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 1osv_1_B DATA FIRST_RESID 240 DATA SEQUENCE AELTVDQQTL LDYIMDSYSK QRMPQEITNK ILKEEFSAEE NFLILTEMAT DATA SEQUENCE SHVQILVEFT KRLPGFQTLD HEDQIALLKG SAVEAMFLRS AEIFNKKLPA DATA SEQUENCE GHADLLEERI RKSGISDEYI TPMFSFYKSV GELKMTQEEY ALLTAIVILS DATA SEQUENCE PDRQYIKDRE AVEKLQEPLL DVLQKLCKIY QPENPQHFAC LLGRLTELRT DATA SEQUENCE FNHHHAEMLM SWRVNDHKFT PLLCEIWDV 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 240 A HA 0.000 nan 4.320 nan 0.000 0.244 240 A C 0.000 177.568 177.584 -0.027 0.000 1.274 240 A CA 0.000 52.026 52.037 -0.019 0.000 0.836 240 A CB 0.000 18.986 19.000 -0.023 0.000 0.831 241 E N 0.231 120.419 120.200 -0.021 0.000 3.136 241 E HA 0.368 4.718 4.350 0.000 0.000 0.271 241 E C 0.239 176.816 176.600 -0.039 0.000 1.454 241 E CA -0.572 55.812 56.400 -0.028 0.000 1.194 241 E CB 0.261 29.954 29.700 -0.012 0.000 1.175 241 E HN 0.470 nan 8.360 nan 0.000 0.726 242 L N 1.218 122.415 121.223 -0.044 0.000 2.456 242 L HA 0.045 4.386 4.340 0.000 0.000 0.272 242 L C 0.801 177.652 176.870 -0.031 0.000 1.189 242 L CA 0.555 55.367 54.840 -0.047 0.000 0.846 242 L CB 0.299 42.328 42.059 -0.051 0.000 1.111 242 L HN 0.582 nan 8.230 nan 0.000 0.475 243 T N 0.039 114.574 114.554 -0.031 0.000 2.874 243 T HA 0.283 4.633 4.350 0.000 0.000 0.281 243 T C 1.400 176.090 174.700 -0.017 0.000 0.994 243 T CA -0.744 61.342 62.100 -0.023 0.000 1.015 243 T CB 0.913 69.766 68.868 -0.024 0.000 1.028 243 T HN 0.264 nan 8.240 nan 0.000 0.523 244 V N 1.710 121.616 119.914 -0.013 0.000 2.324 244 V HA -0.212 3.908 4.120 0.000 0.000 0.250 244 V C 2.327 178.415 176.094 -0.010 0.000 1.060 244 V CA 2.447 64.742 62.300 -0.009 0.000 1.042 244 V CB -1.077 30.741 31.823 -0.008 0.000 0.650 244 V HN 0.917 nan 8.190 nan 0.000 0.450 245 D N -0.656 119.735 120.400 -0.015 0.000 2.117 245 D HA -0.183 4.457 4.640 0.000 0.000 0.197 245 D C 2.339 178.630 176.300 -0.015 0.000 0.987 245 D CA 1.229 55.218 54.000 -0.018 0.000 0.829 245 D CB -0.206 40.582 40.800 -0.020 0.000 0.961 245 D HN 0.543 nan 8.370 nan 0.000 0.460 246 Q N -0.149 119.641 119.800 -0.018 0.000 2.046 246 Q HA -0.185 4.155 4.340 0.000 0.000 0.200 246 Q C 2.101 178.096 176.000 -0.008 0.000 0.975 246 Q CA 1.002 56.794 55.803 -0.019 0.000 0.836 246 Q CB -0.109 28.607 28.738 -0.036 0.000 0.896 246 Q HN 0.161 nan 8.270 nan 0.000 0.428 247 Q N 0.434 120.230 119.800 -0.006 0.000 2.124 247 Q HA -0.126 4.215 4.340 0.000 0.000 0.202 247 Q C 1.842 177.857 176.000 0.025 0.000 0.977 247 Q CA 1.941 57.748 55.803 0.007 0.000 0.850 247 Q CB -0.246 28.496 28.738 0.006 0.000 0.901 247 Q HN 0.322 nan 8.270 nan 0.000 0.429 248 T N 0.748 115.313 114.554 0.019 0.000 2.674 248 T HA -0.160 4.190 4.350 0.000 0.000 0.265 248 T C 1.576 176.310 174.700 0.057 0.000 1.039 248 T CA 1.305 63.422 62.100 0.028 0.000 1.150 248 T CB -0.449 68.417 68.868 -0.002 0.000 0.864 248 T HN 0.262 nan 8.240 nan 0.000 0.427 249 L N 1.100 122.347 121.223 0.039 0.000 2.017 249 L HA 0.046 4.386 4.340 0.000 0.000 0.208 249 L C 2.219 179.153 176.870 0.106 0.000 1.073 249 L CA 1.489 56.370 54.840 0.068 0.000 0.745 249 L CB -1.029 41.050 42.059 0.034 0.000 0.894 249 L HN 0.169 nan 8.230 nan 0.000 0.432 250 L N -0.194 121.068 121.223 0.064 0.000 2.012 250 L HA -0.238 4.102 4.340 0.000 0.000 0.210 250 L C 2.063 178.983 176.870 0.083 0.000 1.073 250 L CA 2.092 56.967 54.840 0.058 0.000 0.748 250 L CB -1.134 40.937 42.059 0.021 0.000 0.891 250 L HN 0.352 nan 8.230 nan 0.000 0.431 251 D N -1.775 118.678 120.400 0.088 0.000 2.144 251 D HA -0.230 4.410 4.640 0.000 0.000 0.200 251 D C 2.032 178.408 176.300 0.128 0.000 0.978 251 D CA 1.424 55.481 54.000 0.095 0.000 0.833 251 D CB -0.356 40.495 40.800 0.084 0.000 0.961 251 D HN 0.466 nan 8.370 nan 0.000 0.470 252 Y N 1.648 121.961 120.300 0.022 0.000 2.181 252 Y HA -0.188 4.363 4.550 0.000 0.000 0.288 252 Y C 2.126 178.042 175.900 0.028 0.000 1.146 252 Y CA 1.315 59.424 58.100 0.015 0.000 1.164 252 Y CB -0.299 38.158 38.460 -0.006 0.000 0.982 252 Y HN -0.000 nan 8.280 nan 0.000 0.515 253 I N -2.744 117.889 120.570 0.105 0.000 2.286 253 I HA -0.197 3.973 4.170 0.000 0.000 0.245 253 I C 2.041 178.248 176.117 0.150 0.000 1.104 253 I CA 1.388 62.731 61.300 0.073 0.000 1.397 253 I CB -0.957 37.124 38.000 0.135 0.000 1.072 253 I HN 0.039 nan 8.210 nan 0.000 0.417 254 M N 1.098 120.773 119.600 0.125 0.000 2.080 254 M HA -0.226 4.254 4.480 