REMARK SPARTA+ Protein Chemical Shift Prediction Table REMARK REMARK All chemical shifts are reported in ppm: REMARK REMARK SS_SHIFT is the predicted secondary chemical shift. REMARK SHIFT is the predicted chemical shift. REMARK RC_SHIFT is the random coil chemical shift. REMARK HM_SHIFT is the ring current shift; a correction REMARK of 0.6 times this value is applied. REMARK EF_SHIFT is the adjustment for electric field effect, REMARK applied to proton shifts only. REMARK SIGMA is the estimated prediction error. REMARK REMARK Reference: REMARK Y. Shen and A. Bax: SPARTA+: a modest improvement in empirical NMR REMARK chemical shift prediction by means of an artificial neural network. REMARK J. Biomol. NMR 48, 13-22 (2010). DATA SOURCE 3jv3_1_B DATA FIRST_RESID 1204 DATA SEQUENCE LTTDMDPSQQ WCSDLHLLDM LTPTERKRQG YIHELIVTEE NYVNDLQLVT DATA SEQUENCE EIFQKPLTES ELLTEKEVAM IFVNWKELIM CNIKLLKALR VRKKMSGEKM DATA SEQUENCE PVKMIGDILS AQLPHMQPYI RFCSCQLNGA ALIQQKTDEA PDFKEFVKRL DATA SEQUENCE AMDPRCKGMP LSSFILKPMQ RVTRYPLIIK NILENTPENH PDHSHLKHAL DATA SEQUENCE EKAEELCSQV NEGVREKENS DRLE VARS RESID RESNAME ATOMNAME SS_SHIFT SHIFT RC_SHIFT HM_SHIFT EF_SHIFT SIGMA FORMAT %4d %4s %4s %9.3f %9.3f %9.3f %9.3f %9.3f %9.3f 1204 L HA 0.000 nan 4.340 nan 0.000 0.249 1204 L C 0.000 176.878 176.870 0.014 0.000 1.165 1204 L CA 0.000 54.847 54.840 0.012 0.000 0.813 1204 L CB 0.000 42.068 42.059 0.015 0.000 0.961 1205 T N -4.632 109.933 114.554 0.019 0.000 2.942 1205 T HA -0.101 4.248 4.350 -0.001 0.000 0.265 1205 T C 1.492 176.218 174.700 0.043 0.000 1.062 1205 T CA 1.241 63.355 62.100 0.024 0.000 1.139 1205 T CB -0.337 68.547 68.868 0.027 0.000 0.883 1205 T HN 0.756 nan 8.240 nan 0.000 0.468 1206 T N -0.005 114.577 114.554 0.047 0.000 3.051 1206 T HA -0.017 4.333 4.350 -0.001 0.000 0.269 1206 T C 0.613 175.348 174.700 0.058 0.000 1.127 1206 T CA 0.989 63.127 62.100 0.062 0.000 1.107 1206 T CB -0.488 68.411 68.868 0.052 0.000 0.898 1206 T HN 0.332 nan 8.240 nan 0.000 0.517 1207 D N 0.161 120.585 120.400 0.039 0.000 2.525 1207 D HA 0.427 5.066 4.640 -0.001 0.000 0.229 1207 D C -0.309 176.004 176.300 0.022 0.000 1.202 1207 D CA -0.197 53.822 54.000 0.031 0.000 0.828 1207 D CB 0.166 40.978 40.800 0.022 0.000 1.008 1207 D HN 0.294 nan 8.370 nan 0.000 0.493 1208 M N 0.632 120.248 119.600 0.027 0.000 2.528 1208 M HA 0.259 4.738 4.480 -0.001 0.000 0.318 1208 M C -0.859 175.445 176.300 0.007 0.000 1.195 1208 M CA -0.778 54.528 55.300 0.009 0.000 1.000 1208 M CB 1.515 34.118 32.600 0.004 0.000 1.615 1208 M HN -0.218 nan 8.290 nan 0.000 0.469 1209 D N 3.780 124.171 120.400 -0.015 0.000 2.359 1209 D HA 0.326 4.966 4.640 -0.001 0.000 0.230 1209 D C -1.809 174.462 176.300 -0.049 0.000 1.118 1209 D CA -1.936 52.044 54.000 -0.033 0.000 0.844 1209 D CB 1.151 41.932 40.800 -0.031 0.000 1.059 1209 D HN 0.241 nan 8.370 nan 0.000 0.493 1210 P HA -0.312 nan 4.420 nan 0.000 0.222 1210 P C 1.171 178.508 177.300 0.061 0.000 1.154 1210 P CA 1.462 64.533 63.100 -0.049 0.000 0.874 1210 P CB -0.067 31.292 31.700 -0.569 0.000 0.787 1211 S N -1.402 114.283 115.700 -0.025 0.000 2.423 1211 S HA -0.145 4.324 4.470 -0.001 0.000 0.231 1211 S C 2.144 176.731 174.600 -0.021 0.000 1.014 1211 S CA 0.863 59.066 58.200 0.006 0.000 0.965 1211 S CB -0.874 62.311 63.200 -0.024 0.000 0.785 1211 S HN 0.028 nan 8.310 nan 0.000 0.495 1212 Q N 1.338 121.111 119.800 -0.044 0.000 2.297 1212 Q HA 0.087 4.426 4.340 -0.001 0.000 0.204 1212 Q C 2.071 178.000 176.000 -0.118 0.000 0.962 1212 Q CA 1.448 57.210 55.803 -0.068 0.000 0.879 1212 Q CB -0.326 28.376 28.738 -0.059 0.000 0.947 1212 Q HN 0.848 nan 8.270 nan 0.000 0.462 1213 Q N -2.203 117.495 119.800 -0.170 0.000 2.349 1213 Q HA -0.023 4.316 4.340 -0.001 0.000 0.209 1213 Q C 0.759 176.426 176.000 -0.555 0.000 0.920 1213 Q CA 0.551 56.113 55.803 -0.402 0.000 0.901 1213 Q CB 0.117 28.532 28.738 -0.540 0.000 1.021 1213 Q HN 0.444 nan 8.270 nan 0.000 0.519 1214 W N -0.710 120.578 121.300 -0.021 0.000 2.993 1214 W HA 0.199 4.858 4.660 -0.001 0.000 0.290 1214 W C 0.593 177.091 176.519 -0.035 0.000 1.203 1214 W CA -0.329 57.022 57.345 0.010 0.000 1.582 1214 W CB 0.973 30.473 29.460 0.067 0.000 1.033 1214 W HN 0.258 nan 8.180 nan 0.000 0.594 1215 C N -1.161 118.170 119.300 0.052 0.000 2.971 1215 C HA 0.375 4.834 4.460 -0.001 0.000 0.239 1215 C C 1.635 176.551 174.990 -0.124 0.000 1.647 1215 C CA -0.472 58.464 59.018 -0.137 0.000 1.088 1215 C CB -0.894 26.548 27.740 -0.497 0.000 1.982 1215 C HN 0.180 nan 8.230 nan 0.000 0.643 1216 S N 0.180 115.832 115.700 -0.081 0.000 2.423 1216 S HA -0.167 4.302 4.470 -0.001 0.000 0.231 1216 S C 1.038 175.601 174.600 -0.061 0.000 1.014 1216 S CA 1.652 59.812 58.200 -0.066 0.000 0.965 1216 S CB -0.417 62.747 63.200 -0.060 0.000 0.785 1216 S HN 0.835 nan 8.310 nan 0.000 0.495 1217 D N 0.943 121.299 120.400 -0.074 0.000 2.400 1217 D HA 0.171 4.811 4.640 -0.001 0.000 0.243 1217 D C -0.053 176.184 176.300 -0.106 0.000 1.184 1217 D CA -0.421 53.539 54.000 -0.066 0.000 0.853 1217 D CB -0.473 40.288 40.800 -0.066 0.000 0.944 1217 D HN 0.268 nan 8.370 nan 0.000 0.501 1218 L N 1.211 122.372 121.223 -0.103 0.000 2.326 1218 L HA 0.223 4.562 4.340 -0.001 0.000 0.278 1218 L C 0.079 176.952 176.870 0.006 0.000 1.092 1218 L CA -0.610 54.159 54.840 -0.117 0.000 0.810 1218 L CB 0.672 42.653 42.059 -0.129 0.000 1.153 1218 L HN 0.124 nan 8.230 nan 0.000 0.439 1219 H N 5.783 124.842 119.070 -0.020 0.000 3.004 1219 H HA 0.178 4.733 4.556 -0.001 0.000 0.316 1219 H C 0.513 175.839 175.328 -0.003 0.000 1.014 1219 H CA -0.078 55.966 56.048 -0.007 0.000 1.454 1219 H CB 0.331 30.093 29.762 0.001 0.000 1.472 1219 H HN 0.650 nan 8.280 nan 0.000 0.571 1220 L N 2.227 123.520 121.223 0.118 0.000 4.496 1220 L HA -0.313 4.026 4.340 -0.001 0.000 0.419 1220 L C 1.569 178.467 176.870 0.045 0.000 1.139 1220 L CA -0.251 54.624 54.840 0.058 0.000 0.975 1220 L CB -1.419 40.672 42.059 0.052 0.000 2.099 1220 L HN 0.516 nan 8.230 nan 0.000 0.818 1221 L N 1.743 122.992 121.223 0.042 0.000 2.051 1221 L HA -0.224 4.115 4.340 -0.001 0.000 0.214 1221 L C 2.432 179.312 176.870 0.017 0.000 1.076 1221 L CA 2.791 57.643 54.840 0.021 0.000 0.758 1221 L CB -0.429 41.631 42.059 0.002 0.000 0.890 1221 L HN 0.543 nan 8.230 nan 0.000 0.433 1222 D N -1.237 119.172 120.400 0.015 0.000 2.263 1222 D HA -0.260 4.379 4.640 -0.001 0.000 0.208 1222 D C 1.917 178.225 176.300 0.012 0.000 0.971 1222 D CA 1.418 55.425 54.000 0.010 0.000 0.867 1222 D CB -0.398 40.407 40.800 0.008 0.000 0.929 1222 D HN 0.490 nan 8.370 nan 0.000 0.492 1223 M N 0.135 119.745 119.600 0.016 0.000 2.495 1223 M HA 0.174 4.653 4.480 -0.001 0.000 0.237 1223 M C 0.612 176.924 176.300 0.020 0.000 1.131 1223 M CA 0.059 55.369 55.300 0.016 0.000 1.032 1223 M CB 0.440 33.049 32.600 0.015 0.000 1.513 1223 M HN -0.110 nan 8.290 nan 0.000 0.488 1224 L N 0.442 121.680 121.223 0.024 0.000 2.439 1224 L HA 0.218 4.557 4.340 -0.001 0.000 0.261 1224 L C 1.204 178.090 176.870 0.028 0.000 1.153 1224 L CA -0.561 54.298 54.840 0.031 0.000 0.808 1224 L CB 0.525 42.607 42.059 0.038 0.000 1.126 1224 L HN 0.165 nan 8.230 nan 0.000 0.460 1225 T N -1.398 113.176 114.554 0.033 0.000 2.795 1225 T HA 0.095 4.444 4.350 -0.001 0.000 0.314 1225 T C -1.824 172.894 174.700 0.029 0.000 1.069 1225 T CA -1.043 61.076 62.100 0.031 0.000 1.071 1225 T CB 0.994 69.886 68.868 0.039 0.000 0.988 1225 T HN 0.382 nan 8.240 nan 0.000 0.543 1226 P HA -0.068 nan 4.420 nan 0.000 0.215 1226 P C 1.976 179.293 177.300 0.028 0.000 1.157 1226 P CA 1.880 64.993 63.100 0.022 0.000 0.863 1226 P CB -0.339 31.374 31.700 0.021 0.000 0.787 1227 T N -1.237 113.341 114.554 0.039 0.000 2.720 1227 T HA -0.227 4.122 4.350 -0.001 0.000 0.268 1227 T C 1.890 176.622 174.700 0.053 0.000 1.037 1227 T CA 1.731 63.861 62.100 0.050 0.000 1.144 1227 T CB -0.997 67.906 68.868 0.058 0.000 0.864 1227 T HN -0.021 nan 8.240 nan 0.000 0.444 1228 E N 0.595 120.829 120.200 0.057 0.000 2.338 1228 E HA -0.009 4.340 4.350 -0.001 0.000 0.197 1228 E C 2.378 179.007 176.600 0.048 0.000 1.007 1228 E CA 0.765 57.205 56.400 0.066 0.000 0.849 1228 E CB -0.311 29.439 29.700 0.082 0.000 0.774 1228 E HN 0.563 nan 8.360 nan 0.000 0.506 1229 R N -0.197 120.320 120.500 0.028 0.000 2.075 1229 R HA 0.007 4.346 4.340 -0.001 0.000 0.226 1229 R C 2.051 178.336 176.300 -0.025 0.000 1.114 1229 R CA 1.330 57.436 56.100 0.009 0.000 0.972 1229 R CB 0.041 30.341 30.300 0.000 0.000 0.869 1229 R HN 0.074 nan 8.270 nan 0.000 0.437 1230 K N 0.038 120.412 120.400 -0.044 0.000 2.057 1230 K HA -0.161 4.158 4.320 -0.001 0.000 0.207 1230 K C 2.113 178.623 176.600 -0.149 0.000 1.049 1230 K CA 1.264 57.457 56.287 -0.157 0.000 0.931 1230 K CB -0.170 32.296 32.500 -0.057 0.000 0.714 1230 K HN 0.038 nan 8.250 nan 0.000 0.440 1231 R N 0.907 121.423 120.500 0.027 0.000 2.105 1231 R HA -0.183 4.156 4.340 -0.001 0.000 0.239 1231 R C 2.042 178.384 176.300 0.070 0.000 1.135 1231 R CA 1.458 57.612 56.100 0.091 0.000 0.967 1231 R CB 0.077 30.411 30.300 0.057 0.000 0.861 1231 R HN 0.186 nan 8.270 nan 0.000 0.442 1232 Q N -0.732 119.109 119.800 0.067 0.000 2.172 1232 Q HA -0.022 4.318 4.340 -0.001 0.000 0.200 1232 Q C 2.044 178.182 176.000 0.230 0.000 0.964 1232 Q CA 1.435 57.336 55.803 0.165 0.000 0.855 1232 Q CB -0.252 28.574 28.738 0.147 0.000 0.918 1232 Q HN 0.543 nan 8.270 nan 0.000 0.444 1233 G N -0.201 108.623 108.800 0.040 0.000 2.459 1233 G HA2 -0.256 3.703 3.960 -0.001 0.000 0.217 1233 G HA3 -0.256 3.703 3.960 -0.001 0.000 0.217 1233 G C 1.199 176.100 174.900 0.003 0.000 1.183 1233 G CA 0.581 45.699 45.100 0.030 0.000 0.776 1233 G HN 0.388 nan 8.290 nan 0.000 0.552 1234 Y N 0.219 120.535 120.300 0.026 0.000 2.421 1234 Y HA 0.103 4.653 4.550 -0.001 0.000 0.292 1234 Y C 2.651 178.444 175.900 -0.178 0.000 1.136 1234 Y CA -0.060 57.967 58.100 -0.120 0.000 1.255 1234 Y CB -0.022 38.390 38.460 -0.080 0.000 0.991 1234 Y HN 0.141 nan 8.280 nan 0.000 0.552 1235 I N -0.764 119.814 120.570 0.014 0.000 2.333 1235 I HA -0.269 3.900 4.170 -0.001 0.000 0.246 1235 I C 2.069 178.018 176.117 -0.280 0.000 1.106 1235 I CA 1.054 62.266 61.300 -0.147 0.000 1.411 1235 I CB -0.341 37.543 38.000 -0.193 0.000 1.082 1235 I HN 0.374 nan 8.210 nan 0.000 0.420 1236 H N 0.088 119.127 119.070 -0.052 0.000 2.495 1236 H HA -0.114 4.442 4.556 -0.001 0.000 0.287 1236 H C 1.933 177.150 175.328 -0.185 0.000 1.033 1236 H CA 1.019 57.055 56.048 -0.020 0.000 1.307 1236 H CB 0.106 29.933 29.762 0.108 0.000 1.401 1236 H HN 0.475 nan 8.280 nan 0.000 0.555 1237 E N 1.007 120.903 120.200 -0.506 0.000 2.047 1237 E HA -0.133 4.216 4.350 -0.001 0.000 0.191 1237 E C 2.265 178.469 176.600 -0.659 0.000 0.987 1237 E CA 0.314 55.893 56.400 -1.369 0.000 0.799 1237 E CB 0.092 28.897 29.700 -1.492 0.000 0.752 1237 E HN 0.166 nan 8.360 nan 0.000 0.449 1238 L N 1.532 122.535 121.223 -0.367 0.000 1.955 1238 L HA -0.218 4.121 4.340 -0.001 0.000 0.213 1238 L C 2.360 179.145 176.870 -0.142 0.000 1.072 1238 L CA 1.812 56.531 54.840 -0.201 0.000 0.755 1238 L CB -1.028 40.939 42.059 -0.153 0.000 0.888 1238 L HN 0.343 nan 8.230 nan 0.000 0.432 1239 I N -0.841 119.644 120.570 -0.142 0.000 2.151 1239 I HA -0.326 3.843 4.170 -0.001 0.000 0.243 1239 I C 2.538 178.658 176.117 0.004 0.000 1.080 1239 I CA 1.310 62.567 61.300 -0.071 0.000 1.339 1239 I CB -0.353 37.584 38.000 -0.104 0.000 1.039 1239 I HN 0.124 nan 8.210 nan 0.000 0.409 1240 V N 0.803 120.735 119.914 0.029 0.000 2.270 1240 V HA -0.285 3.834 4.120 -0.001 0.000 0.245 1240 V C 2.675 178.842 176.094 0.122 0.000 1.043 1240 V CA 2.545 64.930 62.300 0.141 0.000 1.014 1240 V CB -1.170 30.865 31.823 0.353 0.000 0.645 1240 V HN 0.645 nan 8.190 nan 0.000 0.447 1241 T N -1.729 112.843 114.554 0.031 0.000 2.977 1241 T HA -0.212 4.137 4.350 -0.001 0.000 0.271 1241 T C 1.616 176.373 174.700 0.094 0.000 1.105 1241 T CA 1.700 63.836 62.100 0.061 0.000 1.116 1241 T CB -0.212 68.625 68.868 -0.052 0.000 0.878 1241 T HN 0.458 nan 8.240 nan 0.000 0.509 1242 E N 1.164 121.410 120.200 0.077 0.000 2.122 1242 E HA -0.036 4.313 4.350 -0.001 0.000 0.190 1242 E C 2.326 179.023 176.600 0.161 0.000 0.977 1242 E CA 0.713 57.191 56.400 0.130 0.000 0.820 1242 E CB -0.199 29.552 29.700 0.084 0.000 0.770 1242 E HN 0.459 nan 8.360 nan 0.000 0.462 1243 E N 0.509 120.782 120.200 0.122 0.000 2.077 1243 E HA -0.162 4.187 4.350 -0.001 0.000 0.193 1243 E C 1.828 178.506 176.600 0.130 0.000 0.989 1243 E CA 0.682 57.150 56.400 0.114 0.000 0.800 1243 E CB -0.256 29.505 29.700 0.101 0.000 0.746 1243 E HN 0.296 nan 8.360 nan 0.000 0.452 1244 N N 0.322 119.111 118.700 0.149 0.000 2.058 1244 N HA -0.170 4.569 4.740 -0.001 0.000 0.191 1244 N C 1.901 177.515 175.510 0.173 0.000 1.037 1244 N CA 0.918 54.061 53.050 0.155 0.000 0.848 1244 N CB -0.398 38.188 38.487 0.166 0.000 1.021 1244 N HN 0.178 nan 8.380 nan 0.000 0.422 1245 Y N 2.041 122.383 120.300 0.069 0.000 2.070 1245 Y HA -0.204 4.345 4.550 -0.001 0.000 0.280 1245 Y C 2.442 178.387 175.900 0.074 0.000 1.148 1245 Y CA 1.478 59.614 58.100 0.060 0.000 1.125 1245 Y CB -0.698 37.777 38.460 0.025 0.000 0.975 1245 Y HN -0.194 nan 8.280 nan 0.000 0.492 1246 V N 1.409 121.412 119.914 0.148 0.000 2.453 1246 V HA -0.362 3.757 4.120 -0.001 0.000 0.252 1246 V C 2.364 178.457 176.094 -0.002 0.000 1.068 1246 V CA 2.177 64.498 62.300 0.035 0.000 1.070 1246 V CB -0.785 31.104 31.823 0.111 0.000 0.664 1246 V HN 0.537 nan 8.190 nan 0.000 0.461 1247 N N 0.133 118.861 118.700 0.046 0.000 2.084 1247 N HA -0.164 4.575 4.740 -0.001 0.000 0.190 1247 N C 1.534 177.087 175.510 0.072 0.000 1.030 1247 N CA 1.807 54.895 53.050 0.062 0.000 0.849 1247 N CB -0.191 38.347 38.487 0.085 0.000 1.012 1247 N HN 0.508 nan 8.380 nan 0.000 0.423 1248 D N 1.122 121.567 120.400 0.075 0.000 2.144 1248 D HA -0.090 4.549 4.640 -0.001 0.000 0.199 1248 D C 2.176 178.576 176.300 0.167 0.000 0.984 1248 D CA 0.395 54.498 54.000 0.172 0.000 0.834 1248 D CB -0.396 40.531 40.800 0.213 0.000 0.955 1248 D HN 0.281 nan 8.370 nan 0.000 0.465 1249 L N 0.370 121.582 121.223 -0.019 0.000 2.079 1249 L HA -0.213 4.126 4.340 -0.001 0.000 0.210 1249 L C 2.429 179.470 176.870 0.285 0.000 1.081 1249 L CA 1.259 56.150 54.840 0.084 0.000 0.752 1249 L CB -0.354 41.510 42.059 -0.324 0.000 0.896 1249 L HN 0.035 nan 8.230 nan 0.000 0.433 1250 Q N -0.813 119.065 119.800 0.129 0.000 2.187 1250 Q HA -0.150 4.189 4.340 -0.001 0.000 0.199 1250 Q C 2.157 178.207 176.000 0.084 0.000 0.957 1250 Q CA 0.666 56.535 55.803 0.110 0.000 0.857 1250 Q CB 0.034 28.808 28.738 0.060 0.000 0.929 1250 Q HN 0.305 nan 8.270 nan 0.000 0.453 1251 L N 0.009 121.281 121.223 0.081 0.000 2.017 1251 L HA -0.159 4.180 4.340 -0.001 0.000 0.208 1251 L C 2.069 178.934 176.870 -0.008 0.000 1.073 1251 L CA 1.465 56.321 54.840 0.027 0.000 0.745 1251 L CB -0.509 41.577 42.059 0.045 0.000 0.894 1251 L HN -0.002 nan 8.230 nan 0.000 0.432 1252 V N -0.876 119.042 119.914 0.007 0.000 2.332 1252 V HA -0.325 3.795 4.120 -0.001 0.000 0.248 1252 V C 2.446 178.474 176.094 -0.110 0.000 1.055 1252 V CA 2.281 64.525 62.300 -0.093 0.000 1.038 1252 V CB -0.865 30.814 31.823 -0.240 0.000 0.651 1252 V HN 0.545 nan 8.190 nan 0.000 0.450 1253 T N -1.105 113.397 114.554 -0.086 0.000 2.857 1253 T HA -0.152 4.197 4.350 -0.001 0.000 0.266 1253 T C 1.886 176.511 174.700 -0.124 0.000 1.048 1253 T CA 1.386 63.392 62.100 -0.158 0.000 1.139 1253 T CB -0.094 68.769 68.868 -0.009 0.000 0.874 1253 T HN 0.589 nan 8.240 nan 0.000 0.455 1254 E N 1.025 121.184 120.200 -0.069 0.000 2.107 1254 E HA -0.041 4.308 4.350 -0.001 0.000 0.191 1254 E C 1.580 178.098 176.600 -0.137 0.000 0.982 1254 E CA 0.771 57.121 56.400 -0.084 0.000 0.809 1254 E CB 0.054 29.721 29.700 -0.056 0.000 0.756 1254 E HN 0.648 nan 8.360 nan 0.000 0.459 1255 I N -3.334 117.133 120.570 -0.171 0.000 3.707 1255 I HA 0.310 4.479 4.170 -0.001 0.000 0.330 1255 I C -0.245 175.485 176.117 -0.645 0.000 1.572 1255 I CA -0.225 60.858 61.300 -0.363 0.000 1.104 1255 I CB 0.134 37.886 38.000 -0.414 0.000 1.240 1255 I HN -0.058 nan 8.210 nan 0.000 0.475 1256 F N -0.341 119.455 119.950 -0.257 0.000 1.781 1256 F HA 0.130 4.657 4.527 -0.001 0.000 0.267 1256 F C 2.051 177.662 175.800 -0.315 0.000 1.142 1256 F CA 0.060 57.927 58.000 -0.221 0.000 1.284 