 A 103 103 LYS HA H 103 3.726 4.071 -0.345 1 1 1209 . 16 1 1 A 103 103 LYS CA C 103 59.760 55.748 4.012 1 1 1210 . 16 1 1 A 103 103 LYS CB C 103 32.822 32.283 0.539 1 1 1214 . 16 1 1 A 104 104 ARG H H 104 7.409 7.554 -0.145 1 1 1222 . 16 1 1 A 104 104 ARG CA C 104 56.298 44.968 11.330 1 1 1226 . 16 1 1 A 104 104 ARG N N 104 115.912 105.448 10.464 1 1 1227 . 16 1 1 A 105 105 GLY H H 105 8.046 7.014 1.032 1 1 1230 . 16 1 1 A 105 105 GLY CA C 105 46.309 55.301 -8.992 1 1 1231 . 16 1 1 A 105 105 GLY N N 105 108.860 117.942 -9.082 1 1 1232 . 16 1 1 A 106 106 LYS H H 106 8.033 8.397 -0.364 1 1 1233 . 16 1 1 A 106 106 LYS HA H 106 4.394 4.382 0.012 1 1 1242 . 16 1 1 A 106 106 LYS CA C 106 55.822 55.375 0.447 1 1 1243 . 16 1 1 A 106 106 LYS CB C 106 33.449 42.885 -9.436 1 1 1246 . 16 1 1 A 106 106 LYS N N 106 121.082 117.711 3.371 1 1 1247 . 16 1 1 A 107 107 LYS H H 107 8.271 9.172 -0.901 1 1 1248 . 16 1 1 A 107 107 LYS HA H 107 4.329 4.692 -0.363 1 1 1255 . 16 1 1 A 107 107 LYS CA C 107 56.673 58.529 -1.856 1 1 1256 . 16 1 1 A 107 107 LYS CB C 107 33.341 64.054 -30.713 1 1 1258 . 16 1 1 A 107 107 LYS N N 107 121.869 113.636 8.233 1 1 1259 . 16 1 1 A 108 108 LEU H H 108 8.481 7.579 0.902 1 1 1260 . 16 1 1 A 108 108 LEU HA H 108 4.637 4.934 -0.297 1 1 1269 . 16 1 1 A 108 108 LEU CA C 108 53.819 54.651 -0.832 1 1 1270 . 16 1 1 A 108 108 LEU CB C 108 45.135 36.200 8.935 1 1 1272 . 16 1 1 A 108 108 LEU N N 108 124.360 119.719 4.641 1 1 1273 . 16 1 1 A 109 109 LYS H H 109 8.657 8.866 -0.209 1 1 1274 . 16 1 1 A 109 109 LYS HA H 109 4.565 4.491 0.074 1 1 1283 . 16 1 1 A 109 109 LYS CA C 109 55.511 59.151 -3.640 1 1 1284 . 16 1 1 A 109 109 LYS CB C 109 32.029 64.132 -32.103 1 1 1287 . 16 1 1 A 109 109 LYS N N 109 123.165 117.701 5.464 1 1 1288 . 16 1 1 A 110 110 PRO HA H 110 4.232 3.587 0.645 1 1 1295 . 16 1 1 A 110 110 PRO CA C 110 66.732 66.593 0.139 1 1 1296 . 16 1 1 A 110 110 PRO CB C 110 32.481 31.567 0.914 1 1 1299 . 16 1 1 A 111 111 GLU HA H 111 4.221 3.873 0.348 1 1 1304 . 16 1 1 A 111 111 GLU CA C 111 59.819 59.769 0.050 1 1 1305 . 16 1 1 A 111 111 GLU CB C 111 29.250 29.157 0.093 1 1 1307 . 16 1 1 A 112 112 ILE H H 112 7.233 8.232 -0.999 1 1 1308 . 16 1 1 A 112 112 ILE HA H 112 3.848 4.069 -0.221 1 1 1318 . 16 1 1 A 112 112 ILE CA C 112 62.635 59.127 3.508 1 1 1319 . 16 1 1 A 112 112 ILE CB C 112 37.159 29.291 7.868 1 1 1323 . 16 1 1 A 112 112 ILE N N 112 120.783 118.142 2.641 1 1 1324 . 16 1 1 A 113 113 LYS H H 113 8.268 8.009 0.259 1 1 1325 . 16 1 1 A 113 113 LYS HA H 113 3.849 3.644 0.205 1 1 1328 . 16 1 1 A 113 113 LYS CA C 113 60.248 64.888 -4.640 1 1 1329 . 16 1 1 A 113 113 LYS CB C 113 32.668 37.409 -4.741 1 1 1330 . 16 1 1 A 113 113 LYS N N 113 121.680 121.684 -0.004 1 1 1331 . 16 1 1 A 114 114 GLY H H 114 8.460 8.305 0.155 1 1 1334 . 16 1 1 A 114 114 GLY CA C 114 47.600 61.128 -13.528 1 1 1335 . 16 1 1 A 114 114 GLY N N 114 105.413 115.150 -9.737 1 1 1336 . 16 1 1 A 115 115 LYS H H 115 7.352 7.880 -0.528 1 1 1337 . 16 1 1 A 115 115 LYS HA H 115 4.189 4.415 -0.226 1 1 1346 . 16 1 1 A 115 115 LYS CA C 115 59.689 57.275 2.414 1 1 1347 . 16 1 1 A 115 115 LYS CB C 115 33.428 40.593 -7.165 1 1 1351 . 16 1 1 A 115 115 LYS N N 115 121.599 122.194 -0.595 1 1 1352 . 16 1 1 A 116 116 LEU H H 116 8.046 7.935 0.111 1 1 1353 . 16 1 1 A 116 116 LEU HA H 116 4.153 3.864 0.289 1 1 1363 . 16 1 1 A 116 116 LEU CA C 116 57.698 64.932 -7.234 1 1 1364 . 16 1 1 A 116 116 LEU CB C 116 42.070 31.580 10.490 1 1 1366 . 16 1 1 A 116 116 LEU N N 116 118.827 119.111 -0.284 1 1 1367 . 16 1 1 A 117 117 SER H H 117 8.321 7.541 0.780 1 1 1368 . 16 1 1 A 117 117 SER HA H 117 4.334 4.194 0.140 1 1 1371 . 16 1 1 A 117 117 SER CA C 117 61.467 54.237 7.230 1 1 1372 . 16 1 1 A 117 117 SER CB C 117 63.613 41.946 21.667 1 1 1373 . 16 1 1 A 117 117 SER N N 117 114.829 116.047 -1.218 1 1 1374 . 16 1 1 A 118 118 ARG H H 118 7.001 7.820 -0.819 1 1 1375 . 16 1 1 A 118 118 ARG HA H 118 4.403 3.880 0.523 1 1 1382 . 16 1 1 A 118 118 ARG CA C 118 56.734 57.038 -0.304 1 1 1383 . 16 1 1 A 118 118 ARG CB C 118 31.115 27.301 3.814 1 1 1385 . 16 1 1 A 118 118 ARG N N 118 118.114 114.236 3.878 1 1 1386 . 16 1 1 A 119 119 LEU H H 119 7.365 8.260 -0.895 1 1 1387 . 16 1 1 A 119 119 LEU HA H 119 4.253 4.881 -0.628 1 1 1397 . 16 1 1 A 119 119 LEU CA C 119 54.639 57.681 -3.042 1 1 1398 . 16 1 1 A 119 119 LEU CB C 119 41.700 31.476 10.224 1 1 1401 . 16 1 1 A 119 119 LEU N N 119 119.181 117.431 1.750 1 1 1402 . 16 1 1 A 120 120 ARG H H 120 8.766 8.700 0.066 1 1 1403 . 16 1 1 A 120 120 ARG HA H 120 4.374 4.495 -0.121 1 1 1410 . 16 1 1 A 120 120 ARG CA C 120 56.426 59.478 -3.052 1 1 1411 . 16 1 1 A 120 120 ARG CB C 120 32.414 63.775 -31.361 1 1 1414 . 16 1 1 A 120 120 ARG N N 120 122.099 120.704 1.395 1 1 1415 . 16 1 1 A 121 121 LEU H H 121 8.312 8.873 -0.561 1 1 1416 . 16 1 1 A 121 121 LEU HA H 121 4.407 3.697 0.710 1 1 1426 . 16 1 1 A 121 121 LEU CA C 121 56.028 65.778 -9.750 1 1 1427 . 16 1 1 A 121 121 LEU CB C 121 43.122 31.575 11.547 1 1 1430 . 16 1 1 A 121 121 LEU N N 121 118.761 123.524 -4.763 1 1 1431 . 16 1 1 A 122 122 PHE H H 122 7.143 8.421 -1.278 1 1 1432 . 16 1 1 A 122 122 PHE HA H 122 5.201 4.091 1.110 1 1 1439 . 16 1 1 A 122 122 PHE CA C 122 53.047 59.157 -6.110 1 1 1440 . 16 1 1 A 122 122 PHE CB C 122 40.844 29.472 11.372 1 1 1441 . 16 1 1 A 122 122 PHE N N 122 112.750 120.901 -8.151 1 1 1442 . 16 1 1 A 123 123 PRO HA H 123 3.908 3.962 -0.054 1 1 1449 . 16 1 1 A 123 123 PRO CA C 123 65.478 59.231 6.247 1 1 1450 . 16 1 1 A 123 123 PRO CB C 123 33.248 29.284 3.964 1 1 1452 . 16 1 1 A 124 124 LEU H H 124 7.208 8.156 -0.948 1 1 1453 . 16 1 1 A 124 124 LEU HA H 124 4.673 4.076 0.597 1 1 1463 . 16 1 1 A 124 124 LEU CA C 124 53.307 57.668 -4.361 1 1 1464 . 16 1 1 A 124 124 LEU CB C 124 42.853 41.620 1.233 1 1 1468 . 16 1 1 A 124 124 LEU N N 124 113.875 121.438 -7.563 1 1 1469 . 16 1 1 A 125 125 SER H H 125 8.990 8.096 0.894 1 1 1470 . 16 1 1 A 125 125 SER HA H 125 4.533 4.002 0.531 1 1 1473 . 16 1 1 A 125 125 SER CA C 125 59.198 59.664 -0.466 1 1 1474 . 16 1 1 A 125 125 SER CB C 125 64.578 29.546 35.032 1 1 1475 . 16 1 1 A 125 125 SER N N 125 117.894 119.508 -1.614 1 1 1476 . 16 1 1 A 126 126 SER H H 126 8.618 7.837 0.781 1 1 1477 . 16 1 1 A 126 126 SER HA H 126 4.614 3.989 0.625 1 1 1480 . 16 1 1 A 126 126 SER CA C 126 58.730 59.609 -0.879 1 1 1481 . 16 1 1 A 126 126 SER CB C 126 64.367 32.337 32.030 1 1 1482 . 16 1 1 A 126 126 SER N N 126 118.602 119.165 -0.563 1 1 1483 . 16 1 1 A 127 127 SER HA H 127 4.530 3.785 0.745 1 1 1486 . 16 1 1 A 127 127 SER CA C 127 58.954 65.672 -6.718 1 1 1487 . 16 1 1 A 127 127 SER CB C 127 64.379 31.505 32.874 1 1 1488 . 16 1 1 A 128 128 ALA H H 128 8.345 8.112 0.233 1 1 1489 . 16 1 1 A 128 128 ALA HA H 128 4.432 3.932 0.500 1 1 1493 . 16 1 1 A 128 128 ALA CA C 128 52.963 59.424 -6.461 1 1 1494 . 16 1 1 A 128 128 ALA CB C 128 19.924 29.724 -9.800 1 1 1495 . 16 1 1 A 128 128 ALA N N 128 126.185 122.276 3.909 1 1 1496 . 16 1 1 A 129 129 GLU H H 129 8.329 8.000 0.329 1 1 1497 . 16 1 1 A 129 129 GLU HA H 129 4.353 4.071 0.282 1 1 1502 . 16 1 1 A 129 129 GLU CA C 129 57.111 58.614 -1.503 1 1 1503 . 16 1 1 A 129 129 GLU CB C 129 30.949 28.592 2.357 1 1 1504 . 16 1 1 A 129 129 GLU N N 129 120.842 118.557 2.285 1 1 1505 . 16 1 1 A 130 130 LYS H H 130 7.947 8.015 -0.068 1 1 1506 . 16 1 1 A 130 130 LYS HA H 130 3.835 4.052 -0.217 1 1 1515 . 16 1 1 A 130 130 LYS CA C 130 57.756 59.563 -1.807 1 1 1516 . 16 1 1 A 130 130 LYS CB C 130 33.156 32.123 1.033 1 1 826 . 17 1 1 A 70 70 GLY H H 70 9.295 8.644 0.651 1 1 829 . 17 1 1 A 70 70 GLY CA C 70 46.552 59.359 -12.807 1 1 830 . 17 1 1 A 70 70 GLY N N 70 108.643 117.821 -9.178 1 1 832 . 17 1 1 A 71 71 VAL HA H 71 3.538 4.876 -1.338 1 1 840 . 17 1 1 A 71 71 VAL CA C 71 65.623 62.844 2.779 1 1 841 . 17 1 1 A 71 71 VAL CB C 71 30.251 32.019 -1.768 1 1 844 . 17 1 1 A 71 71 VAL N N 71 110.808 136.597 -25.789 1 1 845 . 17 1 1 A 72 72 CYS H H 72 8.022 8.321 -0.299 1 1 846 . 17 1 1 A 72 72 CYS HA H 72 3.469 4.833 -1.364 1 1 849 . 17 1 1 A 72 72 CYS CA C 72 62.733 57.745 4.988 1 1 850 . 17 1 1 A 72 72 CYS CB C 72 27.163 63.614 -36.451 1 1 851 . 17 1 1 A 72 72 CYS N N 72 109.483 114.477 -4.994 1 1 852 . 17 1 1 A 73 73 SER H H 73 7.996 8.352 -0.356 1 1 853 . 17 1 1 A 73 73 SER HA H 73 4.439 4.104 0.335 1 1 856 . 17 1 1 A 73 73 SER CA C 73 62.145 59.279 2.866 1 1 857 . 17 1 1 A 73 73 SER CB C 73 66.013 29.305 36.708 1 1 858 . 17 1 1 A 73 73 SER N N 73 118.630 122.840 -4.210 1 1 859 . 17 1 1 A 74 74 LYS H H 74 10.186 7.973 2.213 1 1 860 . 17 1 1 A 74 74 LYS HA H 74 4.172 3.980 0.192 1 1 867 . 17 1 1 A 74 74 LYS CA C 74 59.848 58.398 1.450 1 1 868 . 17 1 1 A 74 74 LYS CB C 74 34.278 41.469 -7.191 1 1 870 . 17 1 1 A 74 74 LYS N N 74 123.341 117.692 5.649 1 1 871 . 17 1 1 A 75 75 ASP H H 75 7.542 8.246 -0.704 1 1 872 . 17 1 1 A 75 75 ASP HA H 75 3.538 3.941 -0.403 1 1 875 . 17 1 1 A 75 75 ASP CA C 75 52.472 59.932 -7.460 1 1 876 . 17 1 1 A 75 75 ASP CB C 75 42.360 29.347 13.013 1 1 877 . 17 1 1 A 75 75 ASP N N 75 112.035 119.634 -7.599 1 1 878 . 17 1 1 A 76 76 VAL H H 76 8.128 8.341 -0.213 1 1 879 . 17 1 1 A 76 76 VAL HA H 76 4.106 4.021 0.085 1 1 887 . 17 1 1 A 76 76 VAL CA C 76 65.179 59.163 6.016 1 1 888 . 17 1 1 A 76 76 VAL CB C 76 32.174 29.079 3.095 1 1 891 . 17 1 1 A 76 76 VAL N N 76 117.992 120.373 -2.381 1 1 892 . 17 1 1 A 77 77 TRP H H 77 6.869 7.978 -1.109 1 1 893 . 17 1 1 A 77 77 TRP HA H 77 4.509 4.124 0.385 1 1 899 . 17 1 1 A 77 77 TRP CA C 77 59.207 57.698 1.509 1 1 900 . 17 1 1 A 77 77 TRP CB C 77 28.941 41.621 -12.680 1 1 901 . 17 1 1 A 77 77 TRP N N 77 123.077 121.265 1.812 1 1 903 . 17 1 1 A 78 78 GLU H H 78 8.593 8.252 0.341 1 1 904 . 17 1 1 A 78 78 GLU HA H 78 4.318 3.915 0.403 1 1 909 . 17 1 1 A 78 78 GLU CA C 78 60.038 59.118 0.920 1 1 910 . 17 1 1 A 78 78 GLU CB C 78 31.178 28.245 2.933 1 1 912 . 17 1 1 A 78 78 GLU N N 78 121.505 118.363 3.142 1 1 913 . 17 1 1 A 79 79 PHE H H 79 8.071 8.166 -0.095 1 1 914 . 17 1 1 A 79 79 PHE HA H 79 4.986 4.081 0.905 1 1 919 . 17 1 1 A 79 79 PHE CA C 79 58.749 58.789 -0.040 1 1 920 . 17 1 1 A 79 79 PHE CB C 79 39.732 28.745 10.987 1 1 921 . 17 1 1 A 79 79 PHE N N 79 118.384 118.158 0.226 1 1 922 . 17 1 1 A 80 80 LEU H H 80 9.309 7.899 1.410 1 1 923 . 17 1 1 A 80 80 LEU HA H 80 3.970 4.449 -0.479 1 1 933 . 17 1 1 A 80 80 LEU CA C 80 59.307 56.452 2.855 1 1 934 . 17 1 1 A 80 80 LEU CB C 80 43.257 38.193 5.064 1 1 937 . 17 1 1 A 80 80 LEU N N 80 122.915 118.479 4.436 1 1 938 . 17 1 1 A 81 81 GLU H H 81 8.282 8.044 0.238 1 1 939 . 17 1 1 A 81 81 GLU HA H 81 3.832 3.682 0.150 1 1 944 . 17 1 1 A 81 81 GLU CA C 81 62.069 65.171 -3.102 1 1 945 . 17 1 1 A 81 81 GLU CB C 81 30.249 38.154 -7.905 1 1 947 . 17 1 1 A 81 81 GLU N N 81 119.345 120.431 -1.086 1 1 948 . 17 1 1 A 82 82 LEU H H 82 8.236 7.928 0.308 1 1 949 . 17 1 1 A 82 82 LEU HA H 82 4.187 4.413 -0.226 1 1 959 . 17 1 1 A 82 82 LEU CA C 82 58.348 58.762 -0.414 1 1 960 . 17 1 1 A 82 82 LEU CB C 82 42.827 31.980 10.847 1 1 963 . 17 1 1 A 82 82 LEU N N 82 120.013 119.329 0.684 1 1 964 . 17 1 1 A 83 83 GLN H H 83 7.949 7.969 -0.020 1 1 965 . 17 1 1 A 83 83 GLN HA H 83 3.812 3.929 -0.117 1 1 968 . 17 1 1 A 83 83 GLN CA C 83 60.248 58.099 2.149 1 1 969 . 17 1 1 A 83 83 GLN CB C 83 33.537 41.507 -7.970 1 1 970 . 17 1 1 A 83 83 GLN N N 83 116.443 120.428 -3.985 1 1 971 . 17 1 1 A 84 84 ILE H H 84 8.407 8.828 -0.421 1 1 972 . 17 1 1 A 84 84 ILE HA H 84 3.644 4.079 -0.435 1 1 982 . 17 1 1 A 84 84 ILE CA C 84 67.288 58.819 8.469 1 1 983 . 17 1 1 A 84 84 ILE CB C 84 38.305 29.082 9.223 1 1 987 . 17 1 1 A 84 84 ILE N N 84 120.422 117.965 2.457 1 1 988 . 17 1 1 A 85 85 GLU H H 85 7.741 8.229 -0.488 1 1 989 . 17 1 1 A 85 85 GLU HA H 85 3.811 4.981 -1.170 1 1 994 . 17 1 1 A 85 85 GLU CA C 85 59.862 52.890 6.972 1 1 995 . 17 1 1 A 85 85 GLU CB C 85 30.360 46.087 -15.727 1 1 997 . 17 1 1 A 85 85 GLU N N 85 115.705 116.669 -0.964 1 1 998 . 17 1 1 A 86 86 GLU H H 86 7.818 8.713 -0.895 1 1 999 . 