0.000 0.000 0.260 254 M C 2.226 178.611 176.300 0.141 0.000 1.068 254 M CA 1.908 57.299 55.300 0.151 0.000 1.109 254 M CB -1.559 31.105 32.600 0.107 0.000 1.342 254 M HN 0.541 nan 8.290 nan 0.000 0.405 255 D N -0.751 119.683 120.400 0.056 0.000 2.144 255 D HA -0.136 4.504 4.640 0.000 0.000 0.199 255 D C 1.966 178.262 176.300 -0.005 0.000 0.984 255 D CA 1.460 55.466 54.000 0.010 0.000 0.834 255 D CB 0.267 41.045 40.800 -0.035 0.000 0.955 255 D HN 0.294 nan 8.370 nan 0.000 0.465 256 S N -1.407 114.273 115.700 -0.034 0.000 2.414 256 S HA -0.147 4.323 4.470 0.000 0.000 0.227 256 S C 1.828 176.619 174.600 0.318 0.000 1.022 256 S CA 0.286 58.487 58.200 0.002 0.000 0.958 256 S CB -0.402 62.654 63.200 -0.240 0.000 0.797 256 S HN 0.362 nan 8.310 nan 0.000 0.493 257 Y N 2.213 122.664 120.300 0.252 0.000 2.200 257 Y HA 0.022 4.573 4.550 0.000 0.000 0.290 257 Y C 2.513 178.422 175.900 0.015 0.000 1.137 257 Y CA 1.680 59.860 58.100 0.133 0.000 1.163 257 Y CB -0.562 37.943 38.460 0.075 0.000 0.988 257 Y HN 0.261 nan 8.280 nan 0.000 0.518 258 S N -0.300 115.427 115.700 0.045 0.000 2.489 258 S HA -0.084 4.386 4.470 0.000 0.000 0.228 258 S C 1.852 176.413 174.600 -0.064 0.000 0.995 258 S CA 0.564 58.728 58.200 -0.059 0.000 0.934 258 S CB -0.174 63.033 63.200 0.012 0.000 0.771 258 S HN 0.365 nan 8.310 nan 0.000 0.522 259 K N 0.791 121.175 120.400 -0.026 0.000 2.127 259 K HA -0.127 4.193 4.320 0.000 0.000 0.208 259 K C 0.048 176.613 176.600 -0.057 0.000 1.047 259 K CA 1.150 57.418 56.287 -0.032 0.000 0.927 259 K CB 0.135 32.626 32.500 -0.015 0.000 0.716 259 K HN 0.223 nan 8.250 nan 0.000 0.450 260 Q N 0.434 120.177 119.800 -0.095 0.000 2.350 260 Q HA 0.213 4.553 4.340 0.000 0.000 0.255 260 Q C -1.317 174.577 176.000 -0.176 0.000 0.951 260 Q CA -0.364 55.371 55.803 -0.114 0.000 0.751 260 Q CB 2.005 30.685 28.738 -0.096 0.000 1.296 260 Q HN 0.038 nan 8.270 nan 0.000 0.453 261 R N 3.118 123.527 120.500 -0.152 0.000 2.332 261 R HA 0.242 4.583 4.340 0.000 0.000 0.306 261 R C 0.332 176.562 176.300 -0.116 0.000 1.117 261 R CA -0.882 55.116 56.100 -0.170 0.000 1.108 261 R CB 0.362 30.569 30.300 -0.155 0.000 1.126 261 R HN 0.706 nan 8.270 nan 0.000 0.548 262 M N 2.255 121.790 119.600 -0.108 0.000 2.173 262 M HA -0.189 4.292 4.480 0.000 0.000 0.197 262 M C -2.075 174.188 176.300 -0.061 0.000 0.296 262 M CA 0.335 55.593 55.300 -0.070 0.000 0.385 262 M CB -0.959 31.604 32.600 -0.063 0.000 1.141 262 M HN 0.288 nan 8.290 nan 0.000 0.938 263 P HA -0.017 nan 4.420 nan 0.000 0.273 263 P C -0.594 176.680 177.300 -0.043 0.000 1.252 263 P CA 0.463 63.532 63.100 -0.052 0.000 0.809 263 P CB 0.331 31.999 31.700 -0.053 0.000 1.017 264 Q N -0.848 118.931 119.800 -0.036 0.000 2.222 264 Q HA -0.099 4.242 4.340 0.000 0.000 0.308 264 Q C 0.879 176.861 176.000 -0.029 0.000 1.111 264 Q CA 0.283 56.067 55.803 -0.031 0.000 0.691 264 Q CB -1.286 27.432 28.738 -0.033 0.000 0.871 264 Q HN 0.561 nan 8.270 nan 0.000 0.323 265 E N 1.326 121.511 120.200 -0.025 0.000 2.160 265 E HA -0.166 4.184 4.350 0.000 0.000 0.195 265 E C 1.781 178.366 176.600 -0.025 0.000 0.991 265 E CA 1.584 57.970 56.400 -0.023 0.000 0.810 265 E CB -0.183 29.506 29.700 -0.017 0.000 0.742 265 E HN 0.836 nan 8.360 nan 0.000 0.466 266 I N -1.180 119.377 120.570 -0.023 0.000 2.623 266 I HA -0.206 3.964 4.170 0.000 0.000 0.261 266 I C 1.742 177.844 176.117 -0.024 0.000 1.204 266 I CA 1.340 62.627 61.300 -0.022 0.000 1.444 266 I CB -0.266 37.722 38.000 -0.021 0.000 1.094 266 I HN -0.143 nan 8.210 nan 0.000 0.451 267 T N 1.006 115.543 114.554 -0.028 0.000 2.980 267 T HA 0.036 4.386 4.350 0.000 0.000 0.239 267 T C 1.592 176.272 174.700 -0.033 0.000 1.011 267 T CA 1.217 63.300 62.100 -0.029 0.000 1.171 267 T CB -0.400 68.450 68.868 -0.030 0.000 0.873 267 T HN 0.447 nan 8.240 nan 0.000 0.431 268 N N 1.145 119.821 118.700 -0.040 0.000 2.184 268 N HA -0.138 4.602 4.740 0.000 0.000 0.190 268 N C 1.800 177.263 175.510 -0.077 0.000 1.011 268 N CA 0.996 54.010 53.050 -0.060 0.000 0.867 268 N CB -0.022 38.433 38.487 -0.054 0.000 0.993 268 N HN 0.367 nan 8.380 nan 0.000 0.433 269 K N 0.720 121.089 120.400 -0.052 0.000 2.116 269 K HA 0.068 4.388 4.320 0.000 0.000 0.203 269 K C 1.856 178.436 176.600 -0.034 0.000 1.052 269 K CA 0.530 56.788 56.287 -0.048 0.000 0.952 269 K CB 0.054 32.537 32.500 -0.028 0.000 0.729 269 K HN 0.186 nan 8.250 nan 0.000 0.446 270 I N 1.842 122.399 120.570 -0.022 