1256 F CB 0.002 38.917 39.000 -0.141 0.000 1.728 1256 F HN -0.071 nan 8.300 nan 0.000 0.437 1257 Q N 1.495 121.027 119.800 -0.445 0.000 1.942 1257 Q HA -0.181 4.158 4.340 -0.001 0.000 0.203 1257 Q C 1.792 177.541 176.000 -0.418 0.000 0.987 1257 Q CA 2.075 57.293 55.803 -0.975 0.000 0.844 1257 Q CB -0.026 28.020 28.738 -1.153 0.000 0.911 1257 Q HN 0.272 nan 8.270 nan 0.000 0.423 1258 K N -0.325 119.915 120.400 -0.266 0.000 2.113 1258 K HA -0.157 4.163 4.320 -0.001 0.000 0.208 1258 K C -0.746 175.812 176.600 -0.069 0.000 1.047 1258 K CA 1.662 57.866 56.287 -0.138 0.000 0.928 1258 K CB -0.832 31.606 32.500 -0.103 0.000 0.716 1258 K HN 0.272 nan 8.250 nan 0.000 0.446 1259 P HA -0.128 nan 4.420 nan 0.000 0.215 1259 P C 1.158 178.574 177.300 0.194 0.000 1.157 1259 P CA 1.111 64.241 63.100 0.051 0.000 0.863 1259 P CB 0.082 31.749 31.700 -0.054 0.000 0.787 1260 L N -1.670 119.659 121.223 0.175 0.000 2.376 1260 L HA -0.056 4.284 4.340 -0.001 0.000 0.219 1260 L C 1.716 178.681 176.870 0.159 0.000 1.133 1260 L CA 1.190 56.203 54.840 0.288 0.000 0.816 1260 L CB -1.008 41.260 42.059 0.348 0.000 0.933 1260 L HN 0.024 nan 8.230 nan 0.000 0.449 1261 T N -1.652 112.936 114.554 0.055 0.000 3.088 1261 T HA -0.045 4.305 4.350 -0.001 0.000 0.259 1261 T C 1.527 176.239 174.700 0.021 0.000 1.122 1261 T CA 0.603 62.718 62.100 0.026 0.000 1.095 1261 T CB 0.264 69.118 68.868 -0.025 0.000 0.930 1261 T HN 0.162 nan 8.240 nan 0.000 0.508 1262 E N 0.865 121.082 120.200 0.028 0.000 2.094 1262 E HA 0.129 4.478 4.350 -0.001 0.000 0.193 1262 E C 2.298 178.878 176.600 -0.032 0.000 0.950 1262 E CA 0.386 56.788 56.400 0.003 0.000 0.842 1262 E CB -0.587 29.120 29.700 0.012 0.000 0.816 1262 E HN 0.157 nan 8.360 nan 0.000 0.465 1263 S N 0.282 115.952 115.700 -0.051 0.000 2.432 1263 S HA -0.360 4.109 4.470 -0.001 0.000 0.243 1263 S C 0.718 175.209 174.600 -0.182 0.000 1.069 1263 S CA 2.077 60.113 58.200 -0.273 0.000 1.047 1263 S CB -0.216 62.750 63.200 -0.390 0.000 0.854 1263 S HN 0.358 nan 8.310 nan 0.000 0.474 1264 E N -1.464 118.699 120.200 -0.060 0.000 3.673 1264 E HA -0.186 4.163 4.350 -0.001 0.000 0.309 1264 E C 0.541 177.127 176.600 -0.024 0.000 0.819 1264 E CA 0.969 57.348 56.400 -0.036 0.000 1.111 1264 E CB -1.973 27.695 29.700 -0.054 0.000 1.561 1264 E HN 0.668 nan 8.360 nan 0.000 0.450 1265 L N -0.414 120.806 121.223 -0.005 0.000 2.599 1265 L HA 0.115 4.454 4.340 -0.001 0.000 0.230 1265 L C 0.128 177.034 176.870 0.059 0.000 1.141 1265 L CA 0.202 55.072 54.840 0.050 0.000 0.877 1265 L CB -0.219 41.928 42.059 0.146 0.000 1.009 1265 L HN 0.147 nan 8.230 nan 0.000 0.447 1266 L N -4.987 116.265 121.223 0.047 0.000 2.582 1266 L HA 0.477 4.816 4.340 -0.001 0.000 0.257 1266 L C 0.036 176.919 176.870 0.021 0.000 0.974 1266 L CA -1.021 53.823 54.840 0.007 0.000 0.851 1266 L CB 0.507 42.563 42.059 -0.005 0.000 1.424 1266 L HN -0.135 nan 8.230 nan 0.000 0.412 1267 T N -2.520 112.036 114.554 0.003 0.000 2.701 1267 T HA 0.273 4.622 4.350 -0.001 0.000 0.303 1267 T C 0.841 175.560 174.700 0.031 0.000 1.030 1267 T CA 0.276 62.382 62.100 0.011 0.000 1.010 1267 T CB 0.592 69.460 68.868 0.001 0.000 1.007 1267 T HN 0.775 nan 8.240 nan 0.000 0.532 1268 E N 0.745 120.963 120.200 0.030 0.000 2.051 1268 E HA -0.189 4.160 4.350 -0.001 0.000 0.192 1268 E C 2.211 178.842 176.600 0.051 0.000 0.991 1268 E CA 1.453 57.878 56.400 0.042 0.000 0.799 1268 E CB -0.213 29.505 29.700 0.031 0.000 0.748 1268 E HN 0.843 nan 8.360 nan 0.000 0.449 1269 K N 1.218 121.639 120.400 0.035 0.000 2.152 1269 K HA -0.189 4.130 4.320 -0.001 0.000 0.206 1269 K C 1.714 178.335 176.600 0.034 0.000 1.048 1269 K CA 1.656 57.962 56.287 0.032 0.000 0.933 1269 K CB -0.116 32.394 32.500 0.016 0.000 0.721 1269 K HN 0.106 nan 8.250 nan 0.000 0.447 1270 E N 0.847 121.064 120.200 0.030 0.000 2.158 1270 E HA -0.069 4.280 4.350 -0.001 0.000 0.191 1270 E C 2.037 178.684 176.600 0.078 0.000 0.982 1270 E CA 0.653 57.066 56.400 0.021 0.000 0.823 1270 E CB 0.128 29.817 29.700 -0.017 0.000 0.766 1270 E HN 0.112 nan 8.360 nan 0.000 0.468 1271 V N 1.344 121.334 119.914 0.127 0.000 2.244 1271 V HA -0.256 3.863 4.120 -0.001 0.000 0.244 1271 V C 2.329 178.580 176.094 0.262 0.000 1.042 1271 V CA 1.930 64.375 62.300 0.242 0.000 1.006 1271 V CB -0.589 31.347 31.823 0.188 0.000 0.641 1271 V HN 0.321 nan 8.190 nan 0.000 0.446 1272 A N -0.961 121.961 122.820 0.169 0.000 1.986 1272 A HA -0.300 4.019 4.320 -0.001 0.000 0.220 1272 A C 2.180 179.838 177.584 0.123 0.000 1.171 1272 A CA 2.477 54.606 52.037 0.154 0.000 0.640 1272 A CB -0.543 18.517 19.000 0.100 0.000 0.811 1272 A HN 0.547 nan 8.150 nan 0.000 0.451 1273 M N -1.109 118.536 119.600 0.074 0.000 2.288 1273 M HA 0.039 4.518 4.480 -0.001 0.000 0.266 1273 M C 1.865 178.153 176.300 -0.021 0.000 1.072 1273 M CA 1.083 56.394 55.300 0.018 0.000 1.132 1273 M CB -0.205 32.392 32.600 -0.006 0.000 1.386 1273 M HN 0.421 nan 8.290 nan 0.000 0.432 1274 I N -1.342 119.215 120.570 -0.021 0.000 2.296 1274 I HA -0.159 4.010 4.170 -0.001 0.000 0.242 1274 I C 1.548 177.480 176.117 -0.308 0.000 1.087 1274 I CA 1.272 62.450 61.300 -0.204 0.000 1.393 1274 I CB -0.199 37.627 38.000 -0.290 0.000 1.093 1274 I HN 0.145 nan 8.210 nan 0.000 0.421 1275 F N 0.246 120.263 119.950 0.111 0.000 2.698 1275 F HA 0.091 4.617 4.527 -0.001 0.000 0.295 1275 F C 1.496 177.527 175.800 0.385 0.000 1.124 1275 F CA -0.017 58.113 58.000 0.216 0.000 1.426 1275 F CB -0.378 38.663 39.000 0.068 0.000 1.120 1275 F HN -0.212 nan 8.300 nan 0.000 0.583 1276 V N 0.189 120.315 119.914 0.353 0.000 0.690 1276 V HA -0.463 3.656 4.120 -0.001 0.000 0.092 1276 V C 1.028 177.339 176.094 0.362 0.000 0.775 1276 V CA 1.364 63.834 62.300 0.285 0.000 3.098 1276 V CB -1.337 30.604 31.823 0.196 0.000 0.186 1276 V HN 0.601 nan 8.190 nan 0.000 0.077 1277 N N 0.588 119.509 118.700 0.369 0.000 2.484 1277 N HA -0.052 4.687 4.740 -0.001 0.000 0.245 1277 N C 1.031 176.696 175.510 0.259 0.000 1.184 1277 N CA 0.399 53.612 53.050 0.271 0.000 0.884 1277 N CB -0.351 38.237 38.487 0.169 0.000 1.182 1277 N HN 0.911 nan 8.380 nan 0.000 0.493 1278 W N 1.889 123.279 121.300 0.151 0.000 2.350 1278 W HA -0.166 4.493 4.660 -0.001 0.000 0.289 1278 W C 1.506 177.989 176.519 -0.059 0.000 1.215 1278 W CA 1.331 58.654 57.345 -0.037 0.000 1.236 1278 W CB 0.096 29.623 29.460 0.112 0.000 1.130 1278 W HN 0.345 nan 8.180 nan 0.000 0.541 1279 K N 0.781 121.332 120.400 0.253 0.000 2.097 1279 K HA -0.215 4.104 4.320 -0.001 0.000 0.206 1279 K C 1.864 178.480 176.600 0.026 0.000 1.049 1279 K CA 1.768 58.136 56.287 0.136 0.000 0.933 1279 K CB -0.410 32.157 32.500 0.112 0.000 0.717 1279 K HN 0.112 nan 8.250 nan 0.000 0.442 1280 E N 0.659 120.863 120.200 0.007 0.000 2.072 1280 E HA -0.158 4.191 4.350 -0.001 0.000 0.191 1280 E C 2.105 178.645 176.600 -0.100 0.000 0.985 1280 E CA 1.171 57.556 56.400 -0.026 0.000 0.801 1280 E CB -0.052 29.647 29.700 -0.002 0.000 0.750 1280 E HN 0.343 nan 8.360 nan 0.000 0.452 1281 L N 0.660 121.728 121.223 -0.260 0.000 2.042 1281 L HA -0.218 4.122 4.340 -0.001 0.000 0.210 1281 L C 2.521 179.277 176.870 -0.191 0.000 1.076 1281 L CA 1.000 55.605 54.840 -0.391 0.000 0.749 1281 L CB -0.525 41.024 42.059 -0.851 0.000 0.893 1281 L HN 0.175 nan 8.230 nan 0.000 0.432 1282 I N -0.432 120.011 120.570 -0.211 0.000 2.163 1282 I HA -0.357 3.812 4.170 -0.001 0.000 0.243 1282 I C 2.710 178.816 176.117 -0.017 0.000 1.085 1282 I CA 1.649 62.892 61.300 -0.095 0.000 1.347 1282 I CB -0.172 37.806 38.000 -0.037 0.000 1.044 1282 I HN 0.281 nan 8.210 nan 0.000 0.408 1283 M N 0.110 119.702 119.600 -0.013 0.000 2.086 1283 M HA -0.239 4.240 4.480 -0.001 0.000 0.261 1283 M C 2.763 179.073 176.300 0.016 0.000 1.067 1283 M CA 2.043 57.345 55.300 0.003 0.000 1.116 1283 M CB -0.703 31.897 32.600 -0.001 0.000 1.348 1283 M HN 0.582 nan 8.290 nan 0.000 0.407 1284 C N -0.266 119.057 119.300 0.039 0.000 2.435 1284 C HA -0.005 4.454 4.460 -0.001 0.000 0.279 1284 C C 2.190 177.240 174.990 0.101 0.000 1.321 1284 C CA 0.473 59.536 59.018 0.076 0.000 1.752 1284 C CB -1.555 26.268 27.740 0.138 0.000 1.959 1284 C HN 0.515 nan 8.230 nan 0.000 