17 1 1 A 86 86 GLU HA H 86 4.274 4.702 -0.428 1 1 1004 . 17 1 1 A 86 86 GLU CA C 86 58.068 55.822 2.246 1 1 1005 . 17 1 1 A 86 86 GLU CB C 86 31.424 33.616 -2.192 1 1 1007 . 17 1 1 A 86 86 GLU N N 86 114.297 118.479 -4.182 1 1 1008 . 17 1 1 A 87 87 ILE H H 87 8.753 8.465 0.288 1 1 1019 . 17 1 1 A 87 87 ILE CA C 87 62.660 44.643 18.017 1 1 1024 . 17 1 1 A 87 87 ILE N N 87 118.890 109.904 8.986 1 1 1025 . 17 1 1 A 88 88 TYR H H 88 8.059 8.773 -0.714 1 1 1026 . 17 1 1 A 88 88 TYR HA H 88 5.447 4.201 1.246 1 1 1033 . 17 1 1 A 88 88 TYR CA C 88 55.285 58.751 -3.466 1 1 1034 . 17 1 1 A 88 88 TYR CB C 88 40.687 32.099 8.588 1 1 1035 . 17 1 1 A 88 88 TYR N N 88 119.252 125.130 -5.878 1 1 1036 . 17 1 1 A 89 89 PRO HA H 89 4.410 3.982 0.428 1 1 1043 . 17 1 1 A 89 89 PRO CA C 89 66.374 59.433 6.941 1 1 1044 . 17 1 1 A 89 89 PRO CB C 89 31.377 29.126 2.251 1 1 1047 . 17 1 1 A 90 90 GLU H H 90 9.234 8.231 1.003 1 1 1048 . 17 1 1 A 90 90 GLU HA H 90 4.379 4.009 0.370 1 1 1053 . 17 1 1 A 90 90 GLU CA C 90 59.098 58.702 0.396 1 1 1054 . 17 1 1 A 90 90 GLU CB C 90 29.461 28.123 1.338 1 1 1056 . 17 1 1 A 90 90 GLU N N 90 117.574 118.062 -0.488 1 1 1057 . 17 1 1 A 91 91 GLU H H 91 7.966 8.062 -0.096 1 1 1058 . 17 1 1 A 91 91 GLU HA H 91 4.890 4.014 0.876 1 1 1063 . 17 1 1 A 91 91 GLU CA C 91 55.324 59.113 -3.789 1 1 1064 . 17 1 1 A 91 91 GLU CB C 91 31.590 29.213 2.377 1 1 1066 . 17 1 1 A 91 91 GLU N N 91 119.310 119.804 -0.494 1 1 1067 . 17 1 1 A 92 92 GLU H H 92 7.263 8.069 -0.806 1 1 1068 . 17 1 1 A 92 92 GLU HA H 92 3.789 3.901 -0.112 1 1 1073 . 17 1 1 A 92 92 GLU CA C 92 60.628 57.945 2.683 1 1 1074 . 17 1 1 A 92 92 GLU CB C 92 30.531 41.570 -11.039 1 1 1076 . 17 1 1 A 92 92 GLU N N 92 121.332 120.154 1.178 1 1 1077 . 17 1 1 A 93 93 GLU H H 93 8.646 8.075 0.571 1 1 1078 . 17 1 1 A 93 93 GLU HA H 93 4.127 4.086 0.041 1 1 1083 . 17 1 1 A 93 93 GLU CA C 93 60.528 55.311 5.217 1 1 1084 . 17 1 1 A 93 93 GLU CB C 93 29.744 18.179 11.565 1 1 1086 . 17 1 1 A 93 93 GLU N N 93 118.207 120.992 -2.785 1 1 1087 . 17 1 1 A 94 94 ILE H H 94 7.766 8.433 -0.667 1 1 1088 . 17 1 1 A 94 94 ILE HA H 94 3.976 3.911 0.065 1 1 1098 . 17 1 1 A 94 94 ILE CA C 94 64.361 58.120 6.241 1 1 1099 . 17 1 1 A 94 94 ILE CB C 94 38.921 41.368 -2.447 1 1 1103 . 17 1 1 A 94 94 ILE N N 94 119.072 118.141 0.931 1 1 1104 . 17 1 1 A 95 95 LEU H H 95 8.340 7.973 0.367 1 1 1105 . 17 1 1 A 95 95 LEU HA H 95 4.300 4.104 0.196 1 1 1115 . 17 1 1 A 95 95 LEU CA C 95 57.905 59.488 -1.583 1 1 1116 . 17 1 1 A 95 95 LEU CB C 95 42.144 29.182 12.962 1 1 1119 . 17 1 1 A 95 95 LEU N N 95 121.325 117.912 3.413 1 1 1120 . 17 1 1 A 96 96 LYS H H 96 8.899 8.001 0.898 1 1 1121 . 17 1 1 A 96 96 LYS HA H 96 4.075 3.970 0.105 1 1 1126 . 17 1 1 A 96 96 LYS CA C 96 61.707 58.249 3.458 1 1 1127 . 17 1 1 A 96 96 LYS CB C 96 32.910 41.638 -8.728 1 1 1128 . 17 1 1 A 96 96 LYS N N 96 120.018 121.891 -1.873 1 1 1129 . 17 1 1 A 97 97 LYS H H 97 7.808 8.083 -0.275 1 1 1130 . 17 1 1 A 97 97 LYS HA H 97 4.045 4.254 -0.209 1 1 1139 . 17 1 1 A 97 97 LYS CA C 97 60.198 57.275 2.923 1 1 1140 . 17 1 1 A 97 97 LYS CB C 97 32.600 41.323 -8.723 1 1 1143 . 17 1 1 A 97 97 LYS N N 97 121.016 115.311 5.705 1 1 1144 . 17 1 1 A 98 98 ALA H H 98 7.814 7.975 -0.161 1 1 1145 . 17 1 1 A 98 98 ALA HA H 98 4.320 4.689 -0.369 1 1 1149 . 17 1 1 A 98 98 ALA CA C 98 55.260 54.484 0.776 1 1 1150 . 17 1 1 A 98 98 ALA CB C 98 19.468 39.525 -20.057 1 1 1151 . 17 1 1 A 98 98 ALA N N 98 122.102 116.795 5.307 1 1 1152 . 17 1 1 A 99 99 LEU H H 99 8.212 7.985 0.227 1 1 1153 . 17 1 1 A 99 99 LEU HA H 99 4.187 4.834 -0.647 1 1 1160 . 17 1 1 A 99 99 LEU CA C 99 58.398 56.735 1.663 1 1 1161 . 17 1 1 A 99 99 LEU CB C 99 42.720 37.190 5.530 1 1 1164 . 17 1 1 A 99 99 LEU N N 99 118.467 115.927 2.540 1 1 1165 . 17 1 1 A 100 100 ARG H H 100 7.738 7.429 0.309 1 1 1166 . 17 1 1 A 100 100 ARG HA H 100 3.894 5.067 -1.173 1 1 1173 . 17 1 1 A 100 100 ARG CA C 100 60.135 52.718 7.417 1 1 1174 . 17 1 1 A 100 100 ARG CB C 100 30.187 44.931 -14.744 1 1 1177 . 17 1 1 A 100 100 ARG N N 100 119.100 117.260 1.840 1 1 1178 . 17 1 1 A 101 101 ASP H H 101 8.186 8.081 0.105 1 1 1179 . 17 1 1 A 101 101 ASP HA H 101 4.424 4.843 -0.419 1 1 1182 . 17 1 1 A 101 101 ASP CA C 101 57.902 51.183 6.719 1 1 1183 . 17 1 1 A 101 101 ASP CB C 101 40.033 40.732 -0.699 1 1 1184 . 17 1 1 A 101 101 ASP N N 101 121.899 119.195 2.704 1 1 1185 . 17 1 1 A 102 102 LEU H H 102 8.730 8.616 0.114 1 1 1186 . 17 1 1 A 102 102 LEU HA H 102 4.373 4.138 0.235 1 1 1195 . 17 1 1 A 102 102 LEU CA C 102 58.218 58.260 -0.042 1 1 1196 . 17 1 1 A 102 102 LEU CB C 102 42.839 29.326 13.513 1 1 1199 . 17 1 1 A 102 102 LEU N N 102 124.505 123.187 1.318 1 1 1200 . 17 1 1 A 103 103 LYS HA H 103 3.726 4.312 -0.586 1 1 1209 . 17 1 1 A 103 103 LYS CA C 103 59.760 56.122 3.638 1 1 1210 . 17 1 1 A 103 103 LYS CB C 103 32.822 32.829 -0.007 1 1 1214 . 17 1 1 A 104 104 ARG H H 104 7.409 7.983 -0.574 1 1 1222 . 17 1 1 A 104 104 ARG CA C 104 56.298 45.203 11.095 1 1 1226 . 17 1 1 A 104 104 ARG N N 104 115.912 105.812 10.100 1 1 1227 . 17 1 1 A 105 105 GLY H H 105 8.046 7.807 0.239 1 1 1230 . 17 1 1 A 105 105 GLY CA C 105 46.309 55.386 -9.077 1 1 1231 . 17 1 1 A 105 105 GLY N N 105 108.860 117.961 -9.101 1 1 1232 . 17 1 1 A 106 106 LYS H H 106 8.033 8.425 -0.392 1 1 1233 . 17 1 1 A 106 106 LYS HA H 106 4.394 4.276 0.118 1 1 1242 . 17 1 1 A 106 106 LYS CA C 106 55.822 55.264 0.558 1 1 1243 . 17 1 1 A 106 106 LYS CB C 106 33.449 42.719 -9.270 1 1 1246 . 17 1 1 A 106 106 LYS N N 106 121.082 117.700 3.382 1 1 1247 . 17 1 1 A 107 107 LYS H H 107 8.271 8.599 -0.328 1 1 1248 . 17 1 1 A 107 107 LYS HA H 107 4.329 4.502 -0.173 1 1 1255 . 17 1 1 A 107 107 LYS CA C 107 56.673 59.167 -2.494 1 1 1256 . 17 1 1 A 107 107 LYS CB C 107 33.341 64.336 -30.995 1 1 1258 . 17 1 1 A 107 107 LYS N N 107 121.869 114.782 7.087 1 1 1259 . 17 1 1 A 108 108 LEU H H 108 8.481 7.451 1.030 1 1 1260 . 17 1 1 A 108 108 LEU HA H 108 4.637 4.999 -0.362 1 1 1269 . 17 1 1 A 108 108 LEU CA C 108 53.819 54.551 -0.732 1 1 1270 . 17 1 1 A 108 108 LEU CB C 108 45.135 35.729 9.406 1 1 1272 . 17 1 1 A 108 108 LEU N N 108 124.360 117.842 6.518 1 1 1273 . 17 1 1 A 109 109 LYS H H 109 8.657 8.941 -0.284 1 1 1274 . 17 1 1 A 109 109 LYS HA H 109 4.565 4.507 0.058 1 1 1283 . 17 1 1 A 109 109 LYS CA C 109 55.511 59.126 -3.615 1 1 1284 . 17 1 1 A 109 109 LYS CB C 109 32.029 64.012 -31.983 1 1 1287 . 17 1 1 A 109 109 LYS N N 109 123.165 117.780 5.385 1 1 1288 . 17 1 1 A 110 110 PRO HA H 110 4.232 3.589 0.643 1 1 1295 . 17 1 1 A 110 110 PRO CA C 110 66.732 66.669 0.063 1 1 1296 . 17 1 1 A 110 110 PRO CB C 110 32.481 31.585 0.896 1 1 1299 . 17 1 1 A 111 111 GLU HA H 111 4.221 3.921 0.300 1 1 1304 . 17 1 1 A 111 111 GLU CA C 111 59.819 59.832 -0.013 1 1 1305 . 17 1 1 A 111 111 GLU CB C 111 29.250 29.160 0.090 1 1 1307 . 17 1 1 A 112 112 ILE H H 112 7.233 8.244 -1.011 1 1 1308 . 17 1 1 A 112 112 ILE HA H 112 3.848 4.088 -0.240 1 1 1318 . 17 1 1 A 112 112 ILE CA C 112 62.635 59.154 3.481 1 1 1319 . 17 1 1 A 112 112 ILE CB C 112 37.159 29.230 7.929 1 1 1323 . 17 1 1 A 112 112 ILE N N 112 120.783 118.152 2.631 1 1 1324 . 17 1 1 A 113 113 LYS H H 113 8.268 7.920 0.348 1 1 1325 . 17 1 1 A 113 113 LYS HA H 113 3.849 3.679 0.170 1 1 1328 . 17 1 1 A 113 113 LYS CA C 113 60.248 65.112 -4.864 1 1 1329 . 17 1 1 A 113 113 LYS CB C 113 32.668 37.528 -4.860 1 1 1330 . 17 1 1 A 113 113 LYS N N 113 121.680 121.714 -0.034 1 1 1331 . 17 1 1 A 114 114 GLY H H 114 8.460 8.396 0.064 1 1 1334 . 17 1 1 A 114 114 GLY CA C 114 47.600 61.284 -13.684 1 1 1335 . 17 1 1 A 114 114 GLY N N 114 105.413 115.477 -10.064 1 1 1336 . 17 1 1 A 115 115 LYS H H 115 7.352 7.748 -0.396 1 1 1337 . 17 1 1 A 115 115 LYS HA H 115 4.189 4.466 -0.277 1 1 1346 . 17 1 1 A 115 115 LYS CA C 115 59.689 57.261 2.428 1 1 1347 . 17 1 1 A 115 115 LYS CB C 115 33.428 40.516 -7.088 1 1 1351 . 17 1 1 A 115 115 LYS N N 115 121.599 122.251 -0.652 1 1 1352 . 17 1 1 A 116 116 LEU H H 116 8.046 8.017 0.029 1 1 1353 . 17 1 1 A 116 116 LEU HA H 116 4.153 3.882 0.271 1 1 1363 . 17 1 1 A 116 116 LEU CA C 116 57.698 64.881 -7.183 1 1 1364 . 17 1 1 A 116 116 LEU CB C 116 42.070 31.622 10.448 1 1 1366 . 17 1 1 A 116 116 LEU N N 116 118.827 119.230 -0.403 1 1 1367 . 17 1 1 A 117 117 SER H H 117 8.321 7.539 0.782 1 1 1368 . 17 1 1 A 117 117 SER HA H 117 4.334 4.208 0.126 1 1 1371 . 17 1 1 A 117 117 SER CA C 117 61.467 54.295 7.172 1 1 1372 . 17 1 1 A 117 117 SER CB C 117 63.613 41.996 21.617 1 1 1373 . 17 1 1 A 117 117 SER N N 117 114.829 115.915 -1.086 1 1 1374 . 17 1 1 A 118 118 ARG H H 118 7.001 7.853 -0.852 1 1 1375 . 17 1 1 A 118 118 ARG HA H 118 4.403 3.862 0.541 1 1 1382 . 17 1 1 A 118 118 ARG CA C 118 56.734 57.118 -0.384 1 1 1383 . 17 1 1 A 118 118 ARG CB C 118 31.115 27.305 3.810 1 1 1385 . 17 1 1 A 118 118 ARG N N 118 118.114 114.285 3.829 1 1 1386 . 17 1 1 A 119 119 LEU H H 119 7.365 8.261 -0.896 1 1 1387 . 17 1 1 A 119 119 LEU HA H 119 4.253 4.892 -0.639 1 1 1397 . 17 1 1 A 119 119 LEU CA C 119 54.639 57.752 -3.113 1 1 1398 . 17 1 1 A 119 119 LEU CB C 119 41.700 31.533 10.167 1 1 1401 . 17 1 1 A 119 119 LEU N N 119 119.181 117.476 1.705 1 1 1402 . 17 1 1 A 120 120 ARG H H 120 8.766 8.722 0.044 1 1 1403 . 17 1 1 A 120 120 ARG HA H 120 4.374 4.500 -0.126 1 1 1410 . 17 1 1 A 120 120 ARG CA C 120 56.426 59.454 -3.028 1 1 1411 . 17 1 1 A 120 120 ARG CB C 120 32.414 63.730 -31.316 1 1 1414 . 17 1 1 A 120 120 ARG N N 120 122.099 120.658 1.441 1 1 1415 . 17 1 1 A 121 121 LEU H H 121 8.312 8.828 -0.516 1 1 1416 . 17 1 1 A 121 121 LEU HA H 121 4.407 3.699 0.708 1 1 1426 . 17 1 1 A 121 121 LEU CA C 121 56.028 65.694 -9.666 1 1 1427 . 17 1 1 A 121 121 LEU CB C 121 43.122 31.696 11.426 1 1 1430 . 17 1 1 A 121 121 LEU N N 121 118.761 123.332 -4.571 1 1 1431 . 17 1 1 A 122 122 PHE H H 122 7.143 8.414 -1.271 1 1 1432 . 17 1 1 A 122 122 PHE HA H 122 5.201 4.093 1.108 1 1 1439 . 17 1 1 A 122 122 PHE CA C 122 53.047 59.140 -6.093 1 1 1440 . 17 1 1 A 122 122 PHE CB C 122 40.844 29.449 11.395 1 1 1441 . 17 1 1 A 122 122 PHE N N 122 112.750 120.873 -8.123 1 1 1442 . 17 1 1 A 123 123 PRO HA H 123 3.908 3.993 -0.085 1 1 1449 . 17 1 1 A 123 123 PRO CA C 123 65.478 59.198 6.280 1 1 1450 . 17 1 1 A 123 123 PRO CB C 123 33.248 29.312 3.936 1 1 1452 . 17 1 1 A 124 124 LEU H H 124 7.208 8.111 -0.903 1 1 1453 . 17 1 1 A 124 124 LEU HA H 124 4.673 4.062 0.611 1 1 1463 . 17 1 1 A 124 124 LEU CA C 124 53.307 57.652 -4.345 1 1 1464 . 17 1 1 A 124 124 LEU CB C 124 42.853 41.822 1.031 1 1 1468 . 17 1 1 A 124 124 LEU N N 124 113.875 121.438 -7.563 1 1 1469 . 17 1 1 A 125 125 SER H H 125 8.990 8.157 0.833 1 1 1470 . 17 1 1 A 125 125 SER HA H 125 4.533 4.006 0.527 1 1 1473 . 17 1 1 A 125 125 SER CA C 125 59.198 59.641 -0.443 1 1 1474 . 17 1 1 A 125 125 SER CB C 125 64.578 29.325 35.253 1 1 1475 . 17 1 1 A 125 125 SER N N 125 117.894 119.817 -1.923 1 1 1476 . 17 1 1 A 126 126 SER H H 126 8.618 7.814 0.804 1 1 1477 . 17 1 1 A 126 126 SER HA H 126 4.614 3.991 0.623 1 1 1480 . 17 1 1 A 126 126 SER CA C 126 58.730 59.688 -0.958 1 1 1481 . 17 1 1 A 126 126 SER CB C 126 64.367 32.351 32.016 1 1 1482 . 17 1 1 A 126 126 SER N N 126 118.602 119.380 -0.778 1 1 1483 . 17 1 1 A 127 127 SER HA H 127 4.530 3.745 0.785 1 1 1486 . 17 1 1 A 127 127 SER CA C 127 58.954 65.832 -6.878 1 1 1487 . 17 1 1 A 127 127 SER CB C 127 64.379 31.493 32.886 1 1 1488 . 17 1 1 A 128 128 ALA H H 128 8.345 8.188 0.157 1 1 1489 . 17 1 1 A 128 128 ALA HA H 128 4.432 3.887 0.545 1 1 1493 . 17 1 1 A 128 128 ALA CA C 128 52.963 59.716 -6.753 1 1 1494 . 17 1 1 A 128 128 ALA CB C 128 19.924 29.659 -9.735 1 1 1495 . 17 1 1 A 128 128 ALA N N 128 126.185 122.080 4.105 1 1 1496 . 17 1 1 A 129 129 GLU H H 129 8.329 7.948 0.381 1 1 1497 . 17 1 1 A 129 129 GLU HA H 129 4.353 4.074 0.279 1 1 1502 . 17 1 1 A 129 129 GLU CA C 129 57.111 58.674 -1.563 1 1 1503 . 17 1 1 A 129 129 GLU CB C 129 30.949 28.452 2.497 1 1 1504 . 