0.000 2.530 270 I HA -0.233 3.937 4.170 0.000 0.000 0.257 270 I C 2.001 178.119 176.117 0.001 0.000 1.179 270 I CA 0.706 62.004 61.300 -0.004 0.000 1.440 270 I CB -0.140 37.858 38.000 -0.003 0.000 1.087 270 I HN 0.226 nan 8.210 nan 0.000 0.440 271 L N 0.879 122.088 121.223 -0.023 0.000 2.552 271 L HA -0.055 4.286 4.340 0.000 0.000 0.227 271 L C 1.303 178.149 176.870 -0.040 0.000 1.146 271 L CA 1.697 56.522 54.840 -0.025 0.000 0.858 271 L CB -0.395 41.632 42.059 -0.053 0.000 0.969 271 L HN 0.288 nan 8.230 nan 0.000 0.451 272 K N -1.373 119.000 120.400 -0.045 0.000 2.554 272 K HA 0.112 4.432 4.320 0.000 0.000 0.211 272 K C 0.637 177.239 176.600 0.003 0.000 1.226 272 K CA -0.016 56.251 56.287 -0.035 0.000 1.025 272 K CB 1.065 33.511 32.500 -0.090 0.000 1.021 272 K HN -0.028 nan 8.250 nan 0.000 0.600 273 E N 0.528 120.736 120.200 0.013 0.000 2.474 273 E HA 0.097 4.447 4.350 0.000 0.000 0.215 273 E C -0.153 176.479 176.600 0.052 0.000 0.867 273 E CA 0.293 56.709 56.400 0.027 0.000 1.135 273 E CB 0.733 30.441 29.700 0.014 0.000 1.147 273 E HN 0.065 nan 8.360 nan 0.000 0.534 274 E N 0.004 120.243 120.200 0.065 0.000 2.371 274 E HA 0.077 4.427 4.350 0.000 0.000 0.257 274 E C -0.156 176.560 176.600 0.192 0.000 1.134 274 E CA -0.459 56.008 56.400 0.110 0.000 0.919 274 E CB 0.294 30.052 29.700 0.097 0.000 1.025 274 E HN 0.121 nan 8.360 nan 0.000 0.438 275 F N 0.936 120.903 119.950 0.028 0.000 2.635 275 F HA -0.163 4.364 4.527 0.000 0.000 0.379 275 F C 1.100 176.927 175.800 0.045 0.000 1.094 275 F CA 0.375 58.396 58.000 0.035 0.000 1.300 275 F CB 0.548 39.572 39.000 0.040 0.000 1.035 275 F HN 0.150 nan 8.300 nan 0.000 0.581 276 S N 5.508 121.207 115.700 -0.002 0.000 3.700 276 S HA 0.554 5.024 4.470 0.000 0.000 0.192 276 S C 0.109 174.492 174.600 -0.362 0.000 1.430 276 S CA -0.038 58.089 58.200 -0.122 0.000 0.999 276 S CB -0.461 62.723 63.200 -0.026 0.000 1.411 276 S HN 0.765 nan 8.310 nan 0.000 0.491 277 A N 2.027 124.561 122.820 -0.477 0.000 3.708 277 A HA 0.584 4.904 4.320 0.000 0.000 0.178 277 A C 1.165 178.667 177.584 -0.137 0.000 1.050 277 A CA -0.186 51.583 52.037 -0.448 0.000 1.245 277 A CB 0.001 18.544 19.000 -0.763 0.000 1.600 277 A HN 0.476 nan 8.150 nan 0.000 0.697 278 E N 0.270 120.436 120.200 -0.058 0.000 2.489 278 E HA -0.036 4.314 4.350 0.000 0.000 0.193 278 E C 0.893 177.604 176.600 0.185 0.000 1.057 278 E CA 0.574 57.026 56.400 0.087 0.000 0.866 278 E CB -0.016 29.727 29.700 0.071 0.000 0.916 278 E HN 0.575 nan 8.360 nan 0.000 0.500 279 E N 1.038 121.314 120.200 0.125 0.000 2.401 279 E HA -0.119 4.231 4.350 0.000 0.000 0.199 279 E C 0.874 177.563 176.600 0.148 0.000 1.023 279 E CA 0.325 56.824 56.400 0.166 0.000 0.859 279 E CB 0.070 29.874 29.700 0.173 0.000 0.780 279 E HN 0.294 nan 8.360 nan 0.000 0.523 280 N N 0.054 118.847 118.700 0.155 0.000 2.381 280 N HA -0.151 4.589 4.740 0.000 0.000 0.182 280 N C 1.458 177.121 175.510 0.254 0.000 1.025 280 N CA 0.506 53.661 53.050 0.174 0.000 0.888 280 N CB -0.414 38.174 38.487 0.169 0.000 0.965 280 N HN 0.254 nan 8.380 nan 0.000 0.438 281 F N 1.273 121.321 119.950 0.163 0.000 2.206 281 F HA 0.080 4.607 4.527 0.000 0.000 0.298 281 F C 1.912 177.718 175.800 0.011 0.000 1.090 281 F CA 0.711 58.806 58.000 0.158 0.000 1.323 281 F CB -0.153 38.883 39.000 0.059 0.000 1.028 281 F HN -0.104 nan 8.300 nan 0.000 0.492 282 L N -0.103 121.058 121.223 -0.103 0.000 2.072 282 L HA -0.178 4.162 4.340 0.000 0.000 0.205 282 L C 2.474 179.236 176.870 -0.180 0.000 1.079 282 L CA 1.118 55.800 54.840 -0.263 0.000 0.752 282 L CB -0.594 41.371 42.059 -0.156 0.000 0.906 282 L HN 0.167 nan 8.230 nan 0.000 0.436 283 I N -0.143 120.397 120.570 -0.050 0.000 2.113 283 I HA -0.343 3.827 4.170 0.000 0.000 0.238 283 I C 2.465 178.585 176.117 0.005 0.000 1.070 283 I CA 1.537 62.833 61.300 -0.007 0.000 1.332 283 I CB -0.312 37.716 38.000 0.046 0.000 1.044 283 I HN 0.216 nan 8.210 nan 0.000 0.402 284 L N 0.359 121.621 121.223 0.065 0.000 2.079 284 L HA -0.217 4.123 4.340 0.000 0.000 0.210 284 L C 2.764 179.698 176.870 0.107 0.000 1.081 284 L CA 2.071 57.006 54.840 0.159 0.000 0.752 284 L CB -1.041 41.230 42.059 0.352 0.000 0.896 284 L HN 0.469 nan 8.230 nan 0.000 0.433 285 T N -4.174 110.315 114.554 -0.108 0.000 2.985 285 T HA -0.094 4.256 4.350 0.000 0.000 0.266 285 T C 1.578 176.204 174.700 -0.124 0.000 1.076 285 T CA 0.653 62.664 62.100 -0.148 0.000 1.135 285 T CB -0.091 68.483 68.868 -0.490 0.000 0.890 285 T HN 0.351 nan 8.240 nan 0.000 0.480 286 E N 0.825 120.951 120.200 -0.123 0.000 2.072 286 E HA 0.031 4.382 4.350 0.000 0.000 0.190 286 E C 2.202 178.771 176.600 -0.051 0.000 0.982 286 E CA 0.947 57.292 56.400 -0.091 0.000 0.803 286 E CB -0.243 29.407 29.700 -0.083 0.000 0.755 286 E HN 0.518 nan 8.360 nan 0.000 0.453 287 M N 0.535 120.124 119.600 -0.019 0.000 2.086 287 M HA -0.173 4.307 4.480 0.000 0.000 0.261 287 M C 2.540 178.852 176.300 0.020 0.000 1.067 287 M CA 1.554 56.857 55.300 0.005 0.000 1.116 287 M CB -0.306 32.311 32.600 0.028 0.000 1.348 287 M HN 0.116 nan 8.290 nan 0.000 0.407 288 A N 0.019 122.859 122.820 0.032 0.000 1.892 288 A HA -0.200 4.120 4.320 0.000 0.000 0.218 288 A C 2.200 179.742 177.584 -0.070 0.000 1.188 288 A CA 2.510 54.558 52.037 0.018 0.000 0.631 288 A CB -1.356 17.674 19.000 0.050 0.000 0.822 288 A HN 0.488 nan 8.150 nan 0.000 0.447 289 T N -0.507 113.972 114.554 -0.126 0.000 2.684 289 T HA -0.181 4.169 4.350 0.000 0.000 0.267 289 T C 2.295 176.942 174.700 -0.088 0.000 1.036 289 T CA 1.919 63.931 62.100 -0.147 0.000 1.148 289 T CB -0.452 68.340 68.868 -0.126 0.000 0.863 289 T HN 0.587 nan 8.240 nan 0.000 0.436 290 S N 0.492 116.161 115.700 -0.052 0.000 2.359 290 S HA -0.246 4.224 4.470 0.000 0.000 0.224 290 S C 2.078 176.658 174.600 -0.034 0.000 1.035 290 S CA 1.634 59.809 58.200 -0.042 0.000 1.018 290 S CB -0.629 62.552 63.200 -0.032 0.000 0.876 290 S HN 0.696 nan 8.310 nan 0.000 0.448 291 H N 0.605 119.623 119.070 -0.088 0.000 2.422 291 H HA -0.044 4.512 4.556 0.000 0.000 0.298 291 H C 2.012 177.288 175.328 -0.086 0.000 1.098 291 H CA 1.783 57.780 56.048 -0.086 0.000 1.315 291 H CB -0.364 29.358 29.762 -0.067 0.000 1.382 291 H HN 0.349 nan 8.280 nan 0.000 0.523 292 V N 1.352 121.217 119.914 -0.082 0.000 2.244 292 V HA -0.260 3.860 4.120 0.000 0.000 0.244 292 V C 2.847 178.848 176.094 -0.155 0.000 1.042 292 V CA 2.099 64.319 62.300 -0.132 0.000 1.006 292 V CB -0.778 30.966 31.823 -0.131 0.000 0.641 292 V HN 0.430 nan 8.190 nan 0.000 0.446 293 Q N -0.359 119.371 119.800 -0.118 0.000 2.118 293 Q HA -0.278 4.062 4.340 0.000 0.000 0.211 293 Q C 2.161 178.098 176.000 -0.106 0.000 0.998 293 Q CA 2.558 58.305 55.803 -0.094 0.000 0.872 293 Q CB -0.272 28.420 28.738 -0.076 0.000 0.925 293 Q HN 0.665 nan 8.270 nan 0.000 0.414 294 I N 0.271 120.754 120.570 -0.145 0.000 2.394 294 I HA -0.246 3.924 4.170 0.000 0.000 0.251 294 I C 2.294 178.309 176.117 -0.169 0.000 1.136 294 I CA 0.289 61.498 61.300 -0.153 0.000 1.425 294 I CB -0.204 37.684 38.000 -0.187 0.000 1.079 294 I HN 0.309 nan 8.210 nan 0.000 0.425 295 L N 0.680 121.738 121.223 -0.275 0.000 2.017 295 L HA -0.162 4.178 4.340 0.000 0.000 0.208 295 L C 2.406 179.237 176.870 -0.065 0.000 1.073 295 L CA 1.854 56.561 54.840 -0.222 0.000 0.745 295 L CB -0.514 41.380 42.059 -0.276 0.000 0.894 295 L HN -0.023 nan 8.230 nan 0.000 0.432 296 V N -0.194 119.672 119.914 -0.081 0.000 2.407 296 V HA -0.229 3.891 4.120 0.000 0.000 0.248 296 V C 2.651 178.711 176.094 -0.058 0.000 1.055 296 V CA 1.746 64.008 62.300 -0.064 0.000 1.049 296 V CB -0.756 31.039 31.823 -0.046 0.000 0.662 296 V HN 0.467 nan 8.190 nan 0.000 0.455 297 E N -0.485 119.695 120.200 -0.033 0.000 2.106 297 E HA -0.172 4.178 4.350 0.000 0.000 0.192 297 E C 1.977 178.571 176.600 -0.010 0.000 0.984 297 E CA 1.207 57.594 56.400 -0.022 0.000 0.806 297 E CB -0.276 29.413 29.700 -0.018 0.000 0.750 297 E HN 0.682 nan 8.360 nan 0.000 0.458 298 F N 1.649 121.524 119.950 -0.125 0.000 2.325 298 F HA -0.153 4.374 4.527 0.000 0.000 0.299 298 F C 2.412 178.126 175.800 -0.143 0.000 1.090 298 F CA 1.805 59.742 58.000 -0.106 0.000 1.392 298 F CB 0.014 38.973 39.000 -0.068 0.000 1.053 298 F HN 0.009 nan 8.300 nan 0.000 0.521 299 T N -1.425 113.035 114.554 -0.156 0.000 2.939 299 T HA -0.103 4.247 4.350 0.000 0.000 0.254 299 T C 1.830 176.109 174.700 -0.700 0.000 1.041 299 T CA 0.883 62.694 62.100 -0.482 0.000 1.142 299 T CB -0.560 67.976 68.868 -0.555 0.000 0.874 299 T HN 0.445 nan 8.240 nan 0.000 0.452 300 K N 0.576 120.732 120.400 -0.406 0.000 2.574 300 K HA 0.104 4.424 4.320 0.000 0.000 0.193 300 K C 2.197 178.782 176.600 -0.025 0.000 1.035 300 K CA 0.574 56.788 56.287 -0.121 0.000 0.982 300 K CB -0.060 32.441 32.500 0.002 0.000 0.795 300 K HN 0.241 nan 8.250 nan 0.000 0.491 301 R N 0.319 120.739 120.500 -0.133 0.000 2.397 301 R