0.500 1285 N N 1.190 119.971 118.700 0.134 0.000 2.409 1285 N HA 0.094 4.833 4.740 -0.001 0.000 0.179 1285 N C 1.714 177.287 175.510 0.104 0.000 1.032 1285 N CA 1.160 54.308 53.050 0.163 0.000 0.898 1285 N CB -0.166 38.495 38.487 0.290 0.000 0.971 1285 N HN 0.624 nan 8.380 nan 0.000 0.441 1286 I N 1.340 121.951 120.570 0.068 0.000 2.286 1286 I HA -0.221 3.948 4.170 -0.001 0.000 0.245 1286 I C 2.516 178.651 176.117 0.030 0.000 1.104 1286 I CA 0.944 62.271 61.300 0.046 0.000 1.397 1286 I CB -0.068 37.949 38.000 0.029 0.000 1.072 1286 I HN 0.034 nan 8.210 nan 0.000 0.417 1287 K N 0.915 121.326 120.400 0.019 0.000 2.074 1287 K HA -0.226 4.093 4.320 -0.001 0.000 0.209 1287 K C 2.213 178.818 176.600 0.008 0.000 1.048 1287 K CA 1.441 57.728 56.287 0.000 0.000 0.926 1287 K CB -0.107 32.379 32.500 -0.023 0.000 0.713 1287 K HN 0.284 nan 8.250 nan 0.000 0.444 1288 L N 1.034 122.268 121.223 0.019 0.000 2.056 1288 L HA -0.177 4.162 4.340 -0.001 0.000 0.207 1288 L C 2.262 179.129 176.870 -0.006 0.000 1.078 1288 L CA 1.154 55.991 54.840 -0.005 0.000 0.749 1288 L CB -0.238 41.808 42.059 -0.022 0.000 0.901 1288 L HN 0.365 nan 8.230 nan 0.000 0.433 1289 L N -0.156 121.081 121.223 0.022 0.000 2.027 1289 L HA -0.270 4.069 4.340 -0.001 0.000 0.206 1289 L C 2.672 179.549 176.870 0.012 0.000 1.074 1289 L CA 1.499 56.355 54.840 0.025 0.000 0.745 1289 L CB -0.286 41.804 42.059 0.052 0.000 0.898 1289 L HN 0.302 nan 8.230 nan 0.000 0.433 1290 K N -0.426 119.982 120.400 0.013 0.000 2.044 1290 K HA -0.231 4.088 4.320 -0.001 0.000 0.210 1290 K C 2.022 178.621 176.600 -0.003 0.000 1.049 1290 K CA 1.707 57.998 56.287 0.006 0.000 0.927 1290 K CB -0.204 32.298 32.500 0.004 0.000 0.713 1290 K HN 0.393 nan 8.250 nan 0.000 0.443 1291 A N 1.038 123.853 122.820 -0.009 0.000 1.933 1291 A HA -0.124 4.195 4.320 -0.001 0.000 0.218 1291 A C 2.068 179.635 177.584 -0.027 0.000 1.175 1291 A CA 1.192 53.218 52.037 -0.018 0.000 0.628 1291 A CB -0.497 18.490 19.000 -0.022 0.000 0.814 1291 A HN 0.192 nan 8.150 nan 0.000 0.444 1292 L N -1.307 119.898 121.223 -0.030 0.000 2.093 1292 L HA -0.147 4.192 4.340 -0.001 0.000 0.208 1292 L C 2.837 179.691 176.870 -0.025 0.000 1.085 1292 L CA 1.244 56.059 54.840 -0.041 0.000 0.755 1292 L CB -0.423 41.607 42.059 -0.047 0.000 0.904 1292 L HN 0.347 nan 8.230 nan 0.000 0.435 1293 R N -0.710 119.786 120.500 -0.008 0.000 2.096 1293 R HA -0.119 4.220 4.340 -0.001 0.000 0.235 1293 R C 2.229 178.531 176.300 0.002 0.000 1.127 1293 R CA 1.031 57.133 56.100 0.004 0.000 0.968 1293 R CB -0.319 29.989 30.300 0.012 0.000 0.861 1293 R HN 0.175 nan 8.270 nan 0.000 0.440 1294 V N 0.671 120.583 119.914 -0.003 0.000 2.358 1294 V HA -0.209 3.910 4.120 -0.001 0.000 0.246 1294 V C 2.307 178.398 176.094 -0.005 0.000 1.047 1294 V CA 1.674 63.972 62.300 -0.003 0.000 1.035 1294 V CB -0.406 31.414 31.823 -0.006 0.000 0.658 1294 V HN 0.184 nan 8.190 nan 0.000 0.452 1295 R N 0.958 121.449 120.500 -0.015 0.000 2.120 1295 R HA -0.164 4.176 4.340 -0.001 0.000 0.234 1295 R C 2.072 178.368 176.300 -0.006 0.000 1.123 1295 R CA 1.692 57.781 56.100 -0.018 0.000 0.975 1295 R CB -0.501 29.777 30.300 -0.037 0.000 0.866 1295 R HN 0.366 nan 8.270 nan 0.000 0.446 1296 K N 0.401 120.799 120.400 -0.003 0.000 2.103 1296 K HA -0.047 4.272 4.320 -0.001 0.000 0.204 1296 K C 1.840 178.455 176.600 0.025 0.000 1.052 1296 K CA 1.558 57.854 56.287 0.016 0.000 0.945 1296 K CB -0.096 32.417 32.500 0.021 0.000 0.722 1296 K HN 0.177 nan 8.250 nan 0.000 0.443 1297 K N -0.070 120.340 120.400 0.018 0.000 2.007 1297 K HA -0.073 4.246 4.320 -0.001 0.000 0.206 1297 K C 2.015 178.627 176.600 0.020 0.000 1.047 1297 K CA 1.426 57.725 56.287 0.019 0.000 0.937 1297 K CB -0.192 32.317 32.500 0.015 0.000 0.718 1297 K HN 0.144 nan 8.250 nan 0.000 0.438 1298 M N 0.801 120.410 119.600 0.015 0.000 2.435 1298 M HA -0.104 4.375 4.480 -0.001 0.000 0.262 1298 M C 1.075 177.387 176.300 0.020 0.000 1.065 1298 M CA 1.510 56.819 55.300 0.014 0.000 1.076 1298 M CB -0.081 32.523 32.600 0.007 0.000 1.403 1298 M HN 0.076 nan 8.290 nan 0.000 0.454 1299 S N 0.067 115.783 115.700 0.025 0.000 2.478 1299 S HA 0.318 4.788 4.470 -0.001 0.000 0.222 1299 S C 0.638 175.264 174.600 0.044 0.000 1.008 1299 S CA 0.598 58.819 58.200 0.035 0.000 0.928 1299 S CB 0.128 63.353 63.200 0.041 0.000 0.781 1299 S HN 0.807 nan 8.310 nan 0.000 0.518 1300 G N 1.341 110.166 108.800 0.041 0.000 2.742 1300 G HA2 -0.080 3.879 3.960 -0.001 0.000 0.686 1300 G HA3 -0.080 3.879 3.960 -0.001 0.000 0.686 1300 G C 0.029 174.951 174.900 0.037 0.000 1.220 1300 G CA -0.091 45.038 45.100 0.048 0.000 0.783 1300 G HN 0.125 nan 8.290 nan 0.000 0.646 1301 E N 0.606 120.824 120.200 0.029 0.000 2.223 1301 E HA -0.272 4.077 4.350 -0.001 0.000 0.249 1301 E C 1.346 177.909 176.600 -0.061 0.000 1.008 1301 E CA 2.108 58.505 56.400 -0.005 0.000 0.975 1301 E CB -0.101 29.599 29.700 -0.001 0.000 0.901 1301 E HN 0.542 nan 8.360 nan 0.000 0.537 1302 K N -0.130 120.148 120.400 -0.204 0.000 2.811 1302 K HA 0.170 4.489 4.320 -0.001 0.000 0.217 1302 K C -0.518 175.947 176.600 -0.226 0.000 1.115 1302 K CA -0.458 55.642 56.287 -0.311 0.000 1.179 1302 K CB 0.321 32.460 32.500 -0.601 0.000 0.994 1302 K HN 0.130 nan 8.250 nan 0.000 0.464 1303 M N 1.962 121.536 119.600 -0.044 0.000 2.144 1303 M HA 0.230 4.709 4.480 -0.001 0.000 0.356 1303 M C -2.466 173.880 176.300 0.076 0.000 1.217 1303 M CA -2.564 52.766 55.300 0.049 0.000 1.087 1303 M CB 0.728 33.375 32.600 0.079 0.000 1.609 1303 M HN -0.118 nan 8.290 nan 0.000 0.467 1304 P HA -0.023 nan 4.420 nan 0.000 0.261 1304 P C -1.112 176.258 177.300 0.118 0.000 1.173 1304 P CA -0.152 63.022 63.100 0.122 0.000 0.760 1304 P CB 0.048 31.805 31.700 0.096 0.000 0.783 1305 V N 2.675 122.668 119.914 0.133 0.000 2.509 1305 V HA 0.290 4.409 4.120 -0.001 0.000 0.284 1305 V C 1.085 177.224 176.094 0.075 0.000 1.047 1305 V CA -0.074 62.269 62.300 0.071 0.000 0.952 1305 V CB 1.470 33.301 31.823 0.015 0.000 0.988 1305 V HN 0.488 nan 8.190 nan 0.000 0.469 1306 K N 3.506 123.952 120.400 0.076 0.000 2.078 1306 K HA 0.268 4.587 4.320 -0.001 0.000 0.203 1306 K C 0.591 177.277 176.600 0.144 0.000 1.043 1306 K CA 0.550 56.914 56.287 0.128 0.000 0.960 1306 K CB 0.137 32.695 32.500 0.096 0.000 0.761 1306 K HN 0.698 nan 8.250 nan 0.000 0.448 1307 M N 1.293 120.935 119.600 0.070 0.000 2.180 1307 M HA 0.200 4.679 4.480 -0.001 0.000 0.350 1307 M C 0.300 176.576 176.300 -0.039 0.000 1.125 1307 M CA -0.075 55.242 55.300 0.028 0.000 1.031 1307 M CB 1.551 34.149 32.600 -0.003 0.000 1.623 1307 M HN 0.187 nan 8.290 nan 0.000 0.451 1308 I N 1.773 122.301 120.570 -0.069 0.000 4.399 1308 I HA 0.252 4.421 4.170 -0.001 0.000 0.301 1308 I C 1.832 177.877 176.117 -0.121 0.000 1.198 1308 I CA 1.077 62.317 61.300 -0.100 0.000 1.315 1308 I CB -0.210 37.727 38.000 -0.107 0.000 1.452 1308 I HN 0.746 nan 8.210 nan 0.000 0.457 1309 G N 1.404 110.140 108.800 -0.107 0.000 2.475 1309 G HA2 -0.317 3.642 3.960 -0.001 0.000 0.220 1309 G HA3 -0.317 3.642 3.960 -0.001 0.000 0.220 1309 G C 1.235 176.058 174.900 -0.128 0.000 1.125 1309 G CA 1.392 46.439 45.100 -0.088 0.000 0.755 1309 G HN 0.579 nan 8.290 nan 0.000 0.565 1310 D N 0.954 121.166 120.400 -0.313 0.000 2.144 1310 D HA -0.107 4.532 4.640 -0.001 0.000 0.200 1310 D C 2.414 178.595 176.300 -0.198 0.000 0.978 1310 D CA 0.621 54.345 54.000 -0.459 0.000 0.833 1310 D CB -0.598 39.790 40.800 -0.687 0.000 0.961 1310 D HN 0.435 nan 8.370 nan 0.000 0.470 1311 I N 0.380 120.855 120.570 -0.158 0.000 2.202 1311 I HA -0.208 3.961 4.170 -0.001 0.000 0.242 1311 I C 2.727 178.782 176.117 -0.105 0.000 1.091 1311 I CA 0.654 61.889 61.300 -0.108 0.000 1.368 1311 I CB -0.234 37.707 38.000 -0.098 0.000 1.058 1311 I HN -0.050 nan 8.210 nan 0.000 0.410 1312 L N -0.078 121.068 121.223 -0.128 0.000 2.012 1312 L HA -0.259 4.080 4.340 -0.001 0.000 0.210 1312 L C 2.764 179.559 176.870 -0.126 0.000 1.073 1312 L CA 1.665 56.411 54.840 -0.156 0.000 0.748 1312 L CB -0.664 41.293 42.059 -0.170 0.000 0.891 1312 L HN 0.261 nan 8.230 nan 0.000 0.431 1313 S N -0.578 115.077 115.700 -0.075 0.000 2.399 1313 S HA -0.144 4.325 