17 1 1 A 129 129 GLU N N 129 120.842 118.366 2.476 1 1 1505 . 17 1 1 A 130 130 LYS H H 130 7.947 8.010 -0.063 1 1 1506 . 17 1 1 A 130 130 LYS HA H 130 3.835 4.041 -0.206 1 1 1515 . 17 1 1 A 130 130 LYS CA C 130 57.756 59.628 -1.872 1 1 1516 . 17 1 1 A 130 130 LYS CB C 130 33.156 32.089 1.067 1 1 826 . 18 1 1 A 70 70 GLY H H 70 9.295 8.226 1.069 1 1 829 . 18 1 1 A 70 70 GLY CA C 70 46.552 58.749 -12.197 1 1 830 . 18 1 1 A 70 70 GLY N N 70 108.643 117.458 -8.815 1 1 832 . 18 1 1 A 71 71 VAL HA H 71 3.538 4.898 -1.360 1 1 840 . 18 1 1 A 71 71 VAL CA C 71 65.623 62.836 2.787 1 1 841 . 18 1 1 A 71 71 VAL CB C 71 30.251 31.980 -1.729 1 1 844 . 18 1 1 A 71 71 VAL N N 71 110.808 136.368 -25.560 1 1 845 . 18 1 1 A 72 72 CYS H H 72 8.022 8.378 -0.356 1 1 846 . 18 1 1 A 72 72 CYS HA H 72 3.469 4.823 -1.354 1 1 849 . 18 1 1 A 72 72 CYS CA C 72 62.733 57.724 5.009 1 1 850 . 18 1 1 A 72 72 CYS CB C 72 27.163 63.703 -36.540 1 1 851 . 18 1 1 A 72 72 CYS N N 72 109.483 114.048 -4.565 1 1 852 . 18 1 1 A 73 73 SER H H 73 7.996 8.250 -0.254 1 1 853 . 18 1 1 A 73 73 SER HA H 73 4.439 4.024 0.415 1 1 856 . 18 1 1 A 73 73 SER CA C 73 62.145 59.220 2.925 1 1 857 . 18 1 1 A 73 73 SER CB C 73 66.013 29.312 36.701 1 1 858 . 18 1 1 A 73 73 SER N N 73 118.630 123.253 -4.623 1 1 859 . 18 1 1 A 74 74 LYS H H 74 10.186 7.974 2.212 1 1 860 . 18 1 1 A 74 74 LYS HA H 74 4.172 3.966 0.206 1 1 867 . 18 1 1 A 74 74 LYS CA C 74 59.848 58.250 1.598 1 1 868 . 18 1 1 A 74 74 LYS CB C 74 34.278 41.706 -7.428 1 1 870 . 18 1 1 A 74 74 LYS N N 74 123.341 119.503 3.838 1 1 871 . 18 1 1 A 75 75 ASP H H 75 7.542 8.229 -0.687 1 1 872 . 18 1 1 A 75 75 ASP HA H 75 3.538 3.956 -0.418 1 1 875 . 18 1 1 A 75 75 ASP CA C 75 52.472 59.920 -7.448 1 1 876 . 18 1 1 A 75 75 ASP CB C 75 42.360 29.259 13.101 1 1 877 . 18 1 1 A 75 75 ASP N N 75 112.035 119.619 -7.584 1 1 878 . 18 1 1 A 76 76 VAL H H 76 8.128 8.408 -0.280 1 1 879 . 18 1 1 A 76 76 VAL HA H 76 4.106 4.036 0.070 1 1 887 . 18 1 1 A 76 76 VAL CA C 76 65.179 59.245 5.934 1 1 888 . 18 1 1 A 76 76 VAL CB C 76 32.174 29.081 3.093 1 1 891 . 18 1 1 A 76 76 VAL N N 76 117.992 119.976 -1.984 1 1 892 . 18 1 1 A 77 77 TRP H H 77 6.869 7.825 -0.956 1 1 893 . 18 1 1 A 77 77 TRP HA H 77 4.509 4.111 0.398 1 1 899 . 18 1 1 A 77 77 TRP CA C 77 59.207 57.730 1.477 1 1 900 . 18 1 1 A 77 77 TRP CB C 77 28.941 41.407 -12.466 1 1 901 . 18 1 1 A 77 77 TRP N N 77 123.077 121.692 1.385 1 1 903 . 18 1 1 A 78 78 GLU H H 78 8.593 8.478 0.115 1 1 904 . 18 1 1 A 78 78 GLU HA H 78 4.318 3.897 0.421 1 1 909 . 18 1 1 A 78 78 GLU CA C 78 60.038 59.145 0.893 1 1 910 . 18 1 1 A 78 78 GLU CB C 78 31.178 28.316 2.862 1 1 912 . 18 1 1 A 78 78 GLU N N 78 121.505 117.876 3.629 1 1 913 . 18 1 1 A 79 79 PHE H H 79 8.071 8.083 -0.012 1 1 914 . 18 1 1 A 79 79 PHE HA H 79 4.986 4.067 0.919 1 1 919 . 18 1 1 A 79 79 PHE CA C 79 58.749 58.788 -0.039 1 1 920 . 18 1 1 A 79 79 PHE CB C 79 39.732 28.941 10.791 1 1 921 . 18 1 1 A 79 79 PHE N N 79 118.384 118.156 0.228 1 1 922 . 18 1 1 A 80 80 LEU H H 80 9.309 7.909 1.400 1 1 923 . 18 1 1 A 80 80 LEU HA H 80 3.970 4.448 -0.478 1 1 933 . 18 1 1 A 80 80 LEU CA C 80 59.307 56.464 2.843 1 1 934 . 18 1 1 A 80 80 LEU CB C 80 43.257 38.226 5.031 1 1 937 . 18 1 1 A 80 80 LEU N N 80 122.915 118.383 4.532 1 1 938 . 18 1 1 A 81 81 GLU H H 81 8.282 7.997 0.285 1 1 939 . 18 1 1 A 81 81 GLU HA H 81 3.832 3.570 0.262 1 1 944 . 18 1 1 A 81 81 GLU CA C 81 62.069 65.302 -3.233 1 1 945 . 18 1 1 A 81 81 GLU CB C 81 30.249 38.130 -7.881 1 1 947 . 18 1 1 A 81 81 GLU N N 81 119.345 120.422 -1.077 1 1 948 . 18 1 1 A 82 82 LEU H H 82 8.236 7.941 0.295 1 1 949 . 18 1 1 A 82 82 LEU HA H 82 4.187 4.511 -0.324 1 1 959 . 18 1 1 A 82 82 LEU CA C 82 58.348 58.659 -0.311 1 1 960 . 18 1 1 A 82 82 LEU CB C 82 42.827 32.207 10.620 1 1 963 . 18 1 1 A 82 82 LEU N N 82 120.013 119.243 0.770 1 1 964 . 18 1 1 A 83 83 GLN H H 83 7.949 7.878 0.071 1 1 965 . 18 1 1 A 83 83 GLN HA H 83 3.812 3.984 -0.172 1 1 968 . 18 1 1 A 83 83 GLN CA C 83 60.248 58.093 2.155 1 1 969 . 18 1 1 A 83 83 GLN CB C 83 33.537 41.550 -8.013 1 1 970 . 18 1 1 A 83 83 GLN N N 83 116.443 120.154 -3.711 1 1 971 . 18 1 1 A 84 84 ILE H H 84 8.407 8.776 -0.369 1 1 972 . 18 1 1 A 84 84 ILE HA H 84 3.644 4.125 -0.481 1 1 982 . 18 1 1 A 84 84 ILE CA C 84 67.288 58.499 8.789 1 1 983 . 18 1 1 A 84 84 ILE CB C 84 38.305 29.039 9.266 1 1 987 . 18 1 1 A 84 84 ILE N N 84 120.422 117.656 2.766 1 1 988 . 18 1 1 A 85 85 GLU H H 85 7.741 8.142 -0.401 1 1 989 . 18 1 1 A 85 85 GLU HA H 85 3.811 4.933 -1.122 1 1 994 . 18 1 1 A 85 85 GLU CA C 85 59.862 53.078 6.784 1 1 995 . 18 1 1 A 85 85 GLU CB C 85 30.360 46.014 -15.654 1 1 997 . 18 1 1 A 85 85 GLU N N 85 115.705 116.598 -0.893 1 1 998 . 18 1 1 A 86 86 GLU H H 86 7.818 8.704 -0.886 1 1 999 . 18 1 1 A 86 86 GLU HA H 86 4.274 4.698 -0.424 1 1 1004 . 18 1 1 A 86 86 GLU CA C 86 58.068 55.842 2.226 1 1 1005 . 18 1 1 A 86 86 GLU CB C 86 31.424 33.474 -2.050 1 1 1007 . 18 1 1 A 86 86 GLU N N 86 114.297 118.488 -4.191 1 1 1008 . 18 1 1 A 87 87 ILE H H 87 8.753 8.440 0.313 1 1 1019 . 18 1 1 A 87 87 ILE CA C 87 62.660 44.781 17.879 1 1 1024 . 18 1 1 A 87 87 ILE N N 87 118.890 109.929 8.961 1 1 1025 . 18 1 1 A 88 88 TYR H H 88 8.059 8.860 -0.801 1 1 1026 . 18 1 1 A 88 88 TYR HA H 88 5.447 4.174 1.273 1 1 1033 . 18 1 1 A 88 88 TYR CA C 88 55.285 58.169 -2.884 1 1 1034 . 18 1 1 A 88 88 TYR CB C 88 40.687 32.349 8.338 1 1 1035 . 18 1 1 A 88 88 TYR N N 88 119.252 125.588 -6.336 1 1 1036 . 18 1 1 A 89 89 PRO HA H 89 4.410 3.979 0.431 1 1 1043 . 18 1 1 A 89 89 PRO CA C 89 66.374 59.532 6.842 1 1 1044 . 18 1 1 A 89 89 PRO CB C 89 31.377 29.161 2.216 1 1 1047 . 18 1 1 A 90 90 GLU H H 90 9.234 8.282 0.952 1 1 1048 . 18 1 1 A 90 90 GLU HA H 90 4.379 4.006 0.373 1 1 1053 . 18 1 1 A 90 90 GLU CA C 90 59.098 58.714 0.384 1 1 1054 . 18 1 1 A 90 90 GLU CB C 90 29.461 28.263 1.198 1 1 1056 . 18 1 1 A 90 90 GLU N N 90 117.574 118.025 -0.451 1 1 1057 . 18 1 1 A 91 91 GLU H H 91 7.966 8.016 -0.050 1 1 1058 . 18 1 1 A 91 91 GLU HA H 91 4.890 4.047 0.843 1 1 1063 . 18 1 1 A 91 91 GLU CA C 91 55.324 59.202 -3.878 1 1 1064 . 18 1 1 A 91 91 GLU CB C 91 31.590 29.611 1.979 1 1 1066 . 18 1 1 A 91 91 GLU N N 91 119.310 119.774 -0.464 1 1 1067 . 18 1 1 A 92 92 GLU H H 92 7.263 8.032 -0.769 1 1 1068 . 18 1 1 A 92 92 GLU HA H 92 3.789 3.910 -0.121 1 1 1073 . 18 1 1 A 92 92 GLU CA C 92 60.628 57.956 2.672 1 1 1074 . 18 1 1 A 92 92 GLU CB C 92 30.531 41.502 -10.971 1 1 1076 . 18 1 1 A 92 92 GLU N N 92 121.332 119.998 1.334 1 1 1077 . 18 1 1 A 93 93 GLU H H 93 8.646 7.984 0.662 1 1 1078 . 18 1 1 A 93 93 GLU HA H 93 4.127 4.085 0.042 1 1 1083 . 18 1 1 A 93 93 GLU CA C 93 60.528 55.376 5.152 1 1 1084 . 18 1 1 A 93 93 GLU CB C 93 29.744 18.265 11.479 1 1 1086 . 18 1 1 A 93 93 GLU N N 93 118.207 121.316 -3.109 1 1 1087 . 18 1 1 A 94 94 ILE H H 94 7.766 8.294 -0.528 1 1 1088 . 18 1 1 A 94 94 ILE HA H 94 3.976 3.906 0.070 1 1 1098 . 18 1 1 A 94 94 ILE CA C 94 64.361 58.195 6.166 1 1 1099 . 18 1 1 A 94 94 ILE CB C 94 38.921 41.430 -2.509 1 1 1103 . 18 1 1 A 94 94 ILE N N 94 119.072 118.166 0.906 1 1 1104 . 18 1 1 A 95 95 LEU H H 95 8.340 8.137 0.203 1 1 1105 . 18 1 1 A 95 95 LEU HA H 95 4.300 4.125 0.175 1 1 1115 . 18 1 1 A 95 95 LEU CA C 95 57.905 59.430 -1.525 1 1 1116 . 18 1 1 A 95 95 LEU CB C 95 42.144 29.188 12.956 1 1 1119 . 18 1 1 A 95 95 LEU N N 95 121.325 117.495 3.830 1 1 1120 . 18 1 1 A 96 96 LYS H H 96 8.899 8.002 0.897 1 1 1121 . 18 1 1 A 96 96 LYS HA H 96 4.075 4.025 0.050 1 1 1126 . 18 1 1 A 96 96 LYS CA C 96 61.707 57.783 3.924 1 1 1127 . 18 1 1 A 96 96 LYS CB C 96 32.910 41.704 -8.794 1 1 1128 . 18 1 1 A 96 96 LYS N N 96 120.018 122.229 -2.211 1 1 1129 . 18 1 1 A 97 97 LYS H H 97 7.808 8.026 -0.218 1 1 1130 . 18 1 1 A 97 97 LYS HA H 97 4.045 4.290 -0.245 1 1 1139 . 18 1 1 A 97 97 LYS CA C 97 60.198 56.003 4.195 1 1 1140 . 18 1 1 A 97 97 LYS CB C 97 32.600 41.257 -8.657 1 1 1143 . 18 1 1 A 97 97 LYS N N 97 121.016 115.550 5.466 1 1 1144 . 18 1 1 A 98 98 ALA H H 98 7.814 8.293 -0.479 1 1 1145 . 18 1 1 A 98 98 ALA HA H 98 4.320 4.758 -0.438 1 1 1149 . 18 1 1 A 98 98 ALA CA C 98 55.260 54.295 0.965 1 1 1150 . 18 1 1 A 98 98 ALA CB C 98 19.468 39.508 -20.040 1 1 1151 . 18 1 1 A 98 98 ALA N N 98 122.102 116.319 5.783 1 1 1152 . 18 1 1 A 99 99 LEU H H 99 8.212 7.872 0.340 1 1 1153 . 18 1 1 A 99 99 LEU HA H 99 4.187 4.753 -0.566 1 1 1160 . 18 1 1 A 99 99 LEU CA C 99 58.398 56.544 1.854 1 1 1161 . 18 1 1 A 99 99 LEU CB C 99 42.720 36.789 5.931 1 1 1164 . 18 1 1 A 99 99 LEU N N 99 118.467 115.420 3.047 1 1 1165 . 18 1 1 A 100 100 ARG H H 100 7.738 7.426 0.312 1 1 1166 . 18 1 1 A 100 100 ARG HA H 100 3.894 5.191 -1.297 1 1 1173 . 18 1 1 A 100 100 ARG CA C 100 60.135 52.767 7.368 1 1 1174 . 18 1 1 A 100 100 ARG CB C 100 30.187 45.300 -15.113 1 1 1177 . 18 1 1 A 100 100 ARG N N 100 119.100 117.591 1.509 1 1 1178 . 18 1 1 A 101 101 ASP H H 101 8.186 8.075 0.111 1 1 1179 . 18 1 1 A 101 101 ASP HA H 101 4.424 4.829 -0.405 1 1 1182 . 18 1 1 A 101 101 ASP CA C 101 57.902 51.187 6.715 1 1 1183 . 18 1 1 A 101 101 ASP CB C 101 40.033 40.708 -0.675 1 1 1184 . 18 1 1 A 101 101 ASP N N 101 121.899 119.751 2.148 1 1 1185 . 18 1 1 A 102 102 LEU H H 102 8.730 8.580 0.150 1 1 1186 . 18 1 1 A 102 102 LEU HA H 102 4.373 4.091 0.282 1 1 1195 . 18 1 1 A 102 102 LEU CA C 102 58.218 58.348 -0.130 1 1 1196 . 18 1 1 A 102 102 LEU CB C 102 42.839 29.446 13.393 1 1 1199 . 18 1 1 A 102 102 LEU N N 102 124.505 123.077 1.428 1 1 1200 . 18 1 1 A 103 103 LYS HA H 103 3.726 4.350 -0.624 1 1 1209 . 18 1 1 A 103 103 LYS CA C 103 59.760 56.259 3.501 1 1 1210 . 18 1 1 A 103 103 LYS CB C 103 32.822 33.190 -0.368 1 1 1214 . 18 1 1 A 104 104 ARG H H 104 7.409 7.873 -0.464 1 1 1222 . 18 1 1 A 104 104 ARG CA C 104 56.298 45.160 11.138 1 1 1226 . 18 1 1 A 104 104 ARG N N 104 115.912 105.751 10.161 1 1 1227 . 18 1 1 A 105 105 GLY H H 105 8.046 7.943 0.103 1 1 1230 . 18 1 1 A 105 105 GLY CA C 105 46.309 55.681 -9.372 1 1 1231 . 18 1 1 A 105 105 GLY N N 105 108.860 118.638 -9.778 1 1 1232 . 18 1 1 A 106 106 LYS H H 106 8.033 8.414 -0.381 1 1 1233 . 18 1 1 A 106 106 LYS HA H 106 4.394 4.224 0.170 1 1 1242 . 18 1 1 A 106 106 LYS CA C 106 55.822 55.254 0.568 1 1 1243 . 18 1 1 A 106 106 LYS CB C 106 33.449 42.575 -9.126 1 1 1246 . 18 1 1 A 106 106 LYS N N 106 121.082 117.858 3.224 1 1 1247 . 18 1 1 A 107 107 LYS H H 107 8.271 9.107 -0.836 1 1 1248 . 18 1 1 A 107 107 LYS HA H 107 4.329 4.266 0.063 1 1 1255 . 18 1 1 A 107 107 LYS CA C 107 56.673 58.794 -2.121 1 1 1256 . 18 1 1 A 107 107 LYS CB C 107 33.341 63.791 -30.450 1 1 1258 . 18 1 1 A 107 107 LYS N N 107 121.869 113.799 8.070 1 1 1259 . 18 1 1 A 108 108 LEU H H 108 8.481 7.544 0.937 1 1 1260 . 18 1 1 A 108 108 LEU HA H 108 4.637 4.845 -0.208 1 1 1269 . 18 1 1 A 108 108 LEU CA C 108 53.819 54.510 -0.691 1 1 1270 . 18 1 1 A 108 108 LEU CB C 108 45.135 36.314 8.821 1 1 1272 . 18 1 1 A 108 108 LEU N N 108 124.360 120.596 3.764 1 1 1273 . 18 1 1 A 109 109 LYS H H 109 8.657 8.890 -0.233 1 1 1274 . 18 1 1 A 109 109 LYS HA H 109 4.565 4.486 0.079 1 1 1283 . 18 1 1 A 109 109 LYS CA C 109 55.511 59.221 -3.710 1 1 1284 . 18 1 1 A 109 109 LYS CB C 109 32.029 64.163 -32.134 1 1 1287 . 18 1 1 A 109 109 LYS N N 109 123.165 117.138 6.027 1 1 1288 . 18 1 1 A 110 110 PRO HA H 110 4.232 3.606 0.626 1 1 1295 . 18 1 1 A 110 110 PRO CA C 110 66.732 66.523 0.209 1 1 1296 . 18 1 1 A 110 110 PRO CB C 110 32.481 31.468 1.013 1 1 1299 . 18 1 1 A 111 111 GLU HA H 111 4.221 3.880 0.341 1 1 1304 . 18 1 1 A 111 111 GLU CA C 111 59.819 59.779 0.040 1 1 1305 . 18 1 1 A 111 111 GLU CB C 111 29.250 29.131 0.119 1 1 1307 . 18 1 1 A 112 112 ILE H H 112 7.233 8.239 -1.006 1 1 1308 . 18 1 1 A 112 112 ILE HA H 112 3.848 4.070 -0.222 1 1 1318 . 18 1 1 A 112 112 ILE CA C 112 62.635 59.127 3.508 1 1 1319 . 18 1 1 A 112 112 ILE CB C 112 37.159 29.291 7.868 1 1 1323 . 18 1 1 A 112 112 ILE N N 112 120.783 118.106 2.677 1 1 1324 . 18 1 1 A 113 113 LYS H H 113 8.268 7.845 0.423 1 1 1325 . 