HA 0.207 4.547 4.340 0.000 0.000 0.241 301 R C -0.436 175.850 176.300 -0.024 0.000 0.914 301 R CA -0.397 55.663 56.100 -0.067 0.000 1.071 301 R CB 0.427 30.626 30.300 -0.168 0.000 1.116 301 R HN 0.120 nan 8.270 nan 0.000 0.524 302 L N 1.861 123.021 121.223 -0.106 0.000 2.455 302 L HA 0.110 4.450 4.340 0.000 0.000 0.272 302 L C -1.322 175.625 176.870 0.129 0.000 1.174 302 L CA -1.260 53.569 54.840 -0.019 0.000 0.869 302 L CB 0.540 42.586 42.059 -0.020 0.000 1.130 302 L HN -0.112 nan 8.230 nan 0.000 0.474 303 P HA -0.241 nan 4.420 nan 0.000 0.218 303 P C 1.050 178.371 177.300 0.035 0.000 1.018 303 P CA 2.227 65.335 63.100 0.012 0.000 1.016 303 P CB 0.206 31.891 31.700 -0.024 0.000 0.748 304 G N -3.770 105.065 108.800 0.058 0.000 3.233 304 G HA2 -0.038 3.922 3.960 0.000 0.000 0.234 304 G HA3 -0.038 3.922 3.960 0.000 0.000 0.234 304 G C 1.014 175.947 174.900 0.054 0.000 1.137 304 G CA -0.272 44.851 45.100 0.038 0.000 0.763 304 G HN 0.136 nan 8.290 nan 0.000 0.549 305 F N 1.481 121.430 119.950 -0.001 0.000 2.063 305 F HA -0.208 4.319 4.527 0.001 0.000 0.298 305 F C 2.690 178.495 175.800 0.009 0.000 1.109 305 F CA 2.008 60.014 58.000 0.008 0.000 1.212 305 F CB 0.155 39.159 39.000 0.007 0.000 0.973 305 F HN 0.221 nan 8.300 nan 0.000 0.480 306 Q N -1.053 118.822 119.800 0.125 0.000 2.488 306 Q HA -0.111 4.229 4.340 0.000 0.000 0.211 306 Q C 1.832 177.788 176.000 -0.074 0.000 0.967 306 Q CA 1.290 57.113 55.803 0.033 0.000 0.926 306 Q CB -0.151 28.647 28.738 0.099 0.000 0.992 306 Q HN 0.389 nan 8.270 nan 0.000 0.506 307 T N 0.688 115.188 114.554 -0.088 0.000 2.896 307 T HA 0.044 4.394 4.350 0.000 0.000 0.263 307 T C 0.762 175.388 174.700 -0.123 0.000 1.050 307 T CA 0.153 62.202 62.100 -0.086 0.000 1.140 307 T CB 0.047 68.878 68.868 -0.061 0.000 0.877 307 T HN 0.156 nan 8.240 nan 0.000 0.457 308 L N 2.312 123.414 121.223 -0.201 0.000 2.529 308 L HA 0.063 4.403 4.340 0.000 0.000 0.287 308 L C 0.653 177.428 176.870 -0.157 0.000 1.241 308 L CA -0.370 54.343 54.840 -0.212 0.000 0.857 308 L CB -0.061 41.776 42.059 -0.369 0.000 1.113 308 L HN 0.272 nan 8.230 nan 0.000 0.504 309 D N 0.262 120.607 120.400 -0.092 0.000 2.506 309 D HA -0.115 4.525 4.640 0.000 0.000 0.234 309 D C 1.337 177.646 176.300 0.015 0.000 1.143 309 D CA 0.444 54.425 54.000 -0.031 0.000 0.871 309 D CB 0.552 41.346 40.800 -0.011 0.000 1.190 309 D HN 0.499 nan 8.370 nan 0.000 0.459 310 H N 1.515 120.551 119.070 -0.056 0.000 2.265 310 H HA -0.220 4.336 4.556 -0.000 0.000 0.293 310 H C 1.342 176.659 175.328 -0.019 0.000 1.089 310 H CA 1.712 57.740 56.048 -0.034 0.000 1.244 310 H CB 0.419 30.173 29.762 -0.014 0.000 1.355 310 H HN 0.533 nan 8.280 nan 0.000 0.485 311 E N 0.389 120.633 120.200 0.073 0.000 2.110 311 E HA -0.138 4.212 4.350 0.000 0.000 0.193 311 E C 1.740 178.357 176.600 0.029 0.000 0.988 311 E CA 1.314 57.715 56.400 0.001 0.000 0.804 311 E CB -0.149 29.544 29.700 -0.010 0.000 0.745 311 E HN 0.530 nan 8.360 nan 0.000 0.458 312 D N 0.013 120.427 120.400 0.024 0.000 2.312 312 D HA -0.083 4.557 4.640 0.000 0.000 0.211 312 D C 1.617 177.931 176.300 0.024 0.000 0.964 312 D CA 0.540 54.554 54.000 0.024 0.000 0.877 312 D CB -0.025 40.769 40.800 -0.010 0.000 0.924 312 D HN 0.295 nan 8.370 nan 0.000 0.515 313 Q N -0.146 119.658 119.800 0.007 0.000 2.020 313 Q HA -0.034 4.307 4.340 0.000 0.000 0.198 313 Q C 2.239 178.398 176.000 0.264 0.000 0.974 313 Q CA 0.557 56.402 55.803 0.069 0.000 0.829 313 Q CB 0.215 28.987 28.738 0.057 0.000 0.894 313 Q HN 0.277 nan 8.270 nan 0.000 0.433 314 I N 1.009 121.676 120.570 0.161 0.000 2.127 314 I HA -0.284 3.887 4.170 0.000 0.000 0.241 314 I C 2.444 178.644 176.117 0.139 0.000 1.075 314 I CA 1.406 62.781 61.300 0.125 0.000 1.334 314 I CB -1.092 36.929 38.000 0.035 0.000 1.040 314 I HN 0.172 nan 8.210 nan 0.000 0.405 315 A N 0.891 123.789 122.820 0.130 0.000 1.940 315 A HA -0.182 4.138 4.320 0.000 0.000 0.219 315 A C 2.355 180.037 177.584 0.163 0.000 1.176 315 A CA 1.440 53.571 52.037 0.157 0.000 0.631 315 A CB -0.787 18.312 19.000 0.165 0.000 0.814 315 A HN 0.433 nan 8.150 nan 0.000 0.446 316 L N -0.947 120.388 121.223 0.188 0.000 2.156 316 L HA -0.075 4.265 4.340 0.000 0.000 0.208 316 L C 2.542 179.534 176.870 0.204 0.000 1.095 316 L CA 0.347 55.316 54.840 0.215 0.000 0.770 316 L CB -0.352 41.898 42.059 0.319 0.000 0.914 316 L HN 0.378 nan 8.230 nan 0.000 0.439 317 L N 0.421 121.769 121.223 0.208 