4.470 -0.001 0.000 0.231 1313 S C 1.980 176.551 174.600 -0.047 0.000 1.022 1313 S CA 1.215 59.400 58.200 -0.026 0.000 0.983 1313 S CB -0.028 63.220 63.200 0.080 0.000 0.803 1313 S HN 0.449 nan 8.310 nan 0.000 0.480 1314 A N -0.127 122.663 122.820 -0.050 0.000 2.021 1314 A HA 0.130 4.449 4.320 -0.001 0.000 0.216 1314 A C 2.097 179.637 177.584 -0.073 0.000 1.163 1314 A CA 1.086 53.096 52.037 -0.045 0.000 0.676 1314 A CB -0.519 18.477 19.000 -0.007 0.000 0.818 1314 A HN 0.499 nan 8.150 nan 0.000 0.453 1315 Q N -0.135 119.630 119.800 -0.058 0.000 2.061 1315 Q HA 0.132 4.471 4.340 -0.001 0.000 0.195 1315 Q C 1.910 177.848 176.000 -0.103 0.000 0.967 1315 Q CA 1.063 56.861 55.803 -0.007 0.000 0.829 1315 Q CB -0.504 28.209 28.738 -0.042 0.000 0.900 1315 Q HN 0.613 nan 8.270 nan 0.000 0.450 1316 L N 0.813 121.936 121.223 -0.167 0.000 2.151 1316 L HA -0.232 4.107 4.340 -0.001 0.000 0.215 1316 L C -0.787 175.985 176.870 -0.162 0.000 1.084 1316 L CA 1.407 56.139 54.840 -0.180 0.000 0.764 1316 L CB -1.375 40.574 42.059 -0.184 0.000 0.891 1316 L HN 0.239 nan 8.230 nan 0.000 0.435 1317 P HA -0.135 nan 4.420 nan 0.000 0.222 1317 P C 1.043 178.199 177.300 -0.240 0.000 1.147 1317 P CA 1.233 64.171 63.100 -0.270 0.000 0.790 1317 P CB -0.044 31.435 31.700 -0.369 0.000 0.780 1318 H N -1.928 117.143 119.070 0.001 0.000 2.539 1318 H HA 0.225 4.781 4.556 -0.001 0.000 0.267 1318 H C 1.312 176.677 175.328 0.062 0.000 0.982 1318 H CA 0.657 56.719 56.048 0.024 0.000 1.146 1318 H CB -0.151 29.621 29.762 0.017 0.000 1.382 1318 H HN 0.212 nan 8.280 nan 0.000 0.577 1319 M N 0.388 120.071 119.600 0.138 0.000 2.568 1319 M HA 0.030 4.509 4.480 -0.001 0.000 0.226 1319 M C 1.278 177.729 176.300 0.251 0.000 1.148 1319 M CA 0.211 55.640 55.300 0.214 0.000 1.007 1319 M CB 0.116 32.752 32.600 0.060 0.000 1.651 1319 M HN 0.073 nan 8.290 nan 0.000 0.488 1320 Q N 0.592 120.486 119.800 0.158 0.000 2.234 1320 Q HA -0.111 4.228 4.340 -0.001 0.000 0.206 1320 Q C -0.615 175.486 176.000 0.168 0.000 0.980 1320 Q CA 1.492 57.378 55.803 0.138 0.000 0.869 1320 Q CB -1.666 27.125 28.738 0.088 0.000 0.912 1320 Q HN 0.388 nan 8.270 nan 0.000 0.436 1321 P HA -0.164 nan 4.420 nan 0.000 0.220 1321 P C 0.777 178.135 177.300 0.097 0.000 1.144 1321 P CA 1.057 64.216 63.100 0.100 0.000 0.800 1321 P CB -0.269 31.455 31.700 0.041 0.000 0.772 1322 Y N -1.085 119.272 120.300 0.096 0.000 2.333 1322 Y HA -0.165 4.384 4.550 -0.002 0.000 0.290 1322 Y C 2.185 178.172 175.900 0.144 0.000 1.144 1322 Y CA 0.925 59.100 58.100 0.126 0.000 1.228 1322 Y CB -0.825 37.685 38.460 0.084 0.000 0.985 1322 Y HN -0.042 nan 8.280 nan 0.000 0.542 1323 I N -0.507 120.202 120.570 0.232 0.000 2.163 1323 I HA -0.314 3.855 4.170 -0.001 0.000 0.240 1323 I C 2.677 178.861 176.117 0.112 0.000 1.081 1323 I CA 1.384 62.773 61.300 0.149 0.000 1.353 1323 I CB -0.404 37.658 38.000 0.104 0.000 1.054 1323 I HN 0.086 nan 8.210 nan 0.000 0.407 1324 R N 0.865 121.428 120.500 0.106 0.000 2.080 1324 R HA -0.256 4.083 4.340 -0.001 0.000 0.236 1324 R C 2.500 178.835 176.300 0.058 0.000 1.137 1324 R CA 2.125 58.269 56.100 0.074 0.000 0.943 1324 R CB -0.587 29.762 30.300 0.082 0.000 0.846 1324 R HN 0.217 nan 8.270 nan 0.000 0.431 1325 F N 1.146 121.103 119.950 0.011 0.000 2.065 1325 F HA -0.318 4.208 4.527 -0.001 0.000 0.298 1325 F C 2.371 178.193 175.800 0.038 0.000 1.112 1325 F CA 1.970 59.976 58.000 0.011 0.000 1.212 1325 F CB -0.633 38.323 39.000 -0.074 0.000 0.975 1325 F HN 0.146 nan 8.300 nan 0.000 0.476 1326 C N -0.402 118.952 119.300 0.089 0.000 2.425 1326 C HA -0.133 4.326 4.460 -0.001 0.000 0.277 1326 C C 2.988 177.940 174.990 -0.063 0.000 1.280 1326 C CA 1.408 60.454 59.018 0.047 0.000 1.744 1326 C CB -1.470 26.379 27.740 0.182 0.000 1.989 1326 C HN 0.550 nan 8.230 nan 0.000 0.491 1327 S N -0.519 115.155 115.700 -0.043 0.000 2.402 1327 S HA -0.151 4.318 4.470 -0.001 0.000 0.229 1327 S C 1.617 176.158 174.600 -0.099 0.000 1.021 1327 S CA 1.430 59.602 58.200 -0.047 0.000 0.974 1327 S CB -0.272 62.918 63.200 -0.017 0.000 0.800 1327 S HN 0.751 nan 8.310 nan 0.000 0.484 1328 C N 1.432 120.627 119.300 -0.174 0.000 2.673 1328 C HA 0.107 4.566 4.460 -0.001 0.000 0.264 1328 C C 2.618 177.444 174.990 -0.273 0.000 1.304 1328 C CA -0.002 58.897 59.018 -0.198 0.000 1.727 1328 C CB -0.974 26.657 27.740 -0.182 0.000 1.932 1328 C HN 0.724 nan 8.230 nan 0.000 0.563 1329 Q N 1.249 120.818 119.800 -0.385 0.000 2.291 1329 Q HA -0.090 4.249 4.340 -0.001 0.000 0.206 1329 Q C 1.691 177.597 176.000 -0.157 0.000 0.976 1329 Q CA 1.832 57.429 55.803 -0.344 0.000 0.875 1329 Q CB -0.670 27.866 28.738 -0.338 0.000 0.927 1329 Q HN 0.609 nan 8.270 nan 0.000 0.450 1330 L N -0.026 121.130 121.223 -0.112 0.000 2.072 1330 L HA -0.092 4.247 4.340 -0.001 0.000 0.205 1330 L C 1.757 178.586 176.870 -0.068 0.000 1.079 1330 L CA 1.106 55.906 54.840 -0.067 0.000 0.752 1330 L CB -0.510 41.521 42.059 -0.047 0.000 0.906 1330 L HN 0.310 nan 8.230 nan 0.000 0.436 1331 N N 0.443 119.096 118.700 -0.078 0.000 2.289 1331 N HA -0.123 4.616 4.740 -0.001 0.000 0.184 1331 N C 1.781 177.245 175.510 -0.078 0.000 1.016 1331 N CA 1.349 54.359 53.050 -0.068 0.000 0.872 1331 N CB -0.496 37.952 38.487 -0.064 0.000 0.973 1331 N HN 0.332 nan 8.380 nan 0.000 0.433 1332 G N 0.227 108.962 108.800 -0.108 0.000 2.394 1332 G HA2 -0.094 3.865 3.960 -0.001 0.000 0.215 1332 G HA3 -0.094 3.865 3.960 -0.001 0.000 0.215 1332 G C 1.626 176.467 174.900 -0.098 0.000 1.165 1332 G CA 0.923 45.950 45.100 -0.121 0.000 0.784 1332 G HN 0.419 nan 8.290 nan 0.000 0.535 1333 A N 1.316 124.090 122.820 -0.077 0.000 1.873 1333 A HA 0.295 4.614 4.320 -0.001 0.000 0.215 1333 A C 2.829 180.395 177.584 -0.031 0.000 1.186 1333 A CA 2.211 54.219 52.037 -0.048 0.000 0.616 1333 A CB -0.890 18.092 19.000 -0.030 0.000 0.823 1333 A HN 0.773 nan 8.150 nan 0.000 0.442 1334 A N -0.389 122.410 122.820 -0.034 0.000 1.908 1334 A HA -0.108 4.211 4.320 -0.001 0.000 0.218 1334 A C 2.137 179.703 177.584 -0.030 0.000 1.181 1334 A CA 1.692 53.713 52.037 -0.026 0.000 0.627 1334 A CB -0.568 18.415 19.000 -0.030 0.000 0.818 1334 A HN 0.504 nan 8.150 nan 0.000 0.445 1335 L N -0.005 121.191 121.223 -0.045 0.000 2.046 1335 L HA -0.125 4.214 4.340 -0.001 0.000 0.208 1335 L C 2.274 179.110 176.870 -0.057 0.000 1.077 1335 L CA 1.913 56.717 54.840 -0.060 0.000 0.747 1335 L CB -0.874 41.144 42.059 -0.068 0.000 0.896 1335 L HN 0.482 nan 8.230 nan 0.000 0.432 1336 I N -0.369 120.194 120.570 -0.012 0.000 2.315 1336 I HA -0.294 3.875 4.170 -0.001 0.000 0.248 1336 I C 2.465 178.659 176.117 0.127 0.000 1.117 1336 I CA 1.045 62.401 61.300 0.093 0.000 1.404 1336 I CB -0.176 37.877 38.000 0.087 0.000 1.071 1336 I HN 0.318 nan 8.210 nan 0.000 0.419 1337 Q N 0.863 120.698 119.800 0.060 0.000 2.311 1337 Q HA -0.204 4.135 4.340 -0.001 0.000 0.203 1337 Q C 2.052 178.076 176.000 0.041 0.000 0.954 1337 Q CA 1.355 57.195 55.803 0.061 0.000 0.885 1337 Q CB -0.113 28.644 28.738 0.032 0.000 0.963 1337 Q HN 0.500 nan 8.270 nan 0.000 0.471 1338 Q N -0.580 119.222 119.800 0.003 0.000 2.049 1338 Q HA -0.125 4.215 4.340 -0.001 0.000 0.198 1338 Q C 1.556 177.530 176.000 -0.044 0.000 0.971 1338 Q CA 0.955 56.745 55.803 -0.022 0.000 0.833 1338 Q CB 0.062 28.773 28.738 -0.045 0.000 0.896 1338 Q HN 0.089 nan 8.270 nan 0.000 0.434 1339 K N 0.191 120.521 120.400 -0.118 0.000 2.097 1339 K HA -0.088 4.231 4.320 -0.001 0.000 0.205 1339 K C 2.150 178.753 176.600 0.006 0.000 1.050 1339 K CA 1.754 57.884 56.287 -0.262 0.000 0.938 1339 K CB -0.390 31.586 32.500 -0.873 0.000 0.718 1339 K HN 0.494 nan 8.250 nan 0.000 0.442 1340 T N -1.159 113.528 114.554 0.222 0.000 3.072 1340 T HA -0.030 4.319 4.350 -0.001 0.000 0.266 1340 T C 1.056 175.846 174.700 0.150 0.000 1.127 1340 T CA 0.857 63.145 62.100 0.314 0.000 1.107 1340 T CB 0.093 69.124 68.868 0.272 0.000 0.910 1340 T HN -0.036 nan 8.240 nan 0.000 0.513 1341 D N 1.371 121.822 120.400 0.086 0.000 2.389 1341 D HA 0.073 4.712 4.640 -0.001 0.000 0.206 1341 D C 1.933 178.255 176.300 0.036 0.000 1.055 1341 D CA 0.562 54.593 54.000 0.052 0.000 0.856 1341 D CB 0.299 41.119 40.800 0.032 0.000 