18 1 1 A 113 113 LYS HA H 113 3.849 3.647 0.202 1 1 1328 . 18 1 1 A 113 113 LYS CA C 113 60.248 64.730 -4.482 1 1 1329 . 18 1 1 A 113 113 LYS CB C 113 32.668 37.408 -4.740 1 1 1330 . 18 1 1 A 113 113 LYS N N 113 121.680 121.674 0.006 1 1 1331 . 18 1 1 A 114 114 GLY H H 114 8.460 8.244 0.216 1 1 1334 . 18 1 1 A 114 114 GLY CA C 114 47.600 61.098 -13.498 1 1 1335 . 18 1 1 A 114 114 GLY N N 114 105.413 116.671 -11.258 1 1 1336 . 18 1 1 A 115 115 LYS H H 115 7.352 7.845 -0.493 1 1 1337 . 18 1 1 A 115 115 LYS HA H 115 4.189 4.436 -0.247 1 1 1346 . 18 1 1 A 115 115 LYS CA C 115 59.689 57.265 2.424 1 1 1347 . 18 1 1 A 115 115 LYS CB C 115 33.428 40.665 -7.237 1 1 1351 . 18 1 1 A 115 115 LYS N N 115 121.599 121.238 0.361 1 1 1352 . 18 1 1 A 116 116 LEU H H 116 8.046 8.029 0.017 1 1 1353 . 18 1 1 A 116 116 LEU HA H 116 4.153 3.856 0.297 1 1 1363 . 18 1 1 A 116 116 LEU CA C 116 57.698 64.943 -7.245 1 1 1364 . 18 1 1 A 116 116 LEU CB C 116 42.070 31.570 10.500 1 1 1366 . 18 1 1 A 116 116 LEU N N 116 118.827 118.847 -0.020 1 1 1367 . 18 1 1 A 117 117 SER H H 117 8.321 7.535 0.786 1 1 1368 . 18 1 1 A 117 117 SER HA H 117 4.334 4.194 0.140 1 1 1371 . 18 1 1 A 117 117 SER CA C 117 61.467 54.239 7.228 1 1 1372 . 18 1 1 A 117 117 SER CB C 117 63.613 41.950 21.663 1 1 1373 . 18 1 1 A 117 117 SER N N 117 114.829 115.872 -1.043 1 1 1374 . 18 1 1 A 118 118 ARG H H 118 7.001 7.821 -0.820 1 1 1375 . 18 1 1 A 118 118 ARG HA H 118 4.403 3.879 0.524 1 1 1382 . 18 1 1 A 118 118 ARG CA C 118 56.734 57.028 -0.294 1 1 1383 . 18 1 1 A 118 118 ARG CB C 118 31.115 27.276 3.839 1 1 1385 . 18 1 1 A 118 118 ARG N N 118 118.114 114.205 3.909 1 1 1386 . 18 1 1 A 119 119 LEU H H 119 7.365 8.199 -0.834 1 1 1387 . 18 1 1 A 119 119 LEU HA H 119 4.253 4.886 -0.633 1 1 1397 . 18 1 1 A 119 119 LEU CA C 119 54.639 57.742 -3.103 1 1 1398 . 18 1 1 A 119 119 LEU CB C 119 41.700 31.294 10.406 1 1 1401 . 18 1 1 A 119 119 LEU N N 119 119.181 117.394 1.787 1 1 1402 . 18 1 1 A 120 120 ARG H H 120 8.766 8.705 0.061 1 1 1403 . 18 1 1 A 120 120 ARG HA H 120 4.374 4.510 -0.136 1 1 1410 . 18 1 1 A 120 120 ARG CA C 120 56.426 59.211 -2.785 1 1 1411 . 18 1 1 A 120 120 ARG CB C 120 32.414 63.765 -31.351 1 1 1414 . 18 1 1 A 120 120 ARG N N 120 122.099 120.333 1.766 1 1 1415 . 18 1 1 A 121 121 LEU H H 121 8.312 8.827 -0.515 1 1 1416 . 18 1 1 A 121 121 LEU HA H 121 4.407 3.698 0.709 1 1 1426 . 18 1 1 A 121 121 LEU CA C 121 56.028 65.799 -9.771 1 1 1427 . 18 1 1 A 121 121 LEU CB C 121 43.122 31.641 11.481 1 1 1430 . 18 1 1 A 121 121 LEU N N 121 118.761 123.334 -4.573 1 1 1431 . 18 1 1 A 122 122 PHE H H 122 7.143 8.420 -1.277 1 1 1432 . 18 1 1 A 122 122 PHE HA H 122 5.201 4.093 1.108 1 1 1439 . 18 1 1 A 122 122 PHE CA C 122 53.047 59.140 -6.093 1 1 1440 . 18 1 1 A 122 122 PHE CB C 122 40.844 29.447 11.397 1 1 1441 . 18 1 1 A 122 122 PHE N N 122 112.750 120.880 -8.130 1 1 1442 . 18 1 1 A 123 123 PRO HA H 123 3.908 3.991 -0.083 1 1 1449 . 18 1 1 A 123 123 PRO CA C 123 65.478 59.211 6.267 1 1 1450 . 18 1 1 A 123 123 PRO CB C 123 33.248 29.309 3.939 1 1 1452 . 18 1 1 A 124 124 LEU H H 124 7.208 8.080 -0.872 1 1 1453 . 18 1 1 A 124 124 LEU HA H 124 4.673 4.067 0.606 1 1 1463 . 18 1 1 A 124 124 LEU CA C 124 53.307 57.596 -4.289 1 1 1464 . 18 1 1 A 124 124 LEU CB C 124 42.853 41.848 1.005 1 1 1468 . 18 1 1 A 124 124 LEU N N 124 113.875 121.889 -8.014 1 1 1469 . 18 1 1 A 125 125 SER H H 125 8.990 8.194 0.796 1 1 1470 . 18 1 1 A 125 125 SER HA H 125 4.533 4.002 0.531 1 1 1473 . 18 1 1 A 125 125 SER CA C 125 59.198 59.496 -0.298 1 1 1474 . 18 1 1 A 125 125 SER CB C 125 64.578 29.607 34.971 1 1 1475 . 18 1 1 A 125 125 SER N N 125 117.894 119.435 -1.541 1 1 1476 . 18 1 1 A 126 126 SER H H 126 8.618 7.900 0.718 1 1 1477 . 18 1 1 A 126 126 SER HA H 126 4.614 3.988 0.626 1 1 1480 . 18 1 1 A 126 126 SER CA C 126 58.730 59.615 -0.885 1 1 1481 . 18 1 1 A 126 126 SER CB C 126 64.367 32.339 32.028 1 1 1482 . 18 1 1 A 126 126 SER N N 126 118.602 118.827 -0.225 1 1 1483 . 18 1 1 A 127 127 SER HA H 127 4.530 3.769 0.761 1 1 1486 . 18 1 1 A 127 127 SER CA C 127 58.954 65.818 -6.864 1 1 1487 . 18 1 1 A 127 127 SER CB C 127 64.379 31.472 32.907 1 1 1488 . 18 1 1 A 128 128 ALA H H 128 8.345 8.023 0.322 1 1 1489 . 18 1 1 A 128 128 ALA HA H 128 4.432 3.941 0.491 1 1 1493 . 18 1 1 A 128 128 ALA CA C 128 52.963 59.139 -6.176 1 1 1494 . 18 1 1 A 128 128 ALA CB C 128 19.924 29.693 -9.769 1 1 1495 . 18 1 1 A 128 128 ALA N N 128 126.185 122.182 4.003 1 1 1496 . 18 1 1 A 129 129 GLU H H 129 8.329 8.009 0.320 1 1 1497 . 18 1 1 A 129 129 GLU HA H 129 4.353 4.077 0.276 1 1 1502 . 18 1 1 A 129 129 GLU CA C 129 57.111 58.634 -1.523 1 1 1503 . 18 1 1 A 129 129 GLU CB C 129 30.949 28.653 2.296 1 1 1504 . 18 1 1 A 129 129 GLU N N 129 120.842 118.638 2.204 1 1 1505 . 18 1 1 A 130 130 LYS H H 130 7.947 7.985 -0.038 1 1 1506 . 18 1 1 A 130 130 LYS HA H 130 3.835 4.035 -0.200 1 1 1515 . 18 1 1 A 130 130 LYS CA C 130 57.756 59.714 -1.958 1 1 1516 . 18 1 1 A 130 130 LYS CB C 130 33.156 32.102 1.054 1 1 826 . 19 1 1 A 70 70 GLY H H 70 9.295 8.391 0.904 1 1 829 . 19 1 1 A 70 70 GLY CA C 70 46.552 59.109 -12.557 1 1 830 . 19 1 1 A 70 70 GLY N N 70 108.643 118.012 -9.369 1 1 832 . 19 1 1 A 71 71 VAL HA H 71 3.538 4.851 -1.313 1 1 840 . 19 1 1 A 71 71 VAL CA C 71 65.623 62.724 2.899 1 1 841 . 19 1 1 A 71 71 VAL CB C 71 30.251 31.948 -1.697 1 1 844 . 19 1 1 A 71 71 VAL N N 71 110.808 136.529 -25.721 1 1 845 . 19 1 1 A 72 72 CYS H H 72 8.022 8.363 -0.341 1 1 846 . 19 1 1 A 72 72 CYS HA H 72 3.469 4.757 -1.288 1 1 849 . 19 1 1 A 72 72 CYS CA C 72 62.733 57.695 5.038 1 1 850 . 19 1 1 A 72 72 CYS CB C 72 27.163 64.400 -37.237 1 1 851 . 19 1 1 A 72 72 CYS N N 72 109.483 114.058 -4.575 1 1 852 . 19 1 1 A 73 73 SER H H 73 7.996 8.417 -0.421 1 1 853 . 19 1 1 A 73 73 SER HA H 73 4.439 4.105 0.334 1 1 856 . 19 1 1 A 73 73 SER CA C 73 62.145 59.271 2.874 1 1 857 . 19 1 1 A 73 73 SER CB C 73 66.013 29.361 36.652 1 1 858 . 19 1 1 A 73 73 SER N N 73 118.630 123.280 -4.650 1 1 859 . 19 1 1 A 74 74 LYS H H 74 10.186 7.986 2.200 1 1 860 . 19 1 1 A 74 74 LYS HA H 74 4.172 3.951 0.221 1 1 867 . 19 1 1 A 74 74 LYS CA C 74 59.848 58.239 1.609 1 1 868 . 19 1 1 A 74 74 LYS CB C 74 34.278 41.692 -7.414 1 1 870 . 19 1 1 A 74 74 LYS N N 74 123.341 117.863 5.478 1 1 871 . 19 1 1 A 75 75 ASP H H 75 7.542 8.164 -0.622 1 1 872 . 19 1 1 A 75 75 ASP HA H 75 3.538 3.930 -0.392 1 1 875 . 19 1 1 A 75 75 ASP CA C 75 52.472 59.915 -7.443 1 1 876 . 19 1 1 A 75 75 ASP CB C 75 42.360 29.217 13.143 1 1 877 . 19 1 1 A 75 75 ASP N N 75 112.035 119.630 -7.595 1 1 878 . 19 1 1 A 76 76 VAL H H 76 8.128 8.353 -0.225 1 1 879 . 19 1 1 A 76 76 VAL HA H 76 4.106 4.022 0.084 1 1 887 . 19 1 1 A 76 76 VAL CA C 76 65.179 59.185 5.994 1 1 888 . 19 1 1 A 76 76 VAL CB C 76 32.174 29.105 3.069 1 1 891 . 19 1 1 A 76 76 VAL N N 76 117.992 120.262 -2.270 1 1 892 . 19 1 1 A 77 77 TRP H H 77 6.869 7.811 -0.942 1 1 893 . 19 1 1 A 77 77 TRP HA H 77 4.509 4.098 0.411 1 1 899 . 19 1 1 A 77 77 TRP CA C 77 59.207 57.782 1.425 1 1 900 . 19 1 1 A 77 77 TRP CB C 77 28.941 41.470 -12.529 1 1 901 . 19 1 1 A 77 77 TRP N N 77 123.077 121.777 1.300 1 1 903 . 19 1 1 A 78 78 GLU H H 78 8.593 8.374 0.219 1 1 904 . 19 1 1 A 78 78 GLU HA H 78 4.318 3.886 0.432 1 1 909 . 19 1 1 A 78 78 GLU CA C 78 60.038 59.235 0.803 1 1 910 . 19 1 1 A 78 78 GLU CB C 78 31.178 28.319 2.859 1 1 912 . 19 1 1 A 78 78 GLU N N 78 121.505 117.884 3.621 1 1 913 . 19 1 1 A 79 79 PHE H H 79 8.071 8.121 -0.050 1 1 914 . 19 1 1 A 79 79 PHE HA H 79 4.986 4.061 0.925 1 1 919 . 19 1 1 A 79 79 PHE CA C 79 58.749 58.782 -0.033 1 1 920 . 19 1 1 A 79 79 PHE CB C 79 39.732 28.948 10.784 1 1 921 . 19 1 1 A 79 79 PHE N N 79 118.384 118.120 0.264 1 1 922 . 19 1 1 A 80 80 LEU H H 80 9.309 7.931 1.378 1 1 923 . 19 1 1 A 80 80 LEU HA H 80 3.970 4.438 -0.468 1 1 933 . 19 1 1 A 80 80 LEU CA C 80 59.307 56.423 2.884 1 1 934 . 19 1 1 A 80 80 LEU CB C 80 43.257 38.206 5.051 1 1 937 . 19 1 1 A 80 80 LEU N N 80 122.915 118.371 4.544 1 1 938 . 19 1 1 A 81 81 GLU H H 81 8.282 8.060 0.222 1 1 939 . 19 1 1 A 81 81 GLU HA H 81 3.832 3.587 0.245 1 1 944 . 19 1 1 A 81 81 GLU CA C 81 62.069 65.196 -3.127 1 1 945 . 19 1 1 A 81 81 GLU CB C 81 30.249 38.102 -7.853 1 1 947 . 19 1 1 A 81 81 GLU N N 81 119.345 120.333 -0.988 1 1 948 . 19 1 1 A 82 82 LEU H H 82 8.236 7.910 0.326 1 1 949 . 19 1 1 A 82 82 LEU HA H 82 4.187 4.403 -0.216 1 1 959 . 19 1 1 A 82 82 LEU CA C 82 58.348 58.498 -0.150 1 1 960 . 19 1 1 A 82 82 LEU CB C 82 42.827 32.019 10.808 1 1 963 . 19 1 1 A 82 82 LEU N N 82 120.013 119.337 0.676 1 1 964 . 19 1 1 A 83 83 GLN H H 83 7.949 7.918 0.031 1 1 965 . 19 1 1 A 83 83 GLN HA H 83 3.812 3.958 -0.146 1 1 968 . 19 1 1 A 83 83 GLN CA C 83 60.248 58.093 2.155 1 1 969 . 19 1 1 A 83 83 GLN CB C 83 33.537 41.533 -7.996 1 1 970 . 19 1 1 A 83 83 GLN N N 83 116.443 120.376 -3.933 1 1 971 . 19 1 1 A 84 84 ILE H H 84 8.407 8.756 -0.349 1 1 972 . 19 1 1 A 84 84 ILE HA H 84 3.644 4.098 -0.454 1 1 982 . 19 1 1 A 84 84 ILE CA C 84 67.288 58.649 8.639 1 1 983 . 19 1 1 A 84 84 ILE CB C 84 38.305 29.050 9.255 1 1 987 . 19 1 1 A 84 84 ILE N N 84 120.422 117.967 2.455 1 1 988 . 19 1 1 A 85 85 GLU H H 85 7.741 8.234 -0.493 1 1 989 . 19 1 1 A 85 85 GLU HA H 85 3.811 4.949 -1.138 1 1 994 . 19 1 1 A 85 85 GLU CA C 85 59.862 52.904 6.958 1 1 995 . 19 1 1 A 85 85 GLU CB C 85 30.360 46.072 -15.712 1 1 997 . 19 1 1 A 85 85 GLU N N 85 115.705 116.620 -0.915 1 1 998 . 19 1 1 A 86 86 GLU H H 86 7.818 8.720 -0.902 1 1 999 . 19 1 1 A 86 86 GLU HA H 86 4.274 4.725 -0.451 1 1 1004 . 19 1 1 A 86 86 GLU CA C 86 58.068 55.846 2.222 1 1 1005 . 19 1 1 A 86 86 GLU CB C 86 31.424 33.305 -1.881 1 1 1007 . 19 1 1 A 86 86 GLU N N 86 114.297 118.638 -4.341 1 1 1008 . 19 1 1 A 87 87 ILE H H 87 8.753 8.440 0.313 1 1 1019 . 19 1 1 A 87 87 ILE CA C 87 62.660 44.600 18.060 1 1 1024 . 19 1 1 A 87 87 ILE N N 87 118.890 110.357 8.533 1 1 1025 . 19 1 1 A 88 88 TYR H H 88 8.059 8.738 -0.679 1 1 1026 . 19 1 1 A 88 88 TYR HA H 88 5.447 4.208 1.239 1 1 1033 . 19 1 1 A 88 88 TYR CA C 88 55.285 58.818 -3.533 1 1 1034 . 19 1 1 A 88 88 TYR CB C 88 40.687 32.099 8.588 1 1 1035 . 19 1 1 A 88 88 TYR N N 88 119.252 125.126 -5.874 1 1 1036 . 19 1 1 A 89 89 PRO HA H 89 4.410 3.975 0.435 1 1 1043 . 19 1 1 A 89 89 PRO CA C 89 66.374 59.459 6.915 1 1 1044 . 19 1 1 A 89 89 PRO CB C 89 31.377 29.088 2.289 1 1 1047 . 19 1 1 A 90 90 GLU H H 90 9.234 8.246 0.988 1 1 1048 . 19 1 1 A 90 90 GLU HA H 90 4.379 4.008 0.371 1 1 1053 . 19 1 1 A 90 90 GLU CA C 90 59.098 58.698 0.400 1 1 1054 . 19 1 1 A 90 90 GLU CB C 90 29.461 28.142 1.319 1 1 1056 . 19 1 1 A 90 90 GLU N N 90 117.574 118.086 -0.512 1 1 1057 . 19 1 1 A 91 91 GLU H H 91 7.966 8.038 -0.072 1 1 1058 . 19 1 1 A 91 91 GLU HA H 91 4.890 4.060 0.830 1 1 1063 . 19 1 1 A 91 91 GLU CA C 91 55.324 59.078 -3.754 1 1 1064 . 19 1 1 A 91 91 GLU CB C 91 31.590 29.282 2.308 1 1 1066 . 19 1 1 A 91 91 GLU N N 91 119.310 119.851 -0.541 1 1 1067 . 19 1 1 A 92 92 GLU H H 92 7.263 8.114 -0.851 1 1 1068 . 19 1 1 A 92 92 GLU HA H 92 3.789 3.903 -0.114 1 1 1073 . 19 1 1 A 92 92 GLU CA C 92 60.628 57.945 2.683 1 1 1074 . 19 1 1 A 92 92 GLU CB C 92 30.531 41.527 -10.996 1 1 1076 . 19 1 1 A 92 92 GLU N N 92 121.332 120.171 1.161 1 1 1077 . 19 1 1 A 93 93 GLU H H 93 8.646 8.082 0.564 1 1 1078 . 19 1 1 A 93 93 GLU HA H 93 4.127 4.084 0.043 1 1 1083 . 19 1 1 A 93 93 GLU CA C 93 60.528 55.401 5.127 1 1 1084 . 19 1 1 A 93 93 GLU CB C 93 29.744 18.241 11.503 1 1 1086 . 19 1 1 A 93 93 GLU N N 93 118.207 121.335 -3.128 1 1 1087 . 19 1 1 A 94 94 ILE H H 94 7.766 8.370 -0.604 1 1 1088 . 19 1 1 A 94 94 ILE HA H 94 3.976 3.900 0.076 1 1 1098 . 19 1 1 A 94 94 ILE CA C 94 64.361 58.187 6.174 1 1 1099 . 19 1 1 A 94 94 ILE CB C 94 38.921 41.427 -2.506 1 1 1103 . 19 1 1 A 94 94 ILE N N 94 119.072 118.145 0.927 1 1 1104 . 19 1 1 A 95 95 LEU H H 95 8.340 8.060 0.280 1 1 1105 . 19 1 1 A 95 95 LEU HA H 95 4.300 4.125 0.175 1 1 1115 . 19 1 1 A 95 95 LEU CA C 95 57.905 59.514 -1.609 1 1 1116 . 