0.000 1.993 317 L HA -0.162 4.178 4.340 0.000 0.000 0.206 317 L C 2.480 179.423 176.870 0.121 0.000 1.074 317 L CA 1.822 56.749 54.840 0.145 0.000 0.746 317 L CB -0.613 41.528 42.059 0.135 0.000 0.896 317 L HN 0.212 nan 8.230 nan 0.000 0.435 318 K N -0.510 119.963 120.400 0.122 0.000 2.113 318 K HA -0.176 4.145 4.320 0.000 0.000 0.208 318 K C 1.702 178.378 176.600 0.126 0.000 1.047 318 K CA 1.413 57.773 56.287 0.121 0.000 0.928 318 K CB -0.486 32.087 32.500 0.122 0.000 0.716 318 K HN 0.510 nan 8.250 nan 0.000 0.446 319 G N -0.447 108.426 108.800 0.122 0.000 2.920 319 G HA2 -0.111 3.849 3.960 0.000 0.000 0.208 319 G HA3 -0.111 3.849 3.960 0.000 0.000 0.208 319 G C 1.240 176.200 174.900 0.100 0.000 1.159 319 G CA 0.326 45.487 45.100 0.101 0.000 0.784 319 G HN 0.217 nan 8.290 nan 0.000 0.535 320 S N -0.863 114.904 115.700 0.112 0.000 2.549 320 S HA 0.435 4.905 4.470 0.000 0.000 0.225 320 S C 2.504 177.173 174.600 0.114 0.000 1.039 320 S CA 0.980 59.248 58.200 0.114 0.000 0.942 320 S CB -0.039 63.235 63.200 0.123 0.000 0.881 320 S HN 0.417 nan 8.310 nan 0.000 0.503 321 A N 1.891 124.781 122.820 0.117 0.000 1.859 321 A HA -0.154 4.166 4.320 0.000 0.000 0.218 321 A C 2.315 179.963 177.584 0.107 0.000 1.209 321 A CA 2.590 54.710 52.037 0.138 0.000 0.639 321 A CB -1.612 17.488 19.000 0.166 0.000 0.835 321 A HN 1.025 nan 8.150 nan 0.000 0.450 322 V N -1.904 118.016 119.914 0.010 0.000 2.343 322 V HA -0.254 3.866 4.120 0.000 0.000 0.247 322 V C 1.963 177.874 176.094 -0.306 0.000 1.051 322 V CA 2.428 64.536 62.300 -0.319 0.000 1.036 322 V CB -1.246 30.285 31.823 -0.486 0.000 0.654 322 V HN 0.650 nan 8.190 nan 0.000 0.451 323 E N 1.506 121.738 120.200 0.053 0.000 2.110 323 E HA -0.112 4.238 4.350 0.000 0.000 0.193 323 E C 2.428 179.153 176.600 0.208 0.000 0.988 323 E CA 1.344 57.894 56.400 0.249 0.000 0.804 323 E CB -0.421 29.402 29.700 0.205 0.000 0.745 323 E HN 0.728 nan 8.360 nan 0.000 0.458 324 A N 2.107 125.015 122.820 0.147 0.000 1.877 324 A HA -0.190 4.130 4.320 0.000 0.000 0.216 324 A C 2.193 179.879 177.584 0.170 0.000 1.186 324 A CA 1.378 53.527 52.037 0.186 0.000 0.620 324 A CB -0.505 18.610 19.000 0.192 0.000 0.822 324 A HN 0.190 nan 8.150 nan 0.000 0.443 325 M N -0.841 118.779 119.600 0.034 0.000 2.108 325 M HA -0.152 4.328 4.480 0.000 0.000 0.261 325 M C 1.973 178.194 176.300 -0.131 0.000 1.066 325 M CA 1.843 56.983 55.300 -0.266 0.000 1.107 325 M CB -0.814 31.594 32.600 -0.319 0.000 1.356 325 M HN 0.488 nan 8.290 nan 0.000 0.406 326 F N -0.020 120.023 119.950 0.155 0.000 2.146 326 F HA -0.238 4.289 4.527 0.000 0.000 0.298 326 F C 2.424 178.388 175.800 0.274 0.000 1.096 326 F CA 0.654 58.821 58.000 0.278 0.000 1.275 326 F CB -0.444 38.796 39.000 0.399 0.000 1.008 326 F HN 0.124 nan 8.300 nan 0.000 0.480 327 L N -0.074 121.413 121.223 0.439 0.000 2.017 327 L HA -0.258 4.082 4.340 0.000 0.000 0.208 327 L C 2.742 179.775 176.870 0.273 0.000 1.073 327 L CA 1.211 56.281 54.840 0.383 0.000 0.745 327 L CB -0.333 41.919 42.059 0.321 0.000 0.894 327 L HN 0.070 nan 8.230 nan 0.000 0.432 328 R N 0.135 120.728 120.500 0.155 0.000 2.083 328 R HA -0.151 4.189 4.340 0.000 0.000 0.237 328 R C 2.273 178.477 176.300 -0.160 0.000 1.137 328 R CA 2.194 58.301 56.100 0.012 0.000 0.951 328 R CB -0.864 29.428 30.300 -0.013 0.000 0.851 328 R HN 0.222 nan 8.270 nan 0.000 0.434 329 S N 0.061 115.641 115.700 -0.201 0.000 2.402 329 S HA -0.150 4.320 4.470 0.000 0.000 0.233 329 S C 1.860 176.081 174.600 -0.632 0.000 1.030 329 S CA 1.232 59.151 58.200 -0.467 0.000 1.003 329 S CB -0.391 62.535 63.200 -0.457 0.000 0.813 329 S HN 0.581 nan 8.310 nan 0.000 0.477 330 A N 0.764 123.375 122.820 -0.349 0.000 2.067 330 A HA 0.014 4.334 4.320 0.000 0.000 0.217 330 A C 1.984 179.515 177.584 -0.088 0.000 1.156 330 A CA 1.048 53.003 52.037 -0.137 0.000 0.683 330 A CB -0.299 18.794 19.000 0.154 0.000 0.808 330 A HN 0.544 nan 8.150 nan 0.000 0.455 331 E N -0.082 119.972 120.200 -0.244 0.000 2.033 331 E HA -0.117 4.233 4.350 0.000 0.000 0.189 331 E C 1.747 178.152 176.600 -0.325 0.000 0.979 331 E CA 0.884 56.990 56.400 -0.489 0.000 0.802 331 E CB -0.094 29.165 29.700 -0.735 0.000 0.763 331 E HN 0.457 nan 8.360 nan 0.000 0.449 332 I N 1.002 121.345 120.570 -0.379 0.000 2.039 332 I HA -0.261 3.909 4.170 0.000 0.000 0.233 332 I C 1.294 177.204 176.117 -0.345 0.000 1.040 332 I CA 1.332 62.370 61.300 -0.437 0.000 1.308 332 I CB -1.481 