0.957 1341 D HN 0.877 nan 8.370 nan 0.000 0.509 1342 E N -0.309 119.907 120.200 0.027 0.000 2.421 1342 E HA 0.307 4.657 4.350 -0.001 0.000 0.209 1342 E C 0.378 176.993 176.600 0.024 0.000 0.871 1342 E CA -0.218 56.190 56.400 0.012 0.000 1.064 1342 E CB 0.719 30.410 29.700 -0.015 0.000 1.075 1342 E HN -0.024 nan 8.360 nan 0.000 0.513 1343 A N 2.208 125.057 122.820 0.047 0.000 2.293 1343 A HA 0.459 4.778 4.320 -0.001 0.000 0.312 1343 A C -2.214 175.462 177.584 0.153 0.000 1.309 1343 A CA -1.691 50.395 52.037 0.082 0.000 0.839 1343 A CB 1.100 20.137 19.000 0.061 0.000 1.155 1343 A HN -0.060 nan 8.150 nan 0.000 0.501 1344 P HA -0.124 nan 4.420 nan 0.000 0.217 1344 P C 0.656 178.033 177.300 0.128 0.000 1.150 1344 P CA 1.051 64.215 63.100 0.107 0.000 0.832 1344 P CB 0.305 32.045 31.700 0.068 0.000 0.787 1345 D N -1.804 118.674 120.400 0.131 0.000 2.263 1345 D HA -0.140 4.499 4.640 -0.001 0.000 0.208 1345 D C 1.592 178.021 176.300 0.216 0.000 0.971 1345 D CA 0.890 54.969 54.000 0.131 0.000 0.867 1345 D CB -0.414 40.436 40.800 0.085 0.000 0.929 1345 D HN 0.173 nan 8.370 nan 0.000 0.492 1346 F N 1.789 121.797 119.950 0.097 0.000 2.123 1346 F HA -0.018 4.509 4.527 -0.001 0.000 0.289 1346 F C 2.325 178.206 175.800 0.135 0.000 1.099 1346 F CA 0.993 59.078 58.000 0.141 0.000 1.234 1346 F CB -0.122 38.938 39.000 0.099 0.000 1.034 1346 F HN -0.301 nan 8.300 nan 0.000 0.479 1347 K N -0.072 120.449 120.400 0.202 0.000 2.173 1347 K HA -0.298 4.021 4.320 -0.001 0.000 0.207 1347 K C 2.025 178.629 176.600 0.006 0.000 1.046 1347 K CA 2.013 58.349 56.287 0.082 0.000 0.929 1347 K CB -0.171 32.397 32.500 0.112 0.000 0.720 1347 K HN 0.294 nan 8.250 nan 0.000 0.453 1348 E N 0.022 120.247 120.200 0.043 0.000 2.042 1348 E HA -0.122 4.227 4.350 -0.001 0.000 0.189 1348 E C 1.675 178.292 176.600 0.028 0.000 0.974 1348 E CA 0.983 57.405 56.400 0.037 0.000 0.806 1348 E CB -0.506 29.234 29.700 0.067 0.000 0.769 1348 E HN 0.295 nan 8.360 nan 0.000 0.451 1349 F N 0.603 120.492 119.950 -0.103 0.000 2.120 1349 F HA -0.168 4.358 4.527 -0.002 0.000 0.300 1349 F C 2.174 177.862 175.800 -0.188 0.000 1.095 1349 F CA 1.579 59.503 58.000 -0.127 0.000 1.249 1349 F CB -0.669 38.269 39.000 -0.103 0.000 0.995 1349 F HN 0.067 nan 8.300 nan 0.000 0.480 1350 V N 0.371 120.056 119.914 -0.382 0.000 2.626 1350 V HA -0.220 3.899 4.120 -0.001 0.000 0.252 1350 V C 2.419 178.352 176.094 -0.269 0.000 1.067 1350 V CA 2.145 64.182 62.300 -0.438 0.000 1.081 1350 V CB -0.426 31.119 31.823 -0.464 0.000 0.686 1350 V HN 0.359 nan 8.190 nan 0.000 0.468 1351 K N 0.299 120.587 120.400 -0.187 0.000 2.155 1351 K HA -0.080 4.239 4.320 -0.001 0.000 0.203 1351 K C 2.176 178.683 176.600 -0.155 0.000 1.052 1351 K CA 1.335 57.556 56.287 -0.110 0.000 0.948 1351 K CB -0.403 32.062 32.500 -0.058 0.000 0.728 1351 K HN 0.261 nan 8.250 nan 0.000 0.448 1352 R N 0.349 120.721 120.500 -0.214 0.000 2.096 1352 R HA -0.011 4.329 4.340 -0.001 0.000 0.235 1352 R C 2.270 178.369 176.300 -0.334 0.000 1.127 1352 R CA 1.277 57.243 56.100 -0.225 0.000 0.968 1352 R CB -0.666 29.522 30.300 -0.187 0.000 0.861 1352 R HN 0.294 nan 8.270 nan 0.000 0.440 1353 L N -0.137 120.767 121.223 -0.532 0.000 2.109 1353 L HA -0.029 4.310 4.340 -0.001 0.000 0.207 1353 L C 2.359 178.863 176.870 -0.610 0.000 1.086 1353 L CA 1.113 55.547 54.840 -0.677 0.000 0.760 1353 L CB -0.431 41.038 42.059 -0.983 0.000 0.910 1353 L HN 0.092 nan 8.230 nan 0.000 0.437 1354 A N 0.373 122.966 122.820 -0.377 0.000 2.167 1354 A HA -0.101 4.218 4.320 -0.001 0.000 0.214 1354 A C 2.227 179.775 177.584 -0.060 0.000 1.151 1354 A CA 0.858 52.831 52.037 -0.107 0.000 0.735 1354 A CB -0.482 18.591 19.000 0.121 0.000 0.802 1354 A HN 0.545 nan 8.150 nan 0.000 0.467 1355 M N -1.431 118.104 119.600 -0.109 0.000 2.492 1355 M HA 0.074 4.553 4.480 -0.001 0.000 0.262 1355 M C 0.411 176.673 176.300 -0.064 0.000 1.090 1355 M CA 0.446 55.708 55.300 -0.062 0.000 1.110 1355 M CB -0.684 31.875 32.600 -0.067 0.000 1.407 1355 M HN 0.170 nan 8.290 nan 0.000 0.470 1356 D N 3.679 124.010 120.400 -0.115 0.000 2.629 1356 D HA -0.051 4.588 4.640 -0.001 0.000 0.228 1356 D C -1.343 174.934 176.300 -0.037 0.000 1.127 1356 D CA -0.461 53.478 54.000 -0.103 0.000 0.855 1356 D CB 1.074 41.772 40.800 -0.171 0.000 1.180 1356 D HN 0.147 nan 8.370 nan 0.000 0.484 1357 P HA -0.159 nan 4.420 nan 0.000 0.218 1357 P C 0.949 178.271 177.300 0.036 0.000 1.148 1357 P CA 1.123 64.228 63.100 0.008 0.000 0.822 1357 P CB 0.260 31.961 31.700 0.001 0.000 0.784 1358 R N -0.594 119.926 120.500 0.032 0.000 2.189 1358 R HA -0.013 4.326 4.340 -0.001 0.000 0.223 1358 R C 2.425 178.815 176.300 0.150 0.000 1.092 1358 R CA 1.086 57.229 56.100 0.072 0.000 0.989 1358 R CB -1.428 28.900 30.300 0.048 0.000 0.876 1358 R HN 0.241 nan 8.270 nan 0.000 0.457 1359 C N 0.841 120.231 119.300 0.150 0.000 2.449 1359 C HA 0.051 4.510 4.460 -0.001 0.000 0.283 1359 C C 0.720 175.894 174.990 0.306 0.000 1.453 1359 C CA -0.027 59.186 59.018 0.324 0.000 1.779 1359 C CB -0.918 26.968 27.740 0.244 0.000 1.779 1359 C HN 0.550 nan 8.230 nan 0.000 0.546 1360 K N -0.356 120.146 120.400 0.169 0.000 2.960 1360 K HA -0.232 4.088 4.320 -0.001 0.000 0.259 1360 K C 0.973 177.636 176.600 0.105 0.000 1.025 1360 K CA 0.459 56.815 56.287 0.114 0.000 0.756 1360 K CB -1.839 30.723 32.500 0.103 0.000 1.221 1360 K HN 0.844 nan 8.250 nan 0.000 0.483 1361 G N 0.262 109.137 108.800 0.124 0.000 2.143 1361 G HA2 -0.351 3.608 3.960 -0.001 0.000 0.249 1361 G HA3 -0.351 3.608 3.960 -0.001 0.000 0.249 1361 G C -0.017 174.962 174.900 0.131 0.000 0.981 1361 G CA 0.400 45.563 45.100 0.105 0.000 0.665 1361 G HN 0.405 nan 8.290 nan 0.000 0.528 1362 M N 2.423 122.155 119.600 0.220 0.000 2.144 1362 M HA 0.479 4.958 4.480 -0.001 0.000 0.356 1362 M C -1.981 174.561 176.300 0.403 0.000 1.217 1362 M CA -2.188 53.239 55.300 0.211 0.000 1.087 1362 M CB 1.381 33.959 32.600 -0.037 0.000 1.609 1362 M HN 0.042 nan 8.290 nan 0.000 0.467 1363 P HA 0.008 nan 4.420 nan 0.000 0.275 1363 P C 0.353 177.749 177.300 0.160 0.000 1.228 1363 P CA -0.403 62.810 63.100 0.188 0.000 0.786 1363 P CB 0.929 32.684 31.700 0.093 0.000 0.927 1364 L N 3.610 124.781 121.223 -0.088 0.000 2.197 1364 L HA -0.231 4.108 4.340 -0.001 0.000 0.215 1364 L C 2.234 179.000 176.870 -0.174 0.000 1.095 1364 L CA 2.638 57.185 54.840 -0.488 0.000 0.764 1364 L CB -1.439 40.181 42.059 -0.732 0.000 0.897 1364 L HN 0.505 nan 8.230 nan 0.000 0.436 1365 S N -3.060 112.607 115.700 -0.055 0.000 2.453 1365 S HA -0.059 4.410 4.470 -0.001 0.000 0.231 1365 S C 1.795 176.404 174.600 0.015 0.000 1.005 1365 S CA 1.005 59.193 58.200 -0.021 0.000 0.949 1365 S CB -0.402 62.799 63.200 0.000 0.000 0.774 1365 S HN 0.489 nan 8.310 nan 0.000 0.510 1366 S N 0.332 116.051 115.700 0.031 0.000 2.492 1366 S HA 0.362 4.831 4.470 -0.001 0.000 0.218 1366 S C 1.005 175.585 174.600 -0.033 0.000 1.016 1366 S CA -0.062 58.129 58.200 -0.015 0.000 0.916 1366 S CB -0.334 62.822 63.200 -0.073 0.000 0.791 1366 S HN 0.538 nan 8.310 nan 0.000 0.513 1367 F N 0.973 120.900 119.950 -0.037 0.000 2.367 1367 F HA 0.182 4.708 4.527 -0.002 0.000 0.298 1367 F C 1.801 177.696 175.800 0.159 0.000 1.094 1367 F CA 0.232 58.246 58.000 0.024 0.000 1.409 1367 F CB -0.201 38.734 39.000 -0.109 0.000 1.064 1367 F HN 0.142 nan 8.300 nan 0.000 0.528 1368 I N 0.044 120.761 120.570 0.246 0.000 2.756 1368 I HA -0.210 3.959 4.170 -0.001 0.000 0.262 1368 I C 1.763 178.114 176.117 0.390 0.000 1.225 1368 I CA 1.370 62.864 61.300 0.323 0.000 1.472 1368 I CB -0.411 37.644 38.000 0.092 0.000 1.094 1368 I HN 0.065 nan 8.210 nan 0.000 0.454 1369 L N -1.005 120.362 121.223 0.240 0.000 2.446 1369 L HA -0.040 4.299 4.340 -0.001 0.000 0.219 1369 L C 2.229 179.220 176.870 0.201 0.000 1.116 1369 L CA 0.325 55.282 54.840 0.195 0.000 0.844 1369 L CB -0.579 41.538 42.059 0.097 0.000 0.970 1369 L HN 0.088 nan 8.230 nan 0.000 0.457 1370 K N 0.748 121.279 120.400 0.220 0.000 2.044 1370 K HA -0.182 4.138 4.320 -0.001 0.000 0.210 1370 K C -0.334 176.436 176.600 0.283 0.000 1.049 1370 K CA 1.614 58.033 56.287 0.221 0.000 0.927 1370 K CB -1.175 31.457 32.500 0.220 