19 1 1 A 95 95 LEU CB C 95 42.144 29.207 12.937 1 1 1119 . 19 1 1 A 95 95 LEU N N 95 121.325 117.630 3.695 1 1 1120 . 19 1 1 A 96 96 LYS H H 96 8.899 7.949 0.950 1 1 1121 . 19 1 1 A 96 96 LYS HA H 96 4.075 4.013 0.062 1 1 1126 . 19 1 1 A 96 96 LYS CA C 96 61.707 57.678 4.029 1 1 1127 . 19 1 1 A 96 96 LYS CB C 96 32.910 41.811 -8.901 1 1 1128 . 19 1 1 A 96 96 LYS N N 96 120.018 122.215 -2.197 1 1 1129 . 19 1 1 A 97 97 LYS H H 97 7.808 8.045 -0.237 1 1 1130 . 19 1 1 A 97 97 LYS HA H 97 4.045 4.284 -0.239 1 1 1139 . 19 1 1 A 97 97 LYS CA C 97 60.198 56.108 4.090 1 1 1140 . 19 1 1 A 97 97 LYS CB C 97 32.600 41.304 -8.704 1 1 1143 . 19 1 1 A 97 97 LYS N N 97 121.016 115.588 5.428 1 1 1144 . 19 1 1 A 98 98 ALA H H 98 7.814 8.152 -0.338 1 1 1145 . 19 1 1 A 98 98 ALA HA H 98 4.320 4.778 -0.458 1 1 1149 . 19 1 1 A 98 98 ALA CA C 98 55.260 54.134 1.126 1 1 1150 . 19 1 1 A 98 98 ALA CB C 98 19.468 39.537 -20.069 1 1 1151 . 19 1 1 A 98 98 ALA N N 98 122.102 116.492 5.610 1 1 1152 . 19 1 1 A 99 99 LEU H H 99 8.212 8.022 0.190 1 1 1153 . 19 1 1 A 99 99 LEU HA H 99 4.187 4.759 -0.572 1 1 1160 . 19 1 1 A 99 99 LEU CA C 99 58.398 56.989 1.409 1 1 1161 . 19 1 1 A 99 99 LEU CB C 99 42.720 37.261 5.459 1 1 1164 . 19 1 1 A 99 99 LEU N N 99 118.467 115.643 2.824 1 1 1165 . 19 1 1 A 100 100 ARG H H 100 7.738 7.482 0.256 1 1 1166 . 19 1 1 A 100 100 ARG HA H 100 3.894 5.192 -1.298 1 1 1173 . 19 1 1 A 100 100 ARG CA C 100 60.135 52.788 7.347 1 1 1174 . 19 1 1 A 100 100 ARG CB C 100 30.187 45.495 -15.308 1 1 1177 . 19 1 1 A 100 100 ARG N N 100 119.100 117.011 2.089 1 1 1178 . 19 1 1 A 101 101 ASP H H 101 8.186 8.434 -0.248 1 1 1179 . 19 1 1 A 101 101 ASP HA H 101 4.424 4.853 -0.429 1 1 1182 . 19 1 1 A 101 101 ASP CA C 101 57.902 51.095 6.807 1 1 1183 . 19 1 1 A 101 101 ASP CB C 101 40.033 40.735 -0.702 1 1 1184 . 19 1 1 A 101 101 ASP N N 101 121.899 119.063 2.836 1 1 1185 . 19 1 1 A 102 102 LEU H H 102 8.730 8.972 -0.242 1 1 1186 . 19 1 1 A 102 102 LEU HA H 102 4.373 4.036 0.337 1 1 1195 . 19 1 1 A 102 102 LEU CA C 102 58.218 58.357 -0.139 1 1 1196 . 19 1 1 A 102 102 LEU CB C 102 42.839 28.918 13.921 1 1 1199 . 19 1 1 A 102 102 LEU N N 102 124.505 121.992 2.513 1 1 1200 . 19 1 1 A 103 103 LYS HA H 103 3.726 4.342 -0.616 1 1 1209 . 19 1 1 A 103 103 LYS CA C 103 59.760 56.168 3.592 1 1 1210 . 19 1 1 A 103 103 LYS CB C 103 32.822 32.972 -0.150 1 1 1214 . 19 1 1 A 104 104 ARG H H 104 7.409 8.026 -0.617 1 1 1222 . 19 1 1 A 104 104 ARG CA C 104 56.298 45.148 11.150 1 1 1226 . 19 1 1 A 104 104 ARG N N 104 115.912 105.790 10.122 1 1 1227 . 19 1 1 A 105 105 GLY H H 105 8.046 7.879 0.167 1 1 1230 . 19 1 1 A 105 105 GLY CA C 105 46.309 55.892 -9.583 1 1 1231 . 19 1 1 A 105 105 GLY N N 105 108.860 118.400 -9.540 1 1 1232 . 19 1 1 A 106 106 LYS H H 106 8.033 8.418 -0.385 1 1 1233 . 19 1 1 A 106 106 LYS HA H 106 4.394 4.234 0.160 1 1 1242 . 19 1 1 A 106 106 LYS CA C 106 55.822 55.197 0.625 1 1 1243 . 19 1 1 A 106 106 LYS CB C 106 33.449 42.672 -9.223 1 1 1246 . 19 1 1 A 106 106 LYS N N 106 121.082 119.296 1.786 1 1 1247 . 19 1 1 A 107 107 LYS H H 107 8.271 8.593 -0.322 1 1 1248 . 19 1 1 A 107 107 LYS HA H 107 4.329 4.473 -0.144 1 1 1255 . 19 1 1 A 107 107 LYS CA C 107 56.673 59.186 -2.513 1 1 1256 . 19 1 1 A 107 107 LYS CB C 107 33.341 64.458 -31.117 1 1 1258 . 19 1 1 A 107 107 LYS N N 107 121.869 114.461 7.408 1 1 1259 . 19 1 1 A 108 108 LEU H H 108 8.481 7.638 0.843 1 1 1260 . 19 1 1 A 108 108 LEU HA H 108 4.637 4.851 -0.214 1 1 1269 . 19 1 1 A 108 108 LEU CA C 108 53.819 54.548 -0.729 1 1 1270 . 19 1 1 A 108 108 LEU CB C 108 45.135 36.505 8.630 1 1 1272 . 19 1 1 A 108 108 LEU N N 108 124.360 119.944 4.416 1 1 1273 . 19 1 1 A 109 109 LYS H H 109 8.657 8.944 -0.287 1 1 1274 . 19 1 1 A 109 109 LYS HA H 109 4.565 4.504 0.061 1 1 1283 . 19 1 1 A 109 109 LYS CA C 109 55.511 59.189 -3.678 1 1 1284 . 19 1 1 A 109 109 LYS CB C 109 32.029 63.995 -31.966 1 1 1287 . 19 1 1 A 109 109 LYS N N 109 123.165 118.020 5.145 1 1 1288 . 19 1 1 A 110 110 PRO HA H 110 4.232 3.607 0.625 1 1 1295 . 19 1 1 A 110 110 PRO CA C 110 66.732 66.527 0.205 1 1 1296 . 19 1 1 A 110 110 PRO CB C 110 32.481 31.472 1.009 1 1 1299 . 19 1 1 A 111 111 GLU HA H 111 4.221 3.875 0.346 1 1 1304 . 19 1 1 A 111 111 GLU CA C 111 59.819 59.834 -0.015 1 1 1305 . 19 1 1 A 111 111 GLU CB C 111 29.250 29.129 0.121 1 1 1307 . 19 1 1 A 112 112 ILE H H 112 7.233 8.222 -0.989 1 1 1308 . 19 1 1 A 112 112 ILE HA H 112 3.848 4.083 -0.235 1 1 1318 . 19 1 1 A 112 112 ILE CA C 112 62.635 59.148 3.487 1 1 1319 . 19 1 1 A 112 112 ILE CB C 112 37.159 29.128 8.031 1 1 1323 . 19 1 1 A 112 112 ILE N N 112 120.783 118.136 2.647 1 1 1324 . 19 1 1 A 113 113 LYS H H 113 8.268 7.635 0.633 1 1 1325 . 19 1 1 A 113 113 LYS HA H 113 3.849 3.711 0.138 1 1 1328 . 19 1 1 A 113 113 LYS CA C 113 60.248 64.718 -4.470 1 1 1329 . 19 1 1 A 113 113 LYS CB C 113 32.668 37.355 -4.687 1 1 1330 . 19 1 1 A 113 113 LYS N N 113 121.680 121.720 -0.040 1 1 1331 . 19 1 1 A 114 114 GLY H H 114 8.460 8.252 0.208 1 1 1334 . 19 1 1 A 114 114 GLY CA C 114 47.600 61.148 -13.548 1 1 1335 . 19 1 1 A 114 114 GLY N N 114 105.413 116.651 -11.238 1 1 1336 . 19 1 1 A 115 115 LYS H H 115 7.352 7.884 -0.532 1 1 1337 . 19 1 1 A 115 115 LYS HA H 115 4.189 4.429 -0.240 1 1 1346 . 19 1 1 A 115 115 LYS CA C 115 59.689 57.248 2.441 1 1 1347 . 19 1 1 A 115 115 LYS CB C 115 33.428 40.647 -7.219 1 1 1351 . 19 1 1 A 115 115 LYS N N 115 121.599 121.453 0.146 1 1 1352 . 19 1 1 A 116 116 LEU H H 116 8.046 7.779 0.267 1 1 1353 . 19 1 1 A 116 116 LEU HA H 116 4.153 3.776 0.377 1 1 1363 . 19 1 1 A 116 116 LEU CA C 116 57.698 65.385 -7.687 1 1 1364 . 19 1 1 A 116 116 LEU CB C 116 42.070 31.482 10.588 1 1 1366 . 19 1 1 A 116 116 LEU N N 116 118.827 116.307 2.520 1 1 1367 . 19 1 1 A 117 117 SER H H 117 8.321 7.530 0.791 1 1 1368 . 19 1 1 A 117 117 SER HA H 117 4.334 4.198 0.136 1 1 1371 . 19 1 1 A 117 117 SER CA C 117 61.467 54.256 7.211 1 1 1372 . 19 1 1 A 117 117 SER CB C 117 63.613 41.856 21.757 1 1 1373 . 19 1 1 A 117 117 SER N N 117 114.829 118.702 -3.873 1 1 1374 . 19 1 1 A 118 118 ARG H H 118 7.001 7.825 -0.824 1 1 1375 . 19 1 1 A 118 118 ARG HA H 118 4.403 3.882 0.521 1 1 1382 . 19 1 1 A 118 118 ARG CA C 118 56.734 56.956 -0.222 1 1 1383 . 19 1 1 A 118 118 ARG CB C 118 31.115 27.235 3.880 1 1 1385 . 19 1 1 A 118 118 ARG N N 118 118.114 114.197 3.917 1 1 1386 . 19 1 1 A 119 119 LEU H H 119 7.365 8.279 -0.914 1 1 1387 . 19 1 1 A 119 119 LEU HA H 119 4.253 4.882 -0.629 1 1 1397 . 19 1 1 A 119 119 LEU CA C 119 54.639 57.679 -3.040 1 1 1398 . 19 1 1 A 119 119 LEU CB C 119 41.700 31.516 10.184 1 1 1401 . 19 1 1 A 119 119 LEU N N 119 119.181 117.369 1.812 1 1 1402 . 19 1 1 A 120 120 ARG H H 120 8.766 8.640 0.126 1 1 1403 . 19 1 1 A 120 120 ARG HA H 120 4.374 4.503 -0.129 1 1 1410 . 19 1 1 A 120 120 ARG CA C 120 56.426 59.294 -2.868 1 1 1411 . 19 1 1 A 120 120 ARG CB C 120 32.414 63.779 -31.365 1 1 1414 . 19 1 1 A 120 120 ARG N N 120 122.099 120.704 1.395 1 1 1415 . 19 1 1 A 121 121 LEU H H 121 8.312 8.877 -0.565 1 1 1416 . 19 1 1 A 121 121 LEU HA H 121 4.407 3.707 0.700 1 1 1426 . 19 1 1 A 121 121 LEU CA C 121 56.028 65.716 -9.688 1 1 1427 . 19 1 1 A 121 121 LEU CB C 121 43.122 31.709 11.413 1 1 1430 . 19 1 1 A 121 121 LEU N N 121 118.761 123.384 -4.623 1 1 1431 . 19 1 1 A 122 122 PHE H H 122 7.143 8.388 -1.245 1 1 1432 . 19 1 1 A 122 122 PHE HA H 122 5.201 4.093 1.108 1 1 1439 . 19 1 1 A 122 122 PHE CA C 122 53.047 59.144 -6.097 1 1 1440 . 19 1 1 A 122 122 PHE CB C 122 40.844 29.458 11.386 1 1 1441 . 19 1 1 A 122 122 PHE N N 122 112.750 120.877 -8.127 1 1 1442 . 19 1 1 A 123 123 PRO HA H 123 3.908 3.964 -0.056 1 1 1449 . 19 1 1 A 123 123 PRO CA C 123 65.478 59.172 6.306 1 1 1450 . 19 1 1 A 123 123 PRO CB C 123 33.248 29.383 3.865 1 1 1452 . 19 1 1 A 124 124 LEU H H 124 7.208 8.161 -0.953 1 1 1453 . 19 1 1 A 124 124 LEU HA H 124 4.673 4.093 0.580 1 1 1463 . 19 1 1 A 124 124 LEU CA C 124 53.307 57.654 -4.347 1 1 1464 . 19 1 1 A 124 124 LEU CB C 124 42.853 41.170 1.683 1 1 1468 . 19 1 1 A 124 124 LEU N N 124 113.875 121.255 -7.380 1 1 1469 . 19 1 1 A 125 125 SER H H 125 8.990 8.305 0.685 1 1 1470 . 19 1 1 A 125 125 SER HA H 125 4.533 3.954 0.579 1 1 1473 . 19 1 1 A 125 125 SER CA C 125 59.198 59.633 -0.435 1 1 1474 . 19 1 1 A 125 125 SER CB C 125 64.578 29.259 35.319 1 1 1475 . 19 1 1 A 125 125 SER N N 125 117.894 119.317 -1.423 1 1 1476 . 19 1 1 A 126 126 SER H H 126 8.618 7.771 0.847 1 1 1477 . 19 1 1 A 126 126 SER HA H 126 4.614 4.021 0.593 1 1 1480 . 19 1 1 A 126 126 SER CA C 126 58.730 59.337 -0.607 1 1 1481 . 19 1 1 A 126 126 SER CB C 126 64.367 32.310 32.057 1 1 1482 . 19 1 1 A 126 126 SER N N 126 118.602 119.864 -1.262 1 1 1483 . 19 1 1 A 127 127 SER HA H 127 4.530 3.797 0.733 1 1 1486 . 19 1 1 A 127 127 SER CA C 127 58.954 65.613 -6.659 1 1 1487 . 19 1 1 A 127 127 SER CB C 127 64.379 31.589 32.790 1 1 1488 . 19 1 1 A 128 128 ALA H H 128 8.345 8.379 -0.034 1 1 1489 . 19 1 1 A 128 128 ALA HA H 128 4.432 3.998 0.434 1 1 1493 . 19 1 1 A 128 128 ALA CA C 128 52.963 58.775 -5.812 1 1 1494 . 19 1 1 A 128 128 ALA CB C 128 19.924 30.110 -10.186 1 1 1495 . 19 1 1 A 128 128 ALA N N 128 126.185 120.820 5.365 1 1 1496 . 19 1 1 A 129 129 GLU H H 129 8.329 7.713 0.616 1 1 1497 . 19 1 1 A 129 129 GLU HA H 129 4.353 4.081 0.272 1 1 1502 . 19 1 1 A 129 129 GLU CA C 129 57.111 58.641 -1.530 1 1 1503 . 19 1 1 A 129 129 GLU CB C 129 30.949 28.621 2.328 1 1 1504 . 19 1 1 A 129 129 GLU N N 129 120.842 118.744 2.098 1 1 1505 . 19 1 1 A 130 130 LYS H H 130 7.947 8.087 -0.140 1 1 1506 . 19 1 1 A 130 130 LYS HA H 130 3.835 4.040 -0.205 1 1 1515 . 19 1 1 A 130 130 LYS CA C 130 57.756 59.650 -1.894 1 1 1516 . 19 1 1 A 130 130 LYS CB C 130 33.156 32.139 1.017 1 1 826 . 20 1 1 A 70 70 GLY H H 70 9.295 8.380 0.915 1 1 829 . 20 1 1 A 70 70 GLY CA C 70 46.552 59.356 -12.804 1 1 830 . 20 1 1 A 70 70 GLY N N 70 108.643 117.757 -9.114 1 1 832 . 20 1 1 A 71 71 VAL HA H 71 3.538 4.830 -1.292 1 1 840 . 20 1 1 A 71 71 VAL CA C 71 65.623 62.808 2.815 1 1 841 . 20 1 1 A 71 71 VAL CB C 71 30.251 31.987 -1.736 1 1 844 . 20 1 1 A 71 71 VAL N N 71 110.808 136.311 -25.503 1 1 845 . 20 1 1 A 72 72 CYS H H 72 8.022 8.297 -0.275 1 1 846 . 20 1 1 A 72 72 CYS HA H 72 3.469 4.784 -1.315 1 1 849 . 20 1 1 A 72 72 CYS CA C 72 62.733 57.782 4.951 1 1 850 . 20 1 1 A 72 72 CYS CB C 72 27.163 63.073 -35.910 1 1 851 . 20 1 1 A 72 72 CYS N N 72 109.483 115.197 -5.714 1 1 852 . 20 1 1 A 73 73 SER H H 73 7.996 8.173 -0.177 1 1 853 . 20 1 1 A 73 73 SER HA H 73 4.439 4.002 0.437 1 1 856 . 20 1 1 A 73 73 SER CA C 73 62.145 59.290 2.855 1 1 857 . 20 1 1 A 73 73 SER CB C 73 66.013 29.249 36.764 1 1 858 . 20 1 1 A 73 73 SER N N 73 118.630 123.389 -4.759 1 1 859 . 20 1 1 A 74 74 LYS H H 74 10.186 7.887 2.299 1 1 860 . 20 1 1 A 74 74 LYS HA H 74 4.172 3.961 0.211 1 1 867 . 20 1 1 A 74 74 LYS CA C 74 59.848 58.378 1.470 1 1 868 . 20 1 1 A 74 74 LYS CB C 74 34.278 41.454 -7.176 1 1 870 . 20 1 1 A 74 74 LYS N N 74 123.341 119.758 3.583 1 1 871 . 20 1 1 A 75 75 ASP H H 75 7.542 8.242 -0.700 1 1 872 . 20 1 1 A 75 75 ASP HA H 75 3.538 3.941 -0.403 1 1 875 . 20 1 1 A 75 75 ASP CA C 75 52.472 59.884 -7.412 1 1 876 . 20 1 1 A 75 75 ASP CB C 75 42.360 29.221 13.139 1 1 877 . 20 1 1 A 75 75 ASP N N 75 112.035 119.588 -7.553 1 1 878 . 20 1 1 A 76 76 VAL H H 76 8.128 8.417 -0.289 1 1 879 . 20 1 1 A 76 76 VAL HA H 76 4.106 4.021 0.085 1 1 887 . 20 1 1 A 76 76 VAL CA C 76 65.179 59.173 6.006 1 1 888 . 20 1 1 A 76 76 VAL CB C 76 32.174 28.994 3.180 1 1 891 . 20 1 1 A 76 76 VAL N N 76 117.992 120.616 -2.624 1 1 892 . 20 1 1 A 77 77 TRP H H 77 6.869 7.919 -1.050 1 1 893 . 20 1 1 A 77 77 TRP HA H 77 4.509 4.102 0.407 1 1 899 . 20 1 1 A 77 77 TRP CA C 77 59.207 57.704 1.503 1 1 900 . 20 1 1 A 77 77 TRP CB C 77 28.941 41.385 -12.444 1 1 901 . 20 1 1 A 77 77 TRP N N 77 123.077 121.629 1.448 1 1 903 . 20 1 1 A 78 78 GLU H H 78 8.593 8.401 0.192 1 1 904 . 20 1 1 A 78 78 GLU HA H 78 4.318 3.892 0.426 1 1 909 . 