36.079 38.000 -0.733 0.000 1.035 332 I HN 0.011 nan 8.210 nan 0.000 0.392 333 F N 1.162 121.056 119.950 -0.092 0.000 2.535 333 F HA 0.038 4.565 4.527 0.000 0.000 0.332 333 F C 1.833 177.632 175.800 -0.002 0.000 1.208 333 F CA 0.567 58.574 58.000 0.011 0.000 1.330 333 F CB -0.046 38.987 39.000 0.054 0.000 1.167 333 F HN 0.242 nan 8.300 nan 0.000 0.597 334 N N -0.341 118.506 118.700 0.245 0.000 2.951 334 N HA -0.264 4.477 4.740 0.000 0.000 0.218 334 N C 0.232 175.784 175.510 0.070 0.000 0.858 334 N CA 1.077 54.213 53.050 0.143 0.000 1.050 334 N CB -0.714 37.855 38.487 0.137 0.000 1.012 334 N HN 0.543 nan 8.380 nan 0.000 0.611 335 K N 2.577 122.992 120.400 0.024 0.000 2.591 335 K HA -0.130 4.190 4.320 0.000 0.000 0.280 335 K C 1.658 178.257 176.600 -0.001 0.000 0.964 335 K CA 1.142 57.411 56.287 -0.029 0.000 1.014 335 K CB 0.429 32.892 32.500 -0.062 0.000 0.877 335 K HN 0.315 nan 8.250 nan 0.000 0.502 336 K N 3.310 123.703 120.400 -0.011 0.000 2.227 336 K HA -0.284 4.037 4.320 0.000 0.000 0.208 336 K C 1.004 177.602 176.600 -0.002 0.000 1.045 336 K CA 1.858 58.145 56.287 -0.001 0.000 0.931 336 K CB -0.280 32.214 32.500 -0.010 0.000 0.721 336 K HN 0.562 nan 8.250 nan 0.000 0.469 337 L N -2.862 118.353 121.223 -0.013 0.000 1.913 337 L HA -0.097 4.244 4.340 0.000 0.000 0.500 337 L C -2.181 174.653 176.870 -0.060 0.000 0.720 337 L CA 0.745 55.574 54.840 -0.018 0.000 3.206 337 L CB -2.261 39.794 42.059 -0.007 0.000 0.697 337 L HN 0.090 nan 8.230 nan 0.000 0.765 338 P HA 0.167 nan 4.420 nan 0.000 0.267 338 P C 0.629 177.838 177.300 -0.152 0.000 1.158 338 P CA 2.715 65.762 63.100 -0.090 0.000 0.756 338 P CB 0.222 31.887 31.700 -0.058 0.000 0.766 339 A N 2.712 125.393 122.820 -0.232 0.000 3.612 339 A HA -0.001 4.319 4.320 0.000 0.000 0.226 339 A C 1.687 178.754 177.584 -0.862 0.000 0.966 339 A CA 1.258 53.015 52.037 -0.465 0.000 1.801 339 A CB -2.463 16.348 19.000 -0.315 0.000 0.830 339 A HN 1.155 nan 8.150 nan 0.000 0.752 340 G N -0.630 107.925 108.800 -0.409 0.000 2.219 340 G HA2 -0.268 3.692 3.960 0.000 0.000 0.271 340 G HA3 -0.268 3.692 3.960 0.000 0.000 0.271 340 G C 0.168 174.963 174.900 -0.174 0.000 0.991 340 G CA 1.971 46.922 45.100 -0.249 0.000 0.685 340 G HN 2.591 nan 8.290 nan 0.000 0.531 341 H N -3.297 115.794 119.070 0.035 0.000 2.505 341 H HA 0.762 5.318 4.556 0.000 0.000 0.260 341 H C 1.478 176.855 175.328 0.081 0.000 1.168 341 H CA 0.308 56.388 56.048 0.052 0.000 0.945 341 H CB -0.295 29.492 29.762 0.042 0.000 1.800 341 H HN 0.284 nan 8.280 nan 0.000 0.586 342 A N 0.697 123.641 122.820 0.206 0.000 1.897 342 A HA -0.156 4.164 4.320 0.000 0.000 0.215 342 A C 1.739 179.529 177.584 0.343 0.000 1.181 342 A CA 1.464 53.662 52.037 0.268 0.000 0.620 342 A CB -0.229 18.926 19.000 0.258 0.000 0.821 342 A HN 0.406 nan 8.150 nan 0.000 0.443 343 D N -0.151 120.388 120.400 0.232 0.000 2.133 343 D HA -0.200 4.440 4.640 0.000 0.000 0.192 343 D C 1.793 178.184 176.300 0.152 0.000 1.001 343 D CA 1.693 55.790 54.000 0.162 0.000 0.844 343 D CB -0.480 40.380 40.800 0.101 0.000 0.944 343 D HN 0.378 nan 8.370 nan 0.000 0.447 344 L N 0.536 121.859 121.223 0.167 0.000 2.131 344 L HA -0.081 4.259 4.340 0.000 0.000 0.210 344 L C 2.070 179.033 176.870 0.154 0.000 1.092 344 L CA 1.182 56.102 54.840 0.134 0.000 0.759 344 L CB -0.541 41.591 42.059 0.122 0.000 0.903 344 L HN 0.008 nan 8.230 nan 0.000 0.435 345 L N -0.275 121.086 121.223 0.231 0.000 2.072 345 L HA -0.137 4.203 4.340 0.000 0.000 0.205 345 L C 2.480 179.567 176.870 0.362 0.000 1.079 345 L CA 2.027 57.040 54.840 0.289 0.000 0.752 345 L CB -0.783 41.470 42.059 0.322 0.000 0.906 345 L HN 0.537 nan 8.230 nan 0.000 0.436 346 E N -0.597 119.842 120.200 0.398 0.000 2.153 346 E HA -0.298 4.052 4.350 0.000 0.000 0.194 346 E C 2.030 178.625 176.600 -0.008 0.000 0.988 346 E CA 1.431 57.903 56.400 0.120 0.000 0.811 346 E CB -0.141 29.471 29.700 -0.145 0.000 0.746 346 E HN 0.701 nan 8.360 nan 0.000 0.466 347 E N 0.007 120.227 120.200 0.033 0.000 2.107 347 E HA -0.131 4.219 4.350 0.000 0.000 0.191 347 E C 2.203 178.823 176.600 0.035 0.000 0.982 347 E CA 0.559 56.959 56.400 0.001 0.000 0.809 347 E CB 0.170 29.880 29.700 0.017 0.000 0.756 347 E HN 0.201 nan 8.360 nan 0.000 0.459 348 R N 0.061 120.613 120.500 0.087 0.000 2.090 348 R HA -0.035 4.305 4.340 0.000 0.000 0.228 348 R C 2.411 178.790 176.300 0.131 0.000 1.110 348 R CA 0.745 56.905 56.100 0.101 0.000 