0.000 0.713 1370 K HN 0.216 nan 8.250 nan 0.000 0.443 1371 P HA -0.213 nan 4.420 nan 0.000 0.216 1371 P C 1.439 178.921 177.300 0.304 0.000 1.157 1371 P CA 1.397 64.650 63.100 0.256 0.000 0.880 1371 P CB 0.061 31.643 31.700 -0.196 0.000 0.791 1372 M N -1.303 118.453 119.600 0.260 0.000 2.132 1372 M HA -0.181 4.298 4.480 -0.001 0.000 0.263 1372 M C 2.171 178.498 176.300 0.045 0.000 1.065 1372 M CA 1.839 57.241 55.300 0.170 0.000 1.122 1372 M CB -0.959 31.736 32.600 0.157 0.000 1.365 1372 M HN -0.003 nan 8.290 nan 0.000 0.411 1373 Q N -0.646 119.181 119.800 0.046 0.000 2.077 1373 Q HA -0.255 4.084 4.340 -0.001 0.000 0.206 1373 Q C 2.058 177.962 176.000 -0.161 0.000 0.989 1373 Q CA 1.934 57.720 55.803 -0.028 0.000 0.853 1373 Q CB -0.203 28.542 28.738 0.012 0.000 0.907 1373 Q HN 0.238 nan 8.270 nan 0.000 0.418 1374 R N 0.156 120.509 120.500 -0.245 0.000 2.080 1374 R HA -0.126 4.213 4.340 -0.001 0.000 0.236 1374 R C 2.046 177.846 176.300 -0.834 0.000 1.137 1374 R CA 1.444 57.145 56.100 -0.665 0.000 0.943 1374 R CB -0.955 28.680 30.300 -1.108 0.000 0.846 1374 R HN 0.138 nan 8.270 nan 0.000 0.431 1375 V N 0.368 119.935 119.914 -0.579 0.000 2.380 1375 V HA -0.267 3.852 4.120 -0.001 0.000 0.251 1375 V C 2.211 178.148 176.094 -0.261 0.000 1.063 1375 V CA 2.359 64.395 62.300 -0.439 0.000 1.055 1375 V CB -0.736 30.928 31.823 -0.264 0.000 0.657 1375 V HN 0.779 nan 8.190 nan 0.000 0.455 1376 T N -2.057 112.374 114.554 -0.204 0.000 3.088 1376 T HA -0.089 4.260 4.350 -0.001 0.000 0.259 1376 T C 1.798 176.405 174.700 -0.155 0.000 1.122 1376 T CA 0.834 62.856 62.100 -0.130 0.000 1.095 1376 T CB -0.070 68.752 68.868 -0.077 0.000 0.930 1376 T HN 0.341 nan 8.240 nan 0.000 0.508 1377 R N -0.205 120.139 120.500 -0.260 0.000 2.127 1377 R HA 0.241 4.580 4.340 -0.001 0.000 0.217 1377 R C 1.760 177.939 176.300 -0.201 0.000 1.074 1377 R CA 0.852 56.802 56.100 -0.250 0.000 0.991 1377 R CB -1.112 28.998 30.300 -0.317 0.000 0.895 1377 R HN 0.606 nan 8.270 nan 0.000 0.450 1378 Y N 0.754 120.933 120.300 -0.201 0.000 2.040 1378 Y HA -0.212 4.337 4.550 -0.002 0.000 0.275 1378 Y C -0.519 175.278 175.900 -0.172 0.000 1.171 1378 Y CA 1.479 59.457 58.100 -0.203 0.000 1.123 1378 Y CB -1.182 37.143 38.460 -0.226 0.000 0.963 1378 Y HN 0.213 nan 8.280 nan 0.000 0.493 1379 P HA -0.217 nan 4.420 nan 0.000 0.216 1379 P C 1.324 178.577 177.300 -0.078 0.000 1.150 1379 P CA 1.617 64.693 63.100 -0.041 0.000 0.843 1379 P CB -0.144 31.529 31.700 -0.044 0.000 0.787 1380 L N -1.618 119.552 121.223 -0.088 0.000 2.017 1380 L HA -0.162 4.178 4.340 -0.001 0.000 0.208 1380 L C 2.447 179.213 176.870 -0.174 0.000 1.073 1380 L CA 1.547 56.316 54.840 -0.119 0.000 0.745 1380 L CB -0.972 41.023 42.059 -0.107 0.000 0.894 1380 L HN -0.046 nan 8.230 nan 0.000 0.432 1381 I N 0.080 120.555 120.570 -0.159 0.000 2.163 1381 I HA -0.294 3.876 4.170 -0.001 0.000 0.240 1381 I C 2.518 178.515 176.117 -0.201 0.000 1.081 1381 I CA 1.471 62.651 61.300 -0.201 0.000 1.353 1381 I CB -0.276 37.640 38.000 -0.139 0.000 1.054 1381 I HN 0.128 nan 8.210 nan 0.000 0.407 1382 I N 0.841 121.329 120.570 -0.136 0.000 2.208 1382 I HA -0.330 3.840 4.170 -0.001 0.000 0.245 1382 I C 2.621 178.648 176.117 -0.150 0.000 1.097 1382 I CA 1.468 62.688 61.300 -0.134 0.000 1.363 1382 I CB -0.425 37.506 38.000 -0.116 0.000 1.051 1382 I HN 0.203 nan 8.210 nan 0.000 0.413 1383 K N 1.391 121.700 120.400 -0.151 0.000 2.063 1383 K HA -0.213 4.107 4.320 -0.001 0.000 0.208 1383 K C 1.884 178.372 176.600 -0.187 0.000 1.048 1383 K CA 1.725 57.923 56.287 -0.148 0.000 0.928 1383 K CB -0.110 32.312 32.500 -0.131 0.000 0.713 1383 K HN 0.200 nan 8.250 nan 0.000 0.442 1384 N N 0.558 119.076 118.700 -0.303 0.000 2.084 1384 N HA -0.115 4.624 4.740 -0.001 0.000 0.190 1384 N C 1.779 177.145 175.510 -0.240 0.000 1.030 1384 N CA 1.641 54.400 53.050 -0.484 0.000 0.849 1384 N CB -0.210 37.521 38.487 -1.260 0.000 1.012 1384 N HN 0.245 nan 8.380 nan 0.000 0.423 1385 I N 0.560 121.035 120.570 -0.158 0.000 2.127 1385 I HA -0.270 3.900 4.170 -0.001 0.000 0.241 1385 I C 2.226 178.312 176.117 -0.052 0.000 1.075 1385 I CA 0.825 62.115 61.300 -0.017 0.000 1.334 1385 I CB -0.322 37.645 38.000 -0.056 0.000 1.040 1385 I HN 0.097 nan 8.210 nan 0.000 0.405 1386 L N 1.055 122.214 121.223 -0.107 0.000 2.127 1386 L HA -0.213 4.126 4.340 -0.001 0.000 0.211 1386 L C 2.234 179.064 176.870 -0.066 0.000 1.089 1386 L CA 1.880 56.641 54.840 -0.132 0.000 0.757 1386 L CB -0.664 41.288 42.059 -0.177 0.000 0.899 1386 L HN 0.213 nan 8.230 nan 0.000 0.434 1387 E N -0.634 119.540 120.200 -0.043 0.000 2.418 1387 E HA -0.075 4.274 4.350 -0.001 0.000 0.197 1387 E C 0.333 176.964 176.600 0.051 0.000 1.026 1387 E CA 0.529 56.932 56.400 0.005 0.000 0.862 1387 E CB -0.096 29.596 29.700 -0.013 0.000 0.799 1387 E HN 0.562 nan 8.360 nan 0.000 0.518 1388 N N 0.859 119.596 118.700 0.061 0.000 2.535 1388 N HA 0.081 4.820 4.740 -0.001 0.000 0.294 1388 N C -1.077 174.459 175.510 0.044 0.000 1.408 1388 N CA 0.207 53.305 53.050 0.081 0.000 0.927 1388 N CB 1.530 40.098 38.487 0.135 0.000 1.276 1388 N HN -0.128 nan 8.380 nan 0.000 0.505 1389 T N 1.995 116.576 114.554 0.046 0.000 3.078 1389 T HA 0.262 4.611 4.350 -0.001 0.000 0.328 1389 T C -2.672 172.138 174.700 0.182 0.000 0.987 1389 T CA -0.984 61.130 62.100 0.023 0.000 1.049 1389 T CB 2.790 71.601 68.868 -0.095 0.000 1.011 1389 T HN 0.039 nan 8.240 nan 0.000 0.463 1390 P HA 0.106 nan 4.420 nan 0.000 0.269 1390 P C 0.931 178.179 177.300 -0.087 0.000 1.215 1390 P CA -0.183 62.950 63.100 0.055 0.000 0.780 1390 P CB 1.078 32.811 31.700 0.055 0.000 0.898 1391 E N 2.871 122.807 120.200 -0.440 0.000 2.209 1391 E HA -0.220 4.129 4.350 -0.001 0.000 0.196 1391 E C 1.120 177.549 176.600 -0.285 0.000 0.993 1391 E CA 1.351 57.248 56.400 -0.837 0.000 0.819 1391 E CB -1.086 28.229 29.700 -0.642 0.000 0.745 1391 E HN 0.546 nan 8.360 nan 0.000 0.477 1392 N N 1.240 119.866 118.700 -0.123 0.000 2.396 1392 N HA -0.180 4.560 4.740 -0.001 0.000 0.180 1392 N C 0.736 176.254 175.510 0.014 0.000 1.028 1392 N CA 0.343 53.364 53.050 -0.048 0.000 0.893 1392 N CB -0.939 37.525 38.487 -0.038 0.000 0.967 1392 N HN 0.340 nan 8.380 nan 0.000 0.440 1393 H N 3.328 122.383 119.070 -0.024 0.000 3.038 1393 H HA 0.025 4.580 4.556 -0.001 0.000 0.338 1393 H C -1.198 174.156 175.328 0.044 0.000 1.041 1393 H CA -0.781 55.283 56.048 0.025 0.000 1.394 1393 H CB 1.159 30.957 29.762 0.060 0.000 1.357 1393 H HN 0.015 nan 8.280 nan 0.000 0.600 1394 P HA -0.088 nan 4.420 nan 0.000 0.237 1394 P C 0.258 177.740 177.300 0.303 0.000 1.178 1394 P CA 0.958 64.159 63.100 0.169 0.000 0.766 1394 P CB 0.463 32.194 31.700 0.052 0.000 0.876 1395 D N -1.904 118.786 120.400 0.484 0.000 2.389 1395 D HA -0.046 4.593 4.640 -0.001 0.000 0.206 1395 D C 1.716 178.091 176.300 0.126 0.000 1.055 1395 D CA 0.066 54.222 54.000 0.261 0.000 0.856 1395 D CB -0.348 40.511 40.800 0.098 0.000 0.957 1395 D HN 0.072 nan 8.370 nan 0.000 0.509 1396 H N -0.240 118.848 119.070 0.030 0.000 2.252 1396 H HA -0.121 4.434 4.556 -0.001 0.000 0.292 1396 H C 1.977 177.240 175.328 -0.110 0.000 1.082 1396 H CA 2.571 58.594 56.048 -0.043 0.000 1.229 1396 H CB -0.071 29.685 29.762 -0.009 0.000 1.353 1396 H HN -0.057 nan 8.280 nan 0.000 0.488 1397 S N -0.629 115.048 115.700 -0.037 0.000 2.383 1397 S HA -0.193 4.276 4.470 -0.001 0.000 0.229 1397 S C 1.971 176.194 174.600 -0.628 0.000 1.030 1397 S CA 1.142 59.149 58.200 -0.322 0.000 1.002 1397 S CB -0.317 62.683 63.200 -0.334 0.000 0.829 1397 S HN 0.539 nan 8.310 nan 0.000 0.467 1398 H N 0.926 119.795 119.070 -0.336 0.000 2.353 1398 H HA 0.039 4.594 4.556 -0.001 0.000 0.300 1398 H C 2.105 177.293 175.328 -0.232 0.000 1.090 1398 H CA 1.130 57.006 56.048 -0.286 0.000 1.327 1398 H CB -0.460 29.221 29.762 -0.135 0.000 1.383 1398 H HN 0.331 nan 8.280 nan 0.000 0.508 1399 L N 0.476 121.640 121.223 -0.098 0.000 2.141 1399 L HA -0.132 4.207 4.340 -0.001 0.000 0.209 1399 L C 2.632 179.401 176.870 -0.168 0.000 1.094 1399 L CA 0.923 55.679 54.840 -0.140 0.000 0.763 1399 L CB -0.207 41.742 42.059 -0.183 0.000 0.908 1399 L HN 0.144 nan 8.230 nan 0.000 