20 1 1 A 78 78 GLU CA C 78 60.038 59.231 0.807 1 1 910 . 20 1 1 A 78 78 GLU CB C 78 31.178 28.309 2.869 1 1 912 . 20 1 1 A 78 78 GLU N N 78 121.505 117.936 3.569 1 1 913 . 20 1 1 A 79 79 PHE H H 79 8.071 8.099 -0.028 1 1 914 . 20 1 1 A 79 79 PHE HA H 79 4.986 4.078 0.908 1 1 919 . 20 1 1 A 79 79 PHE CA C 79 58.749 58.772 -0.023 1 1 920 . 20 1 1 A 79 79 PHE CB C 79 39.732 28.868 10.864 1 1 921 . 20 1 1 A 79 79 PHE N N 79 118.384 118.141 0.243 1 1 922 . 20 1 1 A 80 80 LEU H H 80 9.309 7.895 1.414 1 1 923 . 20 1 1 A 80 80 LEU HA H 80 3.970 4.441 -0.471 1 1 933 . 20 1 1 A 80 80 LEU CA C 80 59.307 56.409 2.898 1 1 934 . 20 1 1 A 80 80 LEU CB C 80 43.257 38.184 5.073 1 1 937 . 20 1 1 A 80 80 LEU N N 80 122.915 118.377 4.538 1 1 938 . 20 1 1 A 81 81 GLU H H 81 8.282 8.247 0.035 1 1 939 . 20 1 1 A 81 81 GLU HA H 81 3.832 3.637 0.195 1 1 944 . 20 1 1 A 81 81 GLU CA C 81 62.069 65.076 -3.007 1 1 945 . 20 1 1 A 81 81 GLU CB C 81 30.249 38.220 -7.971 1 1 947 . 20 1 1 A 81 81 GLU N N 81 119.345 120.523 -1.178 1 1 948 . 20 1 1 A 82 82 LEU H H 82 8.236 7.791 0.445 1 1 949 . 20 1 1 A 82 82 LEU HA H 82 4.187 4.325 -0.138 1 1 959 . 20 1 1 A 82 82 LEU CA C 82 58.348 58.977 -0.629 1 1 960 . 20 1 1 A 82 82 LEU CB C 82 42.827 31.762 11.065 1 1 963 . 20 1 1 A 82 82 LEU N N 82 120.013 119.298 0.715 1 1 964 . 20 1 1 A 83 83 GLN H H 83 7.949 7.899 0.050 1 1 965 . 20 1 1 A 83 83 GLN HA H 83 3.812 3.843 -0.031 1 1 968 . 20 1 1 A 83 83 GLN CA C 83 60.248 57.944 2.304 1 1 969 . 20 1 1 A 83 83 GLN CB C 83 33.537 41.636 -8.099 1 1 970 . 20 1 1 A 83 83 GLN N N 83 116.443 120.739 -4.296 1 1 971 . 20 1 1 A 84 84 ILE H H 84 8.407 8.204 0.203 1 1 972 . 20 1 1 A 84 84 ILE HA H 84 3.644 4.109 -0.465 1 1 982 . 20 1 1 A 84 84 ILE CA C 84 67.288 59.193 8.095 1 1 983 . 20 1 1 A 84 84 ILE CB C 84 38.305 29.316 8.989 1 1 987 . 20 1 1 A 84 84 ILE N N 84 120.422 117.772 2.650 1 1 988 . 20 1 1 A 85 85 GLU H H 85 7.741 7.705 0.036 1 1 989 . 20 1 1 A 85 85 GLU HA H 85 3.811 4.987 -1.176 1 1 994 . 20 1 1 A 85 85 GLU CA C 85 59.862 52.691 7.171 1 1 995 . 20 1 1 A 85 85 GLU CB C 85 30.360 45.178 -14.818 1 1 997 . 20 1 1 A 85 85 GLU N N 85 115.705 117.315 -1.610 1 1 998 . 20 1 1 A 86 86 GLU H H 86 7.818 8.675 -0.857 1 1 999 . 20 1 1 A 86 86 GLU HA H 86 4.274 4.730 -0.456 1 1 1004 . 20 1 1 A 86 86 GLU CA C 86 58.068 55.710 2.358 1 1 1005 . 20 1 1 A 86 86 GLU CB C 86 31.424 32.625 -1.201 1 1 1007 . 20 1 1 A 86 86 GLU N N 86 114.297 118.655 -4.358 1 1 1008 . 20 1 1 A 87 87 ILE H H 87 8.753 8.451 0.302 1 1 1019 . 20 1 1 A 87 87 ILE CA C 87 62.660 45.022 17.638 1 1 1024 . 20 1 1 A 87 87 ILE N N 87 118.890 109.928 8.962 1 1 1025 . 20 1 1 A 88 88 TYR H H 88 8.059 8.890 -0.831 1 1 1026 . 20 1 1 A 88 88 TYR HA H 88 5.447 4.191 1.256 1 1 1033 . 20 1 1 A 88 88 TYR CA C 88 55.285 58.086 -2.801 1 1 1034 . 20 1 1 A 88 88 TYR CB C 88 40.687 32.349 8.338 1 1 1035 . 20 1 1 A 88 88 TYR N N 88 119.252 125.618 -6.366 1 1 1036 . 20 1 1 A 89 89 PRO HA H 89 4.410 3.979 0.431 1 1 1043 . 20 1 1 A 89 89 PRO CA C 89 66.374 59.527 6.847 1 1 1044 . 20 1 1 A 89 89 PRO CB C 89 31.377 29.123 2.254 1 1 1047 . 20 1 1 A 90 90 GLU H H 90 9.234 8.276 0.958 1 1 1048 . 20 1 1 A 90 90 GLU HA H 90 4.379 4.020 0.359 1 1 1053 . 20 1 1 A 90 90 GLU CA C 90 59.098 58.572 0.526 1 1 1054 . 20 1 1 A 90 90 GLU CB C 90 29.461 28.554 0.907 1 1 1056 . 20 1 1 A 90 90 GLU N N 90 117.574 118.010 -0.436 1 1 1057 . 20 1 1 A 91 91 GLU H H 91 7.966 8.072 -0.106 1 1 1058 . 20 1 1 A 91 91 GLU HA H 91 4.890 4.054 0.836 1 1 1063 . 20 1 1 A 91 91 GLU CA C 91 55.324 59.023 -3.699 1 1 1064 . 20 1 1 A 91 91 GLU CB C 91 31.590 29.319 2.271 1 1 1066 . 20 1 1 A 91 91 GLU N N 91 119.310 120.044 -0.734 1 1 1067 . 20 1 1 A 92 92 GLU H H 92 7.263 8.079 -0.816 1 1 1068 . 20 1 1 A 92 92 GLU HA H 92 3.789 3.925 -0.136 1 1 1073 . 20 1 1 A 92 92 GLU CA C 92 60.628 57.902 2.726 1 1 1074 . 20 1 1 A 92 92 GLU CB C 92 30.531 41.502 -10.971 1 1 1076 . 20 1 1 A 92 92 GLU N N 92 121.332 120.100 1.232 1 1 1077 . 20 1 1 A 93 93 GLU H H 93 8.646 8.035 0.611 1 1 1078 . 20 1 1 A 93 93 GLU HA H 93 4.127 4.151 -0.024 1 1 1083 . 20 1 1 A 93 93 GLU CA C 93 60.528 55.271 5.257 1 1 1084 . 20 1 1 A 93 93 GLU CB C 93 29.744 18.203 11.541 1 1 1086 . 20 1 1 A 93 93 GLU N N 93 118.207 121.892 -3.685 1 1 1087 . 20 1 1 A 94 94 ILE H H 94 7.766 8.267 -0.501 1 1 1088 . 20 1 1 A 94 94 ILE HA H 94 3.976 3.899 0.077 1 1 1098 . 20 1 1 A 94 94 ILE CA C 94 64.361 58.186 6.175 1 1 1099 . 20 1 1 A 94 94 ILE CB C 94 38.921 41.385 -2.464 1 1 1103 . 20 1 1 A 94 94 ILE N N 94 119.072 118.164 0.908 1 1 1104 . 20 1 1 A 95 95 LEU H H 95 8.340 7.973 0.367 1 1 1105 . 20 1 1 A 95 95 LEU HA H 95 4.300 4.125 0.175 1 1 1115 . 20 1 1 A 95 95 LEU CA C 95 57.905 59.474 -1.569 1 1 1116 . 20 1 1 A 95 95 LEU CB C 95 42.144 29.192 12.952 1 1 1119 . 20 1 1 A 95 95 LEU N N 95 121.325 117.629 3.696 1 1 1120 . 20 1 1 A 96 96 LYS H H 96 8.899 7.935 0.964 1 1 1121 . 20 1 1 A 96 96 LYS HA H 96 4.075 3.998 0.077 1 1 1126 . 20 1 1 A 96 96 LYS CA C 96 61.707 57.868 3.839 1 1 1127 . 20 1 1 A 96 96 LYS CB C 96 32.910 41.688 -8.778 1 1 1128 . 20 1 1 A 96 96 LYS N N 96 120.018 122.061 -2.043 1 1 1129 . 20 1 1 A 97 97 LYS H H 97 7.808 8.022 -0.214 1 1 1130 . 20 1 1 A 97 97 LYS HA H 97 4.045 4.284 -0.239 1 1 1139 . 20 1 1 A 97 97 LYS CA C 97 60.198 56.227 3.971 1 1 1140 . 20 1 1 A 97 97 LYS CB C 97 32.600 41.215 -8.615 1 1 1143 . 20 1 1 A 97 97 LYS N N 97 121.016 115.511 5.505 1 1 1144 . 20 1 1 A 98 98 ALA H H 98 7.814 8.114 -0.300 1 1 1145 . 20 1 1 A 98 98 ALA HA H 98 4.320 4.778 -0.458 1 1 1149 . 20 1 1 A 98 98 ALA CA C 98 55.260 54.111 1.149 1 1 1150 . 20 1 1 A 98 98 ALA CB C 98 19.468 39.469 -20.001 1 1 1151 . 20 1 1 A 98 98 ALA N N 98 122.102 116.802 5.300 1 1 1152 . 20 1 1 A 99 99 LEU H H 99 8.212 7.869 0.343 1 1 1153 . 20 1 1 A 99 99 LEU HA H 99 4.187 4.814 -0.627 1 1 1160 . 20 1 1 A 99 99 LEU CA C 99 58.398 57.250 1.148 1 1 1161 . 20 1 1 A 99 99 LEU CB C 99 42.720 37.702 5.018 1 1 1164 . 20 1 1 A 99 99 LEU N N 99 118.467 115.621 2.846 1 1 1165 . 20 1 1 A 100 100 ARG H H 100 7.738 7.372 0.366 1 1 1166 . 20 1 1 A 100 100 ARG HA H 100 3.894 4.983 -1.089 1 1 1173 . 20 1 1 A 100 100 ARG CA C 100 60.135 52.691 7.444 1 1 1174 . 20 1 1 A 100 100 ARG CB C 100 30.187 45.032 -14.845 1 1 1177 . 20 1 1 A 100 100 ARG N N 100 119.100 117.007 2.093 1 1 1178 . 20 1 1 A 101 101 ASP H H 101 8.186 7.787 0.399 1 1 1179 . 20 1 1 A 101 101 ASP HA H 101 4.424 4.888 -0.464 1 1 1182 . 20 1 1 A 101 101 ASP CA C 101 57.902 50.766 7.136 1 1 1183 . 20 1 1 A 101 101 ASP CB C 101 40.033 39.594 0.439 1 1 1184 . 20 1 1 A 101 101 ASP N N 101 121.899 117.880 4.019 1 1 1185 . 20 1 1 A 102 102 LEU H H 102 8.730 8.582 0.148 1 1 1186 . 20 1 1 A 102 102 LEU HA H 102 4.373 4.112 0.261 1 1 1195 . 20 1 1 A 102 102 LEU CA C 102 58.218 58.336 -0.118 1 1 1196 . 20 1 1 A 102 102 LEU CB C 102 42.839 29.418 13.421 1 1 1199 . 20 1 1 A 102 102 LEU N N 102 124.505 118.469 6.036 1 1 1200 . 20 1 1 A 103 103 LYS HA H 103 3.726 4.338 -0.612 1 1 1209 . 20 1 1 A 103 103 LYS CA C 103 59.760 56.156 3.604 1 1 1210 . 20 1 1 A 103 103 LYS CB C 103 32.822 32.985 -0.163 1 1 1214 . 20 1 1 A 104 104 ARG H H 104 7.409 7.897 -0.488 1 1 1222 . 20 1 1 A 104 104 ARG CA C 104 56.298 45.193 11.105 1 1 1226 . 20 1 1 A 104 104 ARG N N 104 115.912 105.822 10.090 1 1 1227 . 20 1 1 A 105 105 GLY H H 105 8.046 7.885 0.161 1 1 1230 . 20 1 1 A 105 105 GLY CA C 105 46.309 55.857 -9.548 1 1 1231 . 20 1 1 A 105 105 GLY N N 105 108.860 118.346 -9.486 1 1 1232 . 20 1 1 A 106 106 LYS H H 106 8.033 8.394 -0.361 1 1 1233 . 20 1 1 A 106 106 LYS HA H 106 4.394 4.232 0.162 1 1 1242 . 20 1 1 A 106 106 LYS CA C 106 55.822 55.096 0.726 1 1 1243 . 20 1 1 A 106 106 LYS CB C 106 33.449 42.776 -9.327 1 1 1246 . 20 1 1 A 106 106 LYS N N 106 121.082 119.262 1.820 1 1 1247 . 20 1 1 A 107 107 LYS H H 107 8.271 8.608 -0.337 1 1 1248 . 20 1 1 A 107 107 LYS HA H 107 4.329 4.542 -0.213 1 1 1255 . 20 1 1 A 107 107 LYS CA C 107 56.673 59.065 -2.392 1 1 1256 . 20 1 1 A 107 107 LYS CB C 107 33.341 64.287 -30.946 1 1 1258 . 20 1 1 A 107 107 LYS N N 107 121.869 114.398 7.471 1 1 1259 . 20 1 1 A 108 108 LEU H H 108 8.481 7.575 0.906 1 1 1260 . 20 1 1 A 108 108 LEU HA H 108 4.637 4.828 -0.191 1 1 1269 . 20 1 1 A 108 108 LEU CA C 108 53.819 54.476 -0.657 1 1 1270 . 20 1 1 A 108 108 LEU CB C 108 45.135 36.910 8.225 1 1 1272 . 20 1 1 A 108 108 LEU N N 108 124.360 119.604 4.756 1 1 1273 . 20 1 1 A 109 109 LYS H H 109 8.657 8.893 -0.236 1 1 1274 . 20 1 1 A 109 109 LYS HA H 109 4.565 4.503 0.062 1 1 1283 . 20 1 1 A 109 109 LYS CA C 109 55.511 59.114 -3.603 1 1 1284 . 20 1 1 A 109 109 LYS CB C 109 32.029 64.079 -32.050 1 1 1287 . 20 1 1 A 109 109 LYS N N 109 123.165 118.039 5.126 1 1 1288 . 20 1 1 A 110 110 PRO HA H 110 4.232 3.583 0.649 1 1 1295 . 20 1 1 A 110 110 PRO CA C 110 66.732 66.652 0.080 1 1 1296 . 20 1 1 A 110 110 PRO CB C 110 32.481 31.575 0.906 1 1 1299 . 20 1 1 A 111 111 GLU HA H 111 4.221 3.923 0.298 1 1 1304 . 20 1 1 A 111 111 GLU CA C 111 59.819 59.906 -0.087 1 1 1305 . 20 1 1 A 111 111 GLU CB C 111 29.250 29.242 0.008 1 1 1307 . 20 1 1 A 112 112 ILE H H 112 7.233 8.169 -0.936 1 1 1308 . 20 1 1 A 112 112 ILE HA H 112 3.848 4.085 -0.237 1 1 1318 . 20 1 1 A 112 112 ILE CA C 112 62.635 59.205 3.430 1 1 1319 . 20 1 1 A 112 112 ILE CB C 112 37.159 29.311 7.848 1 1 1323 . 20 1 1 A 112 112 ILE N N 112 120.783 118.171 2.612 1 1 1324 . 20 1 1 A 113 113 LYS H H 113 8.268 8.041 0.227 1 1 1325 . 20 1 1 A 113 113 LYS HA H 113 3.849 3.726 0.123 1 1 1328 . 20 1 1 A 113 113 LYS CA C 113 60.248 65.297 -5.049 1 1 1329 . 20 1 1 A 113 113 LYS CB C 113 32.668 37.349 -4.681 1 1 1330 . 20 1 1 A 113 113 LYS N N 113 121.680 121.745 -0.065 1 1 1331 . 20 1 1 A 114 114 GLY H H 114 8.460 8.369 0.091 1 1 1334 . 20 1 1 A 114 114 GLY CA C 114 47.600 61.491 -13.891 1 1 1335 . 20 1 1 A 114 114 GLY N N 114 105.413 115.357 -9.944 1 1 1336 . 20 1 1 A 115 115 LYS H H 115 7.352 8.045 -0.693 1 1 1337 . 20 1 1 A 115 115 LYS HA H 115 4.189 4.350 -0.161 1 1 1346 . 20 1 1 A 115 115 LYS CA C 115 59.689 57.549 2.140 1 1 1347 . 20 1 1 A 115 115 LYS CB C 115 33.428 40.684 -7.256 1 1 1351 . 20 1 1 A 115 115 LYS N N 115 121.599 122.146 -0.547 1 1 1352 . 20 1 1 A 116 116 LEU H H 116 8.046 7.755 0.291 1 1 1353 . 20 1 1 A 116 116 LEU HA H 116 4.153 3.780 0.373 1 1 1363 . 20 1 1 A 116 116 LEU CA C 116 57.698 65.498 -7.800 1 1 1364 . 20 1 1 A 116 116 LEU CB C 116 42.070 31.458 10.612 1 1 1366 . 20 1 1 A 116 116 LEU N N 116 118.827 116.748 2.079 1 1 1367 . 20 1 1 A 117 117 SER H H 117 8.321 7.554 0.767 1 1 1368 . 20 1 1 A 117 117 SER HA H 117 4.334 4.215 0.119 1 1 1371 . 20 1 1 A 117 117 SER CA C 117 61.467 54.301 7.166 1 1 1372 . 20 1 1 A 117 117 SER CB C 117 63.613 41.980 21.633 1 1 1373 . 20 1 1 A 117 117 SER N N 117 114.829 118.591 -3.762 1 1 1374 . 20 1 1 A 118 118 ARG H H 118 7.001 7.618 -0.617 1 1 1375 . 20 1 1 A 118 118 ARG HA H 118 4.403 3.880 0.523 1 1 1382 . 20 1 1 A 118 118 ARG CA C 118 56.734 57.038 -0.304 1 1 1383 . 20 1 1 A 118 118 ARG CB C 118 31.115 27.302 3.813 1 1 1385 . 20 1 1 A 118 118 ARG N N 118 118.114 114.248 3.866 1 1 1386 . 20 1 1 A 119 119 LEU H H 119 7.365 8.275 -0.910 1 1 1387 . 20 1 1 A 119 119 LEU HA H 119 4.253 4.883 -0.630 1 1 1397 . 20 1 1 A 119 119 LEU CA C 119 54.639 57.746 -3.107 1 1 1398 . 20 1 1 A 119 119 LEU CB C 119 41.700 31.441 10.259 1 1 1401 . 20 1 1 A 119 119 LEU N N 119 119.181 117.429 1.752 1 1 1402 . 20 1 1 A 120 120 ARG H H 120 8.766 8.796 -0.030 1 1 1403 . 20 1 1 A 120 120 ARG HA H 120 4.374 4.453 -0.079 1 1 1410 . 20 1 1 A 120 120 ARG CA C 120 56.426 59.330 -2.904 1 1 1411 . 20 1 1 A 120 120 ARG CB C 120 32.414 63.714 -31.300 1 1 1414 . 20 1 1 A 120 120 ARG N N 120 122.099 120.815 1.284 1 1 1415 . 20 1 1 A 121 121 LEU H H 121 8.312 8.718 -0.406 1 1 1416 . 20 1 1 A 121 121 LEU HA H 121 4.407 3.560 0.847 1 1 1426 . 20 1 1 A 121 121 LEU CA C 121 56.028 67.001 -10.973 1 1 1427 . 20 1 1 A 121 121 LEU CB C 121 43.122 32.025 11.097 1 1 1430 . 