0.437 1400 K N -0.416 119.840 120.400 -0.239 0.000 2.097 1400 K HA -0.163 4.156 4.320 -0.001 0.000 0.205 1400 K C 1.955 178.570 176.600 0.025 0.000 1.050 1400 K CA 1.278 57.471 56.287 -0.157 0.000 0.938 1400 K CB -0.021 32.375 32.500 -0.174 0.000 0.718 1400 K HN 0.480 nan 8.250 nan 0.000 0.442 1401 H N -1.027 117.994 119.070 -0.081 0.000 2.372 1401 H HA 0.026 4.581 4.556 -0.001 0.000 0.301 1401 H C 2.065 177.353 175.328 -0.067 0.000 1.065 1401 H CA 0.472 56.483 56.048 -0.062 0.000 1.364 1401 H CB 0.145 29.883 29.762 -0.040 0.000 1.406 1401 H HN 0.311 nan 8.280 nan 0.000 0.521 1402 A N 1.564 124.416 122.820 0.053 0.000 1.908 1402 A HA -0.156 4.163 4.320 -0.001 0.000 0.218 1402 A C 2.364 179.913 177.584 -0.059 0.000 1.181 1402 A CA 1.079 53.099 52.037 -0.030 0.000 0.627 1402 A CB -0.776 18.182 19.000 -0.069 0.000 0.818 1402 A HN 0.366 nan 8.150 nan 0.000 0.445 1403 L N -0.715 120.473 121.223 -0.059 0.000 1.994 1403 L HA -0.216 4.123 4.340 -0.001 0.000 0.208 1403 L C 2.654 179.495 176.870 -0.049 0.000 1.071 1403 L CA 2.374 57.175 54.840 -0.066 0.000 0.745 1403 L CB -0.483 41.531 42.059 -0.074 0.000 0.892 1403 L HN 0.672 nan 8.230 nan 0.000 0.431 1404 E N 0.048 120.231 120.200 -0.030 0.000 2.070 1404 E HA -0.297 4.052 4.350 -0.001 0.000 0.197 1404 E C 2.150 178.725 176.600 -0.042 0.000 1.004 1404 E CA 1.670 58.051 56.400 -0.030 0.000 0.805 1404 E CB 0.066 29.752 29.700 -0.022 0.000 0.744 1404 E HN 0.427 nan 8.360 nan 0.000 0.451 1405 K N -0.132 120.241 120.400 -0.045 0.000 2.057 1405 K HA -0.123 4.196 4.320 -0.001 0.000 0.207 1405 K C 2.169 178.730 176.600 -0.066 0.000 1.049 1405 K CA 1.045 57.296 56.287 -0.060 0.000 0.931 1405 K CB -0.142 32.316 32.500 -0.070 0.000 0.714 1405 K HN 0.144 nan 8.250 nan 0.000 0.440 1406 A N 1.703 124.480 122.820 -0.073 0.000 1.877 1406 A HA -0.206 4.113 4.320 -0.001 0.000 0.216 1406 A C 1.909 179.468 177.584 -0.042 0.000 1.186 1406 A CA 1.509 53.506 52.037 -0.067 0.000 0.620 1406 A CB -0.410 18.549 19.000 -0.069 0.000 0.822 1406 A HN 0.288 nan 8.150 nan 0.000 0.443 1407 E N -0.262 119.913 120.200 -0.042 0.000 2.110 1407 E HA -0.233 4.117 4.350 -0.001 0.000 0.193 1407 E C 2.019 178.601 176.600 -0.030 0.000 0.988 1407 E CA 1.410 57.789 56.400 -0.035 0.000 0.804 1407 E CB -0.171 29.508 29.700 -0.036 0.000 0.745 1407 E HN 0.956 nan 8.360 nan 0.000 0.458 1408 E N 1.022 121.203 120.200 -0.032 0.000 2.158 1408 E HA -0.131 4.218 4.350 -0.001 0.000 0.191 1408 E C 2.215 178.803 176.600 -0.019 0.000 0.982 1408 E CA 0.439 56.823 56.400 -0.026 0.000 0.823 1408 E CB -0.246 29.436 29.700 -0.030 0.000 0.766 1408 E HN 0.193 nan 8.360 nan 0.000 0.468 1409 L N 0.777 121.985 121.223 -0.025 0.000 2.027 1409 L HA -0.154 4.185 4.340 -0.001 0.000 0.206 1409 L C 2.505 179.372 176.870 -0.005 0.000 1.074 1409 L CA 1.695 56.526 54.840 -0.014 0.000 0.745 1409 L CB -0.547 41.492 42.059 -0.034 0.000 0.898 1409 L HN 0.505 nan 8.230 nan 0.000 0.433 1410 C N -0.444 118.846 119.300 -0.017 0.000 2.401 1410 C HA -0.187 4.272 4.460 -0.001 0.000 0.276 1410 C C 3.129 178.117 174.990 -0.004 0.000 1.233 1410 C CA 1.602 60.610 59.018 -0.016 0.000 1.753 1410 C CB -0.691 27.032 27.740 -0.028 0.000 2.029 1410 C HN 0.637 nan 8.230 nan 0.000 0.478 1411 S N -0.105 115.591 115.700 -0.007 0.000 2.368 1411 S HA -0.204 4.266 4.470 -0.001 0.000 0.225 1411 S C 1.788 176.391 174.600 0.006 0.000 1.030 1411 S CA 1.610 59.808 58.200 -0.003 0.000 0.999 1411 S CB -0.396 62.799 63.200 -0.008 0.000 0.844 1411 S HN 0.752 nan 8.310 nan 0.000 0.459 1412 Q N 0.311 120.117 119.800 0.010 0.000 2.124 1412 Q HA -0.082 4.257 4.340 -0.001 0.000 0.202 1412 Q C 2.257 178.276 176.000 0.032 0.000 0.977 1412 Q CA 1.276 57.090 55.803 0.019 0.000 0.850 1412 Q CB -0.377 28.375 28.738 0.023 0.000 0.901 1412 Q HN 0.337 nan 8.270 nan 0.000 0.429 1413 V N 1.720 121.659 119.914 0.042 0.000 2.237 1413 V HA -0.324 3.796 4.120 -0.001 0.000 0.245 1413 V C 1.648 177.767 176.094 0.041 0.000 1.046 1413 V CA 2.274 64.610 62.300 0.061 0.000 1.007 1413 V CB -0.706 31.163 31.823 0.077 0.000 0.638 1413 V HN 0.448 nan 8.190 nan 0.000 0.445 1414 N N -0.486 118.230 118.700 0.026 0.000 2.205 1414 N HA -0.185 4.554 4.740 -0.001 0.000 0.186 1414 N C 1.769 177.286 175.510 0.012 0.000 1.015 1414 N CA 1.145 54.205 53.050 0.016 0.000 0.862 1414 N CB -0.087 38.404 38.487 0.007 0.000 0.986 1414 N HN 0.499 nan 8.380 nan 0.000 0.429 1415 E N 0.405 120.612 120.200 0.012 0.000 2.152 1415 E HA -0.071 4.278 4.350 -0.001 0.000 0.192 1415 E C 2.181 178.787 176.600 0.010 0.000 0.983 1415 E CA 0.638 57.043 56.400 0.008 0.000 0.818 1415 E CB -0.273 29.431 29.700 0.007 0.000 0.758 1415 E HN 0.445 nan 8.360 nan 0.000 0.467 1416 G N 1.146 109.956 108.800 0.016 0.000 2.402 1416 G HA2 -0.197 3.762 3.960 -0.001 0.000 0.216 1416 G HA3 -0.197 3.762 3.960 -0.001 0.000 0.216 1416 G C 1.838 176.742 174.900 0.007 0.000 1.162 1416 G CA 0.746 45.855 45.100 0.015 0.000 0.777 1416 G HN 0.147 nan 8.290 nan 0.000 0.539 1417 V N 0.862 120.781 119.914 0.009 0.000 2.287 1417 V HA -0.191 3.928 4.120 -0.001 0.000 0.248 1417 V C 2.800 178.892 176.094 -0.003 0.000 1.053 1417 V CA 2.230 64.529 62.300 -0.000 0.000 1.027 1417 V CB -0.474 31.353 31.823 0.006 0.000 0.646 1417 V HN 0.434 nan 8.190 nan 0.000 0.447 1418 R N -0.068 120.432 120.500 0.000 0.000 2.075 1418 R HA -0.204 4.135 4.340 -0.001 0.000 0.232 1418 R C 2.344 178.642 176.300 -0.003 0.000 1.126 1418 R CA 2.008 58.107 56.100 -0.002 0.000 0.963 1418 R CB -0.243 30.057 30.300 -0.000 0.000 0.858 1418 R HN 0.651 nan 8.270 nan 0.000 0.435 1419 E N 0.327 120.527 120.200 -0.001 0.000 2.072 1419 E HA -0.236 4.113 4.350 -0.001 0.000 0.191 1419 E C 1.867 178.464 176.600 -0.005 0.000 0.985 1419 E CA 1.333 57.732 56.400 -0.002 0.000 0.801 1419 E CB 0.120 29.821 29.700 0.001 0.000 0.750 1419 E HN 0.128 nan 8.360 nan 0.000 0.452 1420 K N 1.091 121.486 120.400 -0.008 0.000 2.025 1420 K HA -0.178 4.141 4.320 -0.001 0.000 0.207 1420 K C 2.022 178.614 176.600 -0.014 0.000 1.049 1420 K CA 1.668 57.947 56.287 -0.014 0.000 0.933 1420 K CB -0.090 32.397 32.500 -0.022 0.000 0.714 1420 K HN 0.062 nan 8.250 nan 0.000 0.438 1421 E N -0.039 120.153 120.200 -0.014 0.000 2.058 1421 E HA -0.221 4.128 4.350 -0.001 0.000 0.194 1421 E C 1.405 177.999 176.600 -0.010 0.000 0.997 1421 E CA 1.440 57.832 56.400 -0.013 0.000 0.801 1421 E CB -0.045 29.648 29.700 -0.011 0.000 0.746 1421 E HN 0.343 nan 8.360 nan 0.000 0.450 1422 N N 0.237 118.932 118.700 -0.008 0.000 2.309 1422 N HA -0.126 4.614 4.740 -0.001 0.000 0.182 1422 N C 1.941 177.447 175.510 -0.006 0.000 1.018 1422 N CA 1.340 54.386 53.050 -0.006 0.000 0.876 1422 N CB -0.324 38.160 38.487 -0.005 0.000 0.972 1422 N HN 0.203 nan 8.380 nan 0.000 0.434 1423 S N 0.249 115.945 115.700 -0.007 0.000 2.428 1423 S HA -0.042 4.427 4.470 -0.001 0.000 0.230 1423 S C 1.087 175.682 174.600 -0.008 0.000 1.014 1423 S CA 0.705 58.901 58.200 -0.007 0.000 0.957 1423 S CB -0.078 63.118 63.200 -0.007 0.000 0.784 1423 S HN 0.029 nan 8.310 nan 0.000 0.499 1424 D N 1.679 122.073 120.400 -0.010 0.000 2.371 1424 D HA 0.086 4.726 4.640 -0.001 0.000 0.234 1424 D C 1.405 177.699 176.300 -0.009 0.000 1.049 1424 D CA 0.422 54.416 54.000 -0.011 0.000 0.907 1424 D CB -0.039 40.752 40.800 -0.014 0.000 0.891 1424 D HN 0.588 nan 8.370 nan 0.000 0.531 1425 R N -0.717 119.778 120.500 -0.008 0.000 2.509 1425 R HA 0.288 4.627 4.340 -0.001 0.000 0.297 1425 R C 1.488 177.785 176.300 -0.006 0.000 0.951 1425 R CA -0.056 56.040 56.100 -0.007 0.000 1.103 1425 R CB 0.742 31.039 30.300 -0.006 0.000 1.283 1425 R HN 0.097 nan 8.270 nan 0.000 0.534 1426 L N 0.388 121.608 121.223 -0.005 0.000 2.554 1426 L HA 0.182 4.522 4.340 -0.001 0.000 0.225 1426 L C 1.080 177.947 176.870 -0.005 0.000 1.104 1426 L CA 0.207 55.044 54.840 -0.005 0.000 0.866 1426 L CB 0.271 42.328 42.059 -0.004 0.000 1.047 1426 L HN 0.169 nan 8.230 nan 0.000 0.468 1427 E N 0.000 120.197 120.200 -0.006 0.000 2.725 1427 E HA 0.000 4.349 4.350 -0.001 0.000 0.291 1427 E CA 0.000 56.397 56.400 -0.006 0.000 0.976 1427 E CB 0.000 29.696 29.700 -0.007 0.000 0.812 1427 E HN 0.000 nan 8.360 nan 0.000 0.440