20 1 1 A 121 121 LEU N N 121 118.761 124.125 -5.364 1 1 1431 . 20 1 1 A 122 122 PHE H H 122 7.143 8.171 -1.028 1 1 1432 . 20 1 1 A 122 122 PHE HA H 122 5.201 4.111 1.090 1 1 1439 . 20 1 1 A 122 122 PHE CA C 122 53.047 59.101 -6.054 1 1 1440 . 20 1 1 A 122 122 PHE CB C 122 40.844 29.402 11.442 1 1 1441 . 20 1 1 A 122 122 PHE N N 122 112.750 119.732 -6.982 1 1 1442 . 20 1 1 A 123 123 PRO HA H 123 3.908 3.974 -0.066 1 1 1449 . 20 1 1 A 123 123 PRO CA C 123 65.478 59.237 6.241 1 1 1450 . 20 1 1 A 123 123 PRO CB C 123 33.248 29.297 3.951 1 1 1452 . 20 1 1 A 124 124 LEU H H 124 7.208 7.851 -0.643 1 1 1453 . 20 1 1 A 124 124 LEU HA H 124 4.673 4.078 0.595 1 1 1463 . 20 1 1 A 124 124 LEU CA C 124 53.307 57.633 -4.326 1 1 1464 . 20 1 1 A 124 124 LEU CB C 124 42.853 41.952 0.901 1 1 1468 . 20 1 1 A 124 124 LEU N N 124 113.875 121.495 -7.620 1 1 1469 . 20 1 1 A 125 125 SER H H 125 8.990 8.068 0.922 1 1 1470 . 20 1 1 A 125 125 SER HA H 125 4.533 3.986 0.547 1 1 1473 . 20 1 1 A 125 125 SER CA C 125 59.198 59.728 -0.530 1 1 1474 . 20 1 1 A 125 125 SER CB C 125 64.578 29.297 35.281 1 1 1475 . 20 1 1 A 125 125 SER N N 125 117.894 119.986 -2.092 1 1 1476 . 20 1 1 A 126 126 SER H H 126 8.618 7.828 0.790 1 1 1477 . 20 1 1 A 126 126 SER HA H 126 4.614 3.990 0.624 1 1 1480 . 20 1 1 A 126 126 SER CA C 126 58.730 59.745 -1.015 1 1 1481 . 20 1 1 A 126 126 SER CB C 126 64.367 32.344 32.023 1 1 1482 . 20 1 1 A 126 126 SER N N 126 118.602 118.942 -0.340 1 1 1483 . 20 1 1 A 127 127 SER HA H 127 4.530 3.758 0.772 1 1 1486 . 20 1 1 A 127 127 SER CA C 127 58.954 65.887 -6.933 1 1 1487 . 20 1 1 A 127 127 SER CB C 127 64.379 31.473 32.906 1 1 1488 . 20 1 1 A 128 128 ALA H H 128 8.345 8.174 0.171 1 1 1489 . 20 1 1 A 128 128 ALA HA H 128 4.432 3.957 0.475 1 1 1493 . 20 1 1 A 128 128 ALA CA C 128 52.963 59.301 -6.338 1 1 1494 . 20 1 1 A 128 128 ALA CB C 128 19.924 29.709 -9.785 1 1 1495 . 20 1 1 A 128 128 ALA N N 128 126.185 121.972 4.213 1 1 1496 . 20 1 1 A 129 129 GLU H H 129 8.329 7.998 0.331 1 1 1497 . 20 1 1 A 129 129 GLU HA H 129 4.353 4.071 0.282 1 1 1502 . 20 1 1 A 129 129 GLU CA C 129 57.111 58.637 -1.526 1 1 1503 . 20 1 1 A 129 129 GLU CB C 129 30.949 28.565 2.384 1 1 1504 . 20 1 1 A 129 129 GLU N N 129 120.842 118.511 2.331 1 1 1505 . 20 1 1 A 130 130 LYS H H 130 7.947 7.988 -0.041 1 1 1506 . 20 1 1 A 130 130 LYS HA H 130 3.835 4.031 -0.196 1 1 1515 . 20 1 1 A 130 130 LYS CA C 130 57.756 59.719 -1.963 1 1 1516 . 20 1 1 A 130 130 LYS CB C 130 33.156 32.096 1.060 1 stop_ loop_ _SPARTA_output.Data_ID _SPARTA_output.Assigned_chem_shift_list_ID _SPARTA_output.Conformer_ID _SPARTA_output.Entity_ID _SPARTA_output.Data_type _SPARTA_output.Data_atom _SPARTA_output.Data_num_shifts _SPARTA_output.Data_value _SPARTA_output.Entity_delta_chem_shifts_ID 1 1 1 1 "RMS(OBS, PRED)" C 0 0.000 1 2 1 1 1 "RMS(OBS, PRED)" CA 61 5.630 1 3 1 1 1 "RMS(OBS, PRED)" CB 56 15.407 1 4 1 1 1 "RMS(OBS, PRED)" H 54 0.720 1 5 1 1 1 "RMS(OBS, PRED)" HA 56 0.582 1 6 1 1 1 "RMS(OBS, PRED)" N 54 5.893 1 7 1 2 1 "RMS(OBS, PRED)" C 0 0.000 1 8 1 2 1 "RMS(OBS, PRED)" CA 61 5.729 1 9 1 2 1 "RMS(OBS, PRED)" CB 56 15.380 1 10 1 2 1 "RMS(OBS, PRED)" H 54 0.682 1 11 1 2 1 "RMS(OBS, PRED)" HA 56 0.579 1 12 1 2 1 "RMS(OBS, PRED)" N 54 5.822 1 13 1 3 1 "RMS(OBS, PRED)" C 0 0.000 1 14 1 3 1 "RMS(OBS, PRED)" CA 61 5.661 1 15 1 3 1 "RMS(OBS, PRED)" CB 56 15.358 1 16 1 3 1 "RMS(OBS, PRED)" H 54 0.668 1 17 1 3 1 "RMS(OBS, PRED)" HA 56 0.576 1 18 1 3 1 "RMS(OBS, PRED)" N 54 5.841 1 19 1 4 1 "RMS(OBS, PRED)" C 0 0.000 1 20 1 4 1 "RMS(OBS, PRED)" CA 61 5.679 1 21 1 4 1 "RMS(OBS, PRED)" CB 56 15.384 1 22 1 4 1 "RMS(OBS, PRED)" H 54 0.724 1 23 1 4 1 "RMS(OBS, PRED)" HA 56 0.564 1 24 1 4 1 "RMS(OBS, PRED)" N 54 5.858 1 25 1 5 1 "RMS(OBS, PRED)" C 0 0.000 1 26 1 5 1 "RMS(OBS, PRED)" CA 61 5.669 1 27 1 5 1 "RMS(OBS, PRED)" CB 56 15.375 1 28 1 5 1 "RMS(OBS, PRED)" H 54 0.692 1 29 1 5 1 "RMS(OBS, PRED)" HA 56 0.570 1 30 1 5 1 "RMS(OBS, PRED)" N 54 6.013 1 31 1 6 1 "RMS(OBS, PRED)" C 0 0.000 1 32 1 6 1 "RMS(OBS, PRED)" CA 61 5.722 1 33 1 6 1 "RMS(OBS, PRED)" CB 56 15.427 1 34 1 6 1 "RMS(OBS, PRED)" H 54 0.690 1 35 1 6 1 "RMS(OBS, PRED)" HA 56 0.591 1 36 1 6 1 "RMS(OBS, PRED)" N 54 5.841 1 37 1 7 1 "RMS(OBS, PRED)" C 0 0.000 1 38 1 7 1 "RMS(OBS, PRED)" CA 61 5.629 1 39 1 7 1 "RMS(OBS, PRED)" CB 56 15.374 1 40 1 7 1 "RMS(OBS, PRED)" H 54 0.680 1 41 1 7 1 "RMS(OBS, PRED)" HA 56 0.568 1 42 1 7 1 "RMS(OBS, PRED)" N 54 5.809 1 43 1 8 1 "RMS(OBS, PRED)" C 0 0.000 1 44 1 8 1 "RMS(OBS, PRED)" CA 61 5.666 1 45 1 8 1 "RMS(OBS, PRED)" CB 56 15.433 1 46 1 8 1 "RMS(OBS, PRED)" H 54 0.675 1 47 1 8 1 "RMS(OBS, PRED)" HA 56 0.574 1 48 1 8 1 "RMS(OBS, PRED)" N 54 5.853 1 49 1 9 1 "RMS(OBS, PRED)" C 0 0.000 1 50 1 9 1 "RMS(OBS, PRED)" CA 61 5.626 1 51 1 9 1 "RMS(OBS, PRED)" CB 56 15.354 1 52 1 9 1 "RMS(OBS, PRED)" H 54 0.705 1 53 1 9 1 "RMS(OBS, PRED)" HA 56 0.572 1 54 1 9 1 "RMS(OBS, PRED)" N 54 5.783 1 55 1 10 1 "RMS(OBS, PRED)" C 0 0.000 1 56 1 10 1 "RMS(OBS, PRED)" CA 61 5.689 1 57 1 10 1 "RMS(OBS, PRED)" CB 56 15.317 1 58 1 10 1 "RMS(OBS, PRED)" H 54 0.700 1 59 1 10 1 "RMS(OBS, PRED)" HA 56 0.571 1 60 1 10 1 "RMS(OBS, PRED)" N 54 5.804 1 61 1 11 1 "RMS(OBS, PRED)" C 0 0.000 1 62 1 11 1 "RMS(OBS, PRED)" CA 61 5.685 1 63 1 11 1 "RMS(OBS, PRED)" CB 56 15.446 1 64 1 11 1 "RMS(OBS, PRED)" H 54 0.679 1 65 1 11 1 "RMS(OBS, PRED)" HA 56 0.599 1 66 1 11 1 "RMS(OBS, PRED)" N 54 5.960 1 67 1 12 1 "RMS(OBS, PRED)" C 0 0.000 1 68 1 12 1 "RMS(OBS, PRED)" CA 61 5.659 1 69 1 12 1 "RMS(OBS, PRED)" CB 56 15.377 1 70 1 12 1 "RMS(OBS, PRED)" H 54 0.698 1 71 1 12 1 "RMS(OBS, PRED)" HA 56 0.569 1 72 1 12 1 "RMS(OBS, PRED)" N 54 5.979 1 73 1 13 1 "RMS(OBS, PRED)" C 0 0.000 1 74 1 13 1 "RMS(OBS, PRED)" CA 61 5.652 1 75 1 13 1 "RMS(OBS, PRED)" CB 56 15.355 1 76 1 13 1 "RMS(OBS, PRED)" H 54 0.729 1 77 1 13 1 "RMS(OBS, PRED)" HA 56 0.568 1 78 1 13 1 "RMS(OBS, PRED)" N 54 5.869 1 79 1 14 1 "RMS(OBS, PRED)" C 0 0.000 1 80 1 14 1 "RMS(OBS, PRED)" CA 61 5.702 1 81 1 14 1 "RMS(OBS, PRED)" CB 56 15.382 1 82 1 14 1 "RMS(OBS, PRED)" H 54 0.702 1 83 1 14 1 "RMS(OBS, PRED)" HA 56 0.595 1 84 1 14 1 "RMS(OBS, PRED)" N 54 5.928 1 85 1 15 1 "RMS(OBS, PRED)" C 0 0.000 1 86 1 15 1 "RMS(OBS, PRED)" CA 61 5.647 1 87 1 15 1 "RMS(OBS, PRED)" CB 56 15.375 1 88 1 15 1 "RMS(OBS, PRED)" H 54 0.704 1 89 1 15 1 "RMS(OBS, PRED)" HA 56 0.566 1 90 1 15 1 "RMS(OBS, PRED)" N 54 5.723 1 91 1 16 1 "RMS(OBS, PRED)" C 0 0.000 1 92 1 16 1 "RMS(OBS, PRED)" CA 61 5.665 1 93 1 16 1 "RMS(OBS, PRED)" CB 56 15.356 1 94 1 16 1 "RMS(OBS, PRED)" H 54 0.719 1 95 1 16 1 "RMS(OBS, PRED)" HA 56 0.571 1 96 1 16 1 "RMS(OBS, PRED)" N 54 5.932 1 97 1 17 1 "RMS(OBS, PRED)" C 0 0.000 1 98 1 17 1 "RMS(OBS, PRED)" CA 61 5.668 1 99 1 17 1 "RMS(OBS, PRED)" CB 56 15.378 1 100 1 17 1 "RMS(OBS, PRED)" H 54 0.680 1 101 1 17 1 "RMS(OBS, PRED)" HA 56 0.570 1 102 1 17 1 "RMS(OBS, PRED)" N 54 5.830 1 103 1 18 1 "RMS(OBS, PRED)" C 0 0.000 1 104 1 18 1 "RMS(OBS, PRED)" CA 61 5.638 1 105 1 18 1 "RMS(OBS, PRED)" CB 56 15.351 1 106 1 18 1 "RMS(OBS, PRED)" H 54 0.683 1 107 1 18 1 "RMS(OBS, PRED)" HA 56 0.576 1 108 1 18 1 "RMS(OBS, PRED)" N 54 5.855 1 109 1 19 1 "RMS(OBS, PRED)" C 0 0.000 1 110 1 19 1 "RMS(OBS, PRED)" CA 61 5.676 1 111 1 19 1 "RMS(OBS, PRED)" CB 56 15.433 1 112 1 19 1 "RMS(OBS, PRED)" H 54 0.682 1 113 1 19 1 "RMS(OBS, PRED)" HA 56 0.567 1 114 1 19 1 "RMS(OBS, PRED)" N 54 5.893 1 115 1 20 1 "RMS(OBS, PRED)" C 0 0.000 1 116 1 20 1 "RMS(OBS, PRED)" CA 61 5.721 1 117 1 20 1 "RMS(OBS, PRED)" CB 56 15.319 1 118 1 20 1 "RMS(OBS, PRED)" H 54 0.666 1 119 1 20 1 "RMS(OBS, PRED)" HA 56 0.567 1 120 1 20 1 "RMS(OBS, PRED)" N 54 5.886 1 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.Conformer_type "average" _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.Assigned_chem_shift_list_ID _Delta_CS.Atom_chem_shift_ID _Delta_CS.Assembly_atom_ID _Delta_CS.Entity_assembly_ID _Delta_CS.Entity_ID _Delta_CS.PDB_asym_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.Sparta_CS_value _Delta_CS.Delta_CS_value _Delta_CS.Entity_delta_chem_shifts_ID 1 826 . 1 1 A 70 70 GLY H H 70 9.295 8.392 0.903 2 1 829 . 1 1 A 70 70 GLY CA C 70 46.552 59.020 -12.468 2 1 830 . 1 1 A 70 70 GLY N N 70 108.643 117.361 -8.718 2 1 832 . 1 1 A 71 71 VAL HA H 71 3.538 4.837 -1.299 2 1 840 . 1 1 A 71 71 VAL CA C 71 65.623 62.781 2.842 2 1 841 . 1 1 A 71 71 VAL CB C 71 30.251 32.089 -1.838 2 1 844 . 1 1 A 71 71 VAL N N 71 110.808 136.498 -25.690 2 1 845 . 1 1 A 72 72 CYS H H 72 8.022 8.564 -0.542 2 1 846 . 1 1 A 72 72 CYS HA H 72 3.469 4.821 -1.352 2 1 849 . 1 1 A 72 72 CYS CA C 72 62.733 57.747 4.986 2 1 850 . 1 1 A 72 72 CYS CB C 72 27.163 63.862 -36.700 2 1 851 . 1 1 A 72 72 CYS N N 72 109.483 116.219 -6.736 2 1 852 . 1 1 A 73 73 SER H H 73 7.996 8.271 -0.275 2 1 853 . 1 1 A 73 73 SER HA H 73 4.439 4.072 0.367 2 1 856 . 1 1 A 73 73 SER CA C 73 62.145 59.295 2.850 2 1 857 . 1 1 A 73 73 SER CB C 73 66.013 29.362 36.651 2 1 858 . 1 1 A 73 73 SER N N 73 118.630 122.681 -4.051 2 1 859 . 1 1 A 74 74 LYS H H 74 10.186 7.929 2.257 2 1 860 . 1 1 A 74 74 LYS HA H 74 4.172 3.972 0.200 2 1 867 . 1 1 A 74 74 LYS CA C 74 59.848 58.377 1.471 2 1 868 . 1 1 A 74 74 LYS CB C 74 34.278 41.483 -7.205 2 1 870 . 1 1 A 74 74 LYS N N 74 123.341 118.763 4.578 2 1 871 . 1 1 A 75 75 ASP H H 75 7.542 8.234 -0.692 2 1 872 . 1 1 A 75 75 ASP HA H 75 3.538 3.967 -0.429 2 1 875 . 1 1 A 75 75 ASP CA C 75 52.472 59.816 -7.344 2 1 876 . 1 1 A 75 75 ASP CB C 75 42.360 29.286 13.074 2 1 877 . 1 1 A 75 75 ASP N N 75 112.035 119.592 -7.557 2 1 878 . 1 1 A 76 76 VAL H H 76 8.128 8.299 -0.171 2 1 879 . 1 1 A 76 76 VAL HA H 76 4.106 4.020 0.086 2 1 887 . 1 1 A 76 76 VAL CA C 76 65.179 59.145 6.034 2 1 888 . 1 1 A 76 76 VAL CB C 76 32.174 29.104 3.070 2 1 891 . 1 1 A 76 76 VAL N N 76 117.992 120.450 -2.458 2 1 892 . 1 1 A 77 77 TRP H H 77 6.869 7.970 -1.101 2 1 893 . 1 1 A 77 77 TRP HA H 77 4.509 4.107 0.402 2 1 899 . 1 1 A 77 77 TRP CA C 77 59.207 57.742 1.465 2 1 900 . 1 1 A 77 77 TRP CB C 77 28.941 41.457 -12.516 2 1 901 . 1 1 A 77 77 TRP N N 77 123.077 121.441 1.636 2 1 903 . 1 1 A 78 78 GLU H H 78 8.593 8.374 0.219 2 1 904 . 1 1 A 78 78 GLU HA H 78 4.318 3.899 0.419 2 1 909 . 1 1 A 78 78 GLU CA C 78 60.038 59.176 0.862 2 1 910 . 1 1 A 78 78 GLU CB C 78 31.178 28.315 2.863 2 1 912 . 1 1 A 78 78 GLU N N 78 121.505 117.898 3.607 2 1 913 . 1 1 A 79 79 PHE H H 79 8.071 8.129 -0.058 2 1 914 . 1 1 A 79 79 PHE HA H 79 4.986 4.071 0.915 2 1 919 . 1 1 A 79 79 PHE CA C 79 58.749 58.760 -0.011 2 1 920 . 1 1 A 79 79 PHE CB C 79 39.732 28.917 10.815 2 1 921 . 1 1 A 79 79 PHE N N 79 118.384 118.141 0.243 2 1 922 . 1 1 A 80 80 LEU H H 80 9.309 7.904 1.405 2 1 923 . 1 1 A 80 80 LEU HA H 80 3.970 4.443 -0.473 2 1 933 . 1 1 A 80 80 LEU CA C 80 59.307 56.440 2.867 2 1 934 . 1 1 A 80 80 LEU CB C 80 43.257 38.204 5.053 2 1 937 . 1 1 A 80 80 LEU N N 80 122.915 118.389 4.526 2 1 938 . 1 1 A 81 81 GLU H H 81 8.282 8.020 0.262 2 1 939 . 1 1 A 81 81 GLU HA H 81 3.832 3.609 0.223 2 1 944 . 1 1 A 81 81 GLU CA C 81 62.069 65.180 -3.111 2 1 945 . 1 1 A 81 81 GLU CB C 81 30.249 38.143 -7.894 2 1 947 . 1 1 A 81 81 GLU N N 81 119.345 120.398 -1.053 2 1 948 . 1 1 A 82 82 LEU H H 82 8.236 7.921 0.315 2 1 949 . 1 1 A 82 82 LEU HA H 82 4.187 4.411 -0.224 2 1 959 . 1 1 A 82 82 LEU CA C 82 58.348 58.698 -0.350 2 1 960 . 1 1 A 82 82 LEU CB C 82 42.827 31.993 10.834 2 1 963 . 1 1 A 82 82 LEU N N 82 120.013 119.329 0.684 2 1 964 . 1 1 A 83 83 GLN H H 83 7.949 8.011 -0.062 2 1 965 . 1 1 A 83 83 GLN HA H 83 3.812 3.934 -0.122 2 1 968 . 1 1 A 83 83 GLN CA C 83 60.248 58.072 2.176 2 1 969 . 1 1 A 83 83 GLN CB C 83 33.537 41.516 -7.979 2 1 970 . 1 1 A 83 83 GLN N N 83 116.443 120.493 -4.050 2 1 971 . 1 1 A 84 84 ILE H H 84 8.407 8.492 -0.085 2 1 972 . 1 1 A 84 84 ILE HA H 84 3.644 4.137 -0.493 2 1 982 . 1 1 A 84 84 ILE CA C 84 67.288 58.809 8.479 2 1 983 . 1 1 A 84 84 ILE CB C 84 38.305 29.362 8.943 2 1 987 . 1 1 A 84 84 ILE N N 84 120.422 117.757 2.665 2 1 988 . 1 1 A 85 85 GLU H H 85 7.741 8.120 -0.379 2 1 989 . 1 1 A 85 85 GLU HA H 85 3.811 4.977 -1.166 2 1 994 . 1 1 A 85 85 GLU CA C 85 59.862 52.805 7.057 2 1 995 . 1 1 A 85 85 GLU CB C 85 30.360 45.903 -15.543 2 1 997 . 1 1 A 85 85 GLU N N 85 115.705 116.742 -1.037 2 1 998 . 1 1 A 86 86 GLU H H 86 7.818 8.700 -0.882 2 1 999 . 1 1 A 86 86 GLU HA H 86 4.274 4.714 -0.440 2 1 1004 . 1 1 A 86 86 GLU CA C 86 58.068 55.798 2.270 2 1 1005 . 1 1 A 86 86 GLU CB C 86 31.424 33.447 -2.023 2 1 1007 . 1 1 A 86 86 GLU N N 86 114.297 118.551 -4.254 2 1 1008 . 1 1 A 87 87 ILE H H 87 8.753 8.445 0.308 2 1 1019 . 1 1 A 87 87 ILE CA C 87 62.660 44.671 17.989 2 1 1024 . 1 1 A 87 87 ILE N N 87 118.890 110.025 8.865 2 1 1025 . 1 1 A 88 88 TYR H H 88 8.059 8.816 -0.757 2 1 1026 . 1 1 A 88 88 TYR HA H 88 5.447 4.179 1.268 2 1 1033 . 1 1 A 88 88 TYR CA C 88 55.285 58.446 -3.161 2 1 1034 . 1 1 A 88 88 TYR CB C 88 40.687 32.221 8.466 2 1 1035 . 1 1 A 88 88 TYR N N 88 119.252 125.313 -6.061 2 1 1036 . 1 1 A 89 89 PRO HA H 89 4.410 3.996 0.414 2 1 1043 . 1 1 A 89 89 PRO CA C 89 66.374 59.439 6.935 2 1 1044 . 1 1 A 89 89 PRO CB C 89 31.377 29.154 2.223 2 1 1047 . 1 1 A 90 90 GLU H H 90 9.234 8.252 0.982 2 1 1048 . 1 1 A 90 90 GLU HA H 90 4.379 4.014 0.365 2 1 1053 . 1 1 A 90 90 GLU CA C 90 59.098 58.696 0.402 2 1 1054 . 1 1 A 90 90 GLU CB C 90 29.461 28.225 1.236 2 1 1056 . 1 1 A 90 90 GLU N N 90 117.574 118.082 -0.508 2 1 1057 . 1 1 A 91 91 GLU H H 91 7.966 8.042 -0.076 2 1 1058 . 1 1 A 91 91 GLU HA H 91 4.890 4.050 0.840 2 1 1063 . 1 1 A 91 91 GLU CA C 91 55.324 59.067 -3.743 2 1 1064 . 1 1 A 91 91 GLU CB C 91 31.590 29.334 2.256 2 1 1066 . 1 1 A 91 91 GLU N N 91 119.310 119.794 -0.484 2 1 1067 . 1 1 A 92 92 GLU H H 92 7.263 8.053 -0.790 2 1 1068 . 1 1 A 92 92 GLU HA H 92 3.789 3.935 -0.146 2 1 1073 . 1 1 A 92 92 GLU CA C 92 60.628 57.933 2.695 2 1 1074 . 1 1 A 92 92 GLU CB C 92 30.531 41.559 -11.028 2 1 1076 . 1 1 A 92 92 GLU N N 92 121.332 120.274 1.058 2 1 1077 . 1 1 A 93 93 GLU H H 93 8.646 7.991 0.655 2 1 1078 . 1 1 A 93 93 GLU HA H 93 4.127 4.093 0.034 2 1 1083 . 1 1 A 93 93 GLU CA C 93 60.528 55.378 5.150 2 1 1084 . 1 1 A 93 93 GLU CB C 93 29.744 18.255 11.489 2 1 1086 . 1 1 A 93 93 GLU N N 93 118.207 121.427 -3.220 2 1 1087 . 1 1 A 94 94 ILE H H 94 7.766 8.314 -0.548 2 1 1088 . 1 1 A 94 94 ILE HA H 94 3.976 3.910 0.066 2 1 1098 . 1 1 A 94 94 ILE CA C 94 64.361 58.167 6.194 2 1 1099 . 1 1 A 94 94 ILE CB C 94 38.921 41.413 -2.492 2 1 1103 . 1 1 A 94 94 ILE N N 94 119.072 118.148 0.924 2 1 1104 . 1 1 A 95 95 LEU H H 95 8.340 8.052 0.288 2 1 1105 . 1 1 A 95 95 LEU HA H 95 4.300 4.133 0.167 2 1 1115 . 1 1 A 95 95 LEU CA C 95 57.905 59.485 -1.580 2 1 1116 . 1 1 A 95 95 LEU CB C 95 42.144 29.209 12.935 2 1 1119 . 1 1 A 95 95 LEU N N 95 121.325 117.704 3.621 2 1 1120 . 1 1 A 96 96 LYS H H 96 8.899 7.979 0.920 2 1 1121 . 1 1 A 96 96 LYS HA H 96 4.075 4.019 0.056 2 1 1126 . 1 1 A 96 96 LYS CA C 96 61.707 57.873 3.834 2 1 1127 . 1 1 A 96 96 LYS CB C 96 32.910 41.717 -8.807 2 1 1128 . 1 1 A 96 96 LYS N N 96 120.018 122.125 -2.107 2 1 1129 . 1 1 A 97 97 LYS H H 97 7.808 8.025 -0.217 2 1 1130 . 1 1 A 97 97 LYS HA H 97 4.045 4.298 -0.253 2 1 1139 . 1 1 A 97 97 LYS CA C 97 60.198 56.146 4.052 2 1 1140 . 1 1 A 97 97 LYS CB C 97 32.600 41.265 -8.665 2 1 1143 . 1 1 A 97 97 LYS N N 97 121.016 115.657 5.359 2 1 1144 . 1 1 A 98 98 ALA H H 98 7.814 8.243 -0.429 2 1 1145 . 1 1 A 98 98 ALA HA H 98 4.320 4.733 -0.413 2 1 1149 . 1 1 A 98 98 ALA CA C 98 55.260 54.412 0.848 2 1 1150 . 1 1 A 98 98 ALA CB C 98 19.468 39.474 -20.006 2 1 1151 . 1 1 A 98 98 ALA N N 98 122.102 116.626 5.476 2 1 1152 . 1 1 A 99 99 LEU H H 99 8.212 7.886 0.326 2 1 1153 . 1 1 A 99 99 LEU HA H 99 4.187 4.778 -0.591 2 1 1160 . 1 1 A 99 99 LEU CA C 99 58.398 56.732 1.666 2 1 1161 . 1 1 A 99 99 LEU CB C 99 42.720 36.995 5.725 2 1 1164 . 1 1 A 99 99 LEU N N 99 118.467 115.665 2.802 2 1 1165 . 1 1 A 100 100 ARG H H 100 7.738 7.472 0.266 2 1 1166 . 1 1 A 100 100 ARG HA H 100 3.894 5.177 -1.283 2 1 1173 . 1 1 A 100 100 ARG CA C 100 60.135 52.813 7.322 2 1 1174 . 1 1 A 100 100 ARG CB C 100 30.187 45.350 -15.163 2 1 1177 . 1 1 A 100 100 ARG N N 100 119.100 117.408 1.692 2 1 1178 . 1 1 A 101 101 ASP H H 101 8.186 8.194 -0.008 2 1 1179 . 1 1 A 101 101 ASP HA H 101 4.424 4.895 -0.471 2 1 1182 . 1 1 A 101 101 ASP CA C 101 57.902 51.561 6.341 2 1 1183 . 1 1 A 101 101 ASP CB C 101 40.033 40.395 -0.362 2 1 1184 . 1 1 A 101 101 ASP N N 101 121.899 118.211 3.688 2 1 1185 . 1 1 A 102 102 LEU H H 102 8.730 8.702 0.028 2 1 1186 . 1 1 A 102 102 LEU HA H 102 4.373 4.139 0.234 2 1 1195 . 1 1 A 102 102 LEU CA C 102 58.218 57.984 0.234 2 1 1196 . 1 1 A 102 102 LEU CB C 102 42.839 29.385 13.454 2 1 1199 . 1 1 A 102 102 LEU N N 102 124.505 121.888 2.617 2 1 1200 . 1 1 A 103 103 LYS HA H 103 3.726 4.274 -0.548 2 1 1209 . 1 1 A 103 103 LYS CA C 103 59.760 56.028 3.732 2 1 1210 . 1 1 A 103 103 LYS CB C 103 32.822 32.834 -0.011 2 1 1214 . 1 1 A 104 104 ARG H H 104 7.409 7.892 -0.483 2 1 1222 . 1 1 A 104 104 ARG CA C 104 56.298 45.154 11.144 2 1 1226 . 1 1 A 104 104 ARG N N 104 115.912 105.836 10.076 2 1 1227 . 1 1 A 105 105 GLY H H 105 8.046 7.588 0.458 2 1 1230 . 1 1 A 105 105 GLY CA C 105 46.309 55.455 -9.146 2 1 1231 . 1 1 A 105 105 GLY N N 105 108.860 117.414 -8.554 2 1 1232 . 1 1 A 106 106 LYS H H 106 8.033 8.444 -0.411 2 1 1233 . 1 1 A 106 106 LYS HA H 106 4.394 4.275 0.119 2 1 1242 . 1 1 A 106 106 LYS CA C 106 55.822 55.289 0.533 2 1 1243 . 1 1 A 106 106 LYS CB C 106 33.449 42.660 -9.211 2 1 1246 . 1 1 A 106 106 LYS N N 106 121.082 118.692 2.390 2 1 1247 . 1 1 A 107 107 LYS H H 107 8.271 8.738 -0.467 2 1 1248 . 1 1 A 107 107 LYS HA H 107 4.329 4.510 -0.181 2 1 1255 . 1 1 A 107 107 LYS CA C 107 56.673 59.125 -2.452 2 1 1256 . 1 1 A 107 107 LYS CB C 107 33.341 64.204 -30.863 2 1 1258 . 1 1 A 107 107 LYS N N 107 121.869 114.970 6.899 2 1 1259 . 1 1 A 108 108 LEU H H 108 8.481 7.489 0.993 2 1 1260 . 1 1 A 108 108 LEU HA H 108 4.637 4.931 -0.294 2 1 1269 . 1 1 A 108 108 LEU CA C 108 53.819 54.543 -0.724 2 1 1270 . 1 1 A 108 108 LEU CB C 108 45.135 36.207 8.928 2 1 1272 . 1 1 A 108 108 LEU N N 108 124.360 118.716 5.644 2 1 1273 . 1 1 A 109 109 LYS H H 109 8.657 8.941 -0.284 2 1 1274 . 1 1 A 109 109 LYS HA H 109 4.565 4.523 0.042 2 1 1283 . 1 1 A 109 109 LYS CA C 109 55.511 58.890 -3.379 2 1 1284 . 1 1 A 109 109 LYS CB C 109 32.029 64.154 -32.125 2 1 1287 . 1 1 A 109 109 LYS N N 109 123.165 117.550 5.615 2 1 1288 . 1 1 A 110 110 PRO HA H 110 4.232 3.596 0.636 2 1 1295 . 1 1 A 110 110 PRO CA C 110 66.732 66.614 0.118 2 1 1296 . 1 1 A 110 110 PRO CB C 110 32.481 31.535 0.946 2 1 1299 . 1 1 A 111 111 GLU HA H 111 4.221 3.904 0.317 2 1 1304 . 1 1 A 111 111 GLU CA C 111 59.819 59.837 -0.018 2 1 1305 . 1 1 A 111 111 GLU CB C 111 29.250 29.161 0.089 2 1 1307 . 1 1 A 112 112 ILE H H 112 7.233 8.181 -0.948 2 1 1308 . 1 1 A 112 112 ILE HA H 112 3.848 4.079 -0.231 2 1 1318 . 1 1 A 112 112 ILE CA C 112 62.635 59.180 3.455 2 1 1319 . 1 1 A 112 112 ILE CB C 112 37.159 29.275 7.884 2 1 1323 . 1 1 A 112 112 ILE N N 112 120.783 118.154 2.629 2 1 1324 . 1 1 A 113 113 LYS H H 113 8.268 7.946 0.322 2 1 1325 . 1 1 A 113 113 LYS HA H 113 3.849 3.680 0.169 2 1 1328 . 1 1 A 113 113 LYS CA C 113 60.248 65.082 -4.834 2 1 1329 . 1 1 A 113 113 LYS CB C 113 32.668 37.443 -4.775 2 1 1330 . 1 1 A 113 113 LYS N N 113 121.680 121.728 -0.048 2 1 1331 . 1 1 A 114 114 GLY H H 114 8.460 8.336 0.124 2 1 1334 . 1 1 A 114 114 GLY CA C 114 47.600 61.207 -13.607 2 1 1335 . 1 1 A 114 114 GLY N N 114 105.413 115.968 -10.555 2 1 1336 . 1 1 A 115 115 LYS H H 115 7.352 7.814 -0.462 2 1 1337 . 1 1 A 115 115 LYS HA H 115 4.189 4.449 -0.260 2 1 1346 . 1 1 A 115 115 LYS CA C 115 59.689 57.241 2.448 2 1 1347 . 1 1 A 115 115 LYS CB C 115 33.428 40.676 -7.248 2 1 1351 . 1 1 A 115 115 LYS N N 115 121.599 121.969 -0.370 2 1 1352 . 1 1 A 116 116 LEU H H 116 8.046 7.989 0.057 2 1 1353 . 1 1 A 116 116 LEU HA H 116 4.153 3.843 0.310 2 1 1363 . 1 1 A 116 116 LEU CA C 116 57.698 65.061 -7.363 2 1 1364 . 1 1 A 116 116 LEU CB C 116 42.070 31.555 10.515 2 1 1366 . 1 1 A 116 116 LEU N N 116 118.827 118.099 0.728 2 1 1367 . 1 1 A 117 117 SER H H 117 8.321 7.528 0.793 2 1 1368 . 1 1 A 117 117 SER HA H 117 4.334 4.204 0.130 2 1 1371 . 1 1 A 117 117 SER CA C 117 61.467 54.248 7.219 2 1 1372 . 1 1 A 117 117 SER CB C 117 63.613 41.923 21.690 2 1 1373 . 1 1 A 117 117 SER N N 117 114.829 116.827 -1.998 2 1 1374 . 1 1 A 118 118 ARG H H 118 7.001 7.783 -0.782 2 1 1375 . 1 1 A 118 118 ARG HA H 118 4.403 3.873 0.530 2 1 1382 . 1 1 A 118 118 ARG CA C 118 56.734 57.004 -0.270 2 1 1383 . 1 1 A 118 118 ARG CB C 118 31.115 27.266 3.849 2 1 1385 . 1 1 A 118 118 ARG N N 118 118.114 114.220 3.894 2 1 1386 . 1 1 A 119 119 LEU H H 119 7.365 8.270 -0.905 2 1 1387 . 1 1 A 119 119 LEU HA H 119 4.253 4.882 -0.629 2 1 1397 . 1 1 A 119 119 LEU CA C 119 54.639 57.766 -3.127 2 1 1398 . 1 1 A 119 119 LEU CB C 119 41.700 31.439 10.261 2 1 1401 . 1 1 A 119 119 LEU N N 119 119.181 117.385 1.796 2 1 1402 . 1 1 A 120 120 ARG H H 120 8.766 8.710 0.056 2 1 1403 . 1 1 A 120 120 ARG HA H 120 4.374 4.472 -0.098 2 1 1410 . 1 1 A 120 120 ARG CA C 120 56.426 59.250 -2.824 2 1 1411 . 1 1 A 120 120 ARG CB C 120 32.414 63.773 -31.359 2 1 1414 . 1 1 A 120 120 ARG N N 120 122.099 120.355 1.744 2 1 1415 . 1 1 A 121 121 LEU H H 121 8.312 8.780 -0.468 2 1 1416 . 1 1 A 121 121 LEU HA H 121 4.407 3.624 0.783 2 1 1426 . 1 1 A 121 121 LEU CA C 121 56.028 66.447 -10.418 2 1 1427 . 1 1 A 121 121 LEU CB C 121 43.122 31.820 11.302 2 1 1430 . 1 1 A 121 121 LEU N N 121 118.761 123.740 -4.979 2 1 1431 . 1 1 A 122 122 PHE H H 122 7.143 8.348 -1.205 2 1 1432 . 1 1 A 122 122 PHE HA H 122 5.201 4.112 1.089 2 1 1439 . 1 1 A 122 122 PHE CA C 122 53.047 59.156 -6.109 2 1 1440 . 1 1 A 122 122 PHE CB C 122 40.844 29.417 11.427 2 1 1441 . 1 1 A 122 122 PHE N N 122 112.750 120.380 -7.630 2 1 1442 . 1 1 A 123 123 PRO HA H 123 3.908 3.982 -0.074 2 1 1449 . 1 1 A 123 123 PRO CA C 123 65.478 59.196 6.282 2 1 1450 . 1 1 A 123 123 PRO CB C 123 33.248 29.321 3.927 2 1 1452 . 1 1 A 124 124 LEU H H 124 7.208 8.044 -0.836 2 1 1453 . 1 1 A 124 124 LEU HA H 124 4.673 4.074 0.599 2 1 1463 . 1 1 A 124 124 LEU CA C 124 53.307 57.679 -4.372 2 1 1464 . 1 1 A 124 124 LEU CB C 124 42.853 41.738 1.115 2 1 1468 . 1 1 A 124 124 LEU N N 124 113.875 121.373 -7.498 2 1 1469 . 1 1 A 125 125 SER H H 125 8.990 8.132 0.858 2 1 1470 . 1 1 A 125 125 SER HA H 125 4.533 3.976 0.557 2 1 1473 . 1 1 A 125 125 SER CA C 125 59.198 59.615 -0.417 2 1 1474 . 1 1 A 125 125 SER CB C 125 64.578 29.368 35.210 2 1 1475 . 1 1 A 125 125 SER N N 125 117.894 119.736 -1.842 2 1 1476 . 1 1 A 126 126 SER H H 126 8.618 7.771 0.847 2 1 1477 . 1 1 A 126 126 SER HA H 126 4.614 3.993 0.621 2 1 1480 . 1 1 A 126 126 SER CA C 126 58.730 59.783 -1.053 2 1 1481 . 1 1 A 126 126 SER CB C 126 64.367 32.336 32.031 2 1 1482 . 1 1 A 126 126 SER N N 126 118.602 119.166 -0.564 2 1 1483 . 1 1 A 127 127 SER HA H 127 4.530 3.778 0.752 2 1 1486 . 1 1 A 127 127 SER CA C 127 58.954 65.714 -6.760 2 1 1487 . 1 1 A 127 127 SER CB C 127 64.379 31.517 32.862 2 1 1488 . 1 1 A 128 128 ALA H H 128 8.345 8.264 0.081 2 1 1489 . 1 1 A 128 128 ALA HA H 128 4.432 3.958 0.474 2 1 1493 . 1 1 A 128 128 ALA CA C 128 52.963 59.137 -6.174 2 1 1494 . 1 1 A 128 128 ALA CB C 128 19.924 29.785 -9.861 2 1 1495 . 1 1 A 128 128 ALA N N 128 126.185 121.786 4.399 2 1 1496 . 1 1 A 129 129 GLU H H 129 8.329 7.910 0.419 2 1 1497 . 1 1 A 129 129 GLU HA H 129 4.353 4.074 0.279 2 1 1502 . 1 1 A 129 129 GLU CA C 129 57.111 58.643 -1.532 2 1 1503 . 1 1 A 129 129 GLU CB C 129 30.949 28.571 2.378 2 1 1504 . 1 1 A 129 129 GLU N N 129 120.842 118.622 2.220 2 1 1505 . 1 1 A 130 130 LYS H H 130 7.947 8.006 -0.059 2 1 1506 . 1 1 A 130 130 LYS HA H 130 3.835 4.037 -0.203 2 1 1515 . 1 1 A 130 130 LYS CA C 130 57.756 59.691 -1.935 2 1 1516 . 1 1 A 130 130 LYS CB C 130 33.156 32.102 1.054 2 stop_ save_