0.973 348 R CB -0.191 30.181 30.300 0.120 0.000 0.869 348 R HN 0.266 nan 8.270 nan 0.000 0.440 349 I N 0.706 121.372 120.570 0.160 0.000 2.127 349 I HA -0.280 3.890 4.170 0.000 0.000 0.241 349 I C 2.120 178.291 176.117 0.089 0.000 1.075 349 I CA 1.394 62.801 61.300 0.178 0.000 1.334 349 I CB -0.186 37.968 38.000 0.257 0.000 1.040 349 I HN 0.065 nan 8.210 nan 0.000 0.405 350 R N 0.486 120.995 120.500 0.016 0.000 2.377 350 R HA -0.113 4.227 4.340 0.000 0.000 0.207 350 R C 0.887 177.181 176.300 -0.009 0.000 1.075 350 R CA 0.651 56.727 56.100 -0.038 0.000 1.035 350 R CB -0.096 30.135 30.300 -0.116 0.000 0.857 350 R HN 0.181 nan 8.270 nan 0.000 0.475 351 K N 0.089 120.509 120.400 0.033 0.000 3.278 351 K HA 0.141 4.461 4.320 0.000 0.000 0.200 351 K C -1.168 175.489 176.600 0.095 0.000 1.107 351 K CA -0.142 56.167 56.287 0.037 0.000 0.923 351 K CB 0.901 33.407 32.500 0.010 0.000 0.787 351 K HN -0.092 nan 8.250 nan 0.000 0.481 352 S N -1.575 114.210 115.700 0.142 0.000 2.671 352 S HA 0.484 4.955 4.470 0.000 0.000 0.299 352 S C 0.536 175.284 174.600 0.247 0.000 1.116 352 S CA -0.531 57.845 58.200 0.293 0.000 0.912 352 S CB 1.346 64.819 63.200 0.454 0.000 1.130 352 S HN 0.385 nan 8.310 nan 0.000 0.501 353 G N 2.064 111.116 108.800 0.420 0.000 3.297 353 G HA2 0.212 4.172 3.960 0.000 0.000 0.225 353 G HA3 0.212 4.172 3.960 0.000 0.000 0.225 353 G C 0.262 175.224 174.900 0.103 0.000 1.171 353 G CA 0.283 45.562 45.100 0.297 0.000 1.652 353 G HN 0.765 nan 8.290 nan 0.000 0.564 354 I N -2.484 118.020 120.570 -0.110 0.000 2.436 354 I HA 0.556 4.726 4.170 0.000 0.000 0.289 354 I C -0.144 175.919 176.117 -0.091 0.000 1.010 354 I CA -0.821 60.329 61.300 -0.250 0.000 1.098 354 I CB 1.938 39.628 38.000 -0.517 0.000 1.266 354 I HN -0.163 nan 8.210 nan 0.000 0.434 355 S N 4.258 119.926 115.700 -0.054 0.000 2.566 355 S HA -0.004 4.466 4.470 0.000 0.000 0.280 355 S C 0.536 175.138 174.600 0.005 0.000 1.343 355 S CA -0.202 57.991 58.200 -0.012 0.000 1.036 355 S CB 0.602 63.804 63.200 0.002 0.000 0.866 355 S HN 0.709 nan 8.310 nan 0.000 0.526 356 D N 1.130 121.520 120.400 -0.016 0.000 2.312 356 D HA -0.060 4.580 4.640 0.000 0.000 0.211 356 D C 1.694 177.970 176.300 -0.039 0.000 0.964 356 D CA 0.525 54.503 54.000 -0.037 0.000 0.877 356 D CB -0.125 40.643 40.800 -0.053 0.000 0.924 356 D HN 0.770 nan 8.370 nan 0.000 0.515 357 E N -0.493 119.698 120.200 -0.016 0.000 2.077 357 E HA -0.242 4.108 4.350 0.000 0.000 0.193 357 E C 1.723 178.305 176.600 -0.030 0.000 0.989 357 E CA 0.790 57.177 56.400 -0.023 0.000 0.800 357 E CB -0.046 29.656 29.700 0.003 0.000 0.746 357 E HN 0.327 nan 8.360 nan 0.000 0.452 358 Y N 0.831 121.059 120.300 -0.120 0.000 2.176 358 Y HA -0.042 4.508 4.550 0.000 0.000 0.291 358 Y C 2.027 177.828 175.900 -0.165 0.000 1.122 358 Y CA 1.443 59.452 58.100 -0.151 0.000 1.128 358 Y CB -0.186 38.193 38.460 -0.135 0.000 1.005 358 Y HN -0.007 nan 8.280 nan 0.000 0.509 359 I N -0.533 119.991 120.570 -0.077 0.000 2.163 359 I HA -0.385 3.786 4.170 0.000 0.000 0.243 359 I C 2.179 178.228 176.117 -0.114 0.000 1.085 359 I CA 1.946 63.196 61.300 -0.082 0.000 1.347 359 I CB -0.790 37.211 38.000 0.003 0.000 1.044 359 I HN 0.242 nan 8.210 nan 0.000 0.408 360 T N 1.785 116.258 114.554 -0.134 0.000 2.607 360 T HA -0.135 4.215 4.350 0.000 0.000 0.267 360 T C -0.404 174.186 174.700 -0.184 0.000 1.049 360 T CA 2.054 64.075 62.100 -0.131 0.000 1.162 360 T CB -1.564 67.231 68.868 -0.121 0.000 0.863 360 T HN 0.350 nan 8.240 nan 0.000 0.424 361 P HA -0.030 nan 4.420 nan 0.000 0.220 361 P C 1.518 178.506 177.300 -0.521 0.000 1.148 361 P CA 1.032 63.921 63.100 -0.351 0.000 0.803 361 P CB -0.145 31.316 31.700 -0.398 0.000 0.782 362 M N -1.458 117.722 119.600 -0.699 0.000 2.132 362 M HA -0.054 4.426 4.480 0.000 0.000 0.263 362 M C 2.038 177.647 176.300 -1.151 0.000 1.065 362 M CA 1.431 56.109 55.300 -1.036 0.000 1.122 362 M CB -1.725 30.264 32.600 -1.018 0.000 1.365 362 M HN -0.095 nan 8.290 nan 0.000 0.411 363 F N 0.290 119.835 119.950 -0.675 0.000 2.558 363 F HA -0.060 4.468 4.527 0.000 0.000 0.298 363 F C 2.421 178.069 175.800 -0.253 0.000 1.119 363 F CA 0.753 58.489 58.000 -0.439 0.000 1.451 363 F CB -0.463 38.372 39.000 -0.274 0.000 1.091 363 F HN 0.144 nan 8.300 nan 0.000 0.563 364 S N -0.114 115.515 115.700 -0.118 0.000 2.387 364 S HA -0.173 4.297 4.470 0.000 0.000 0.226 364 S C 1.833 176.409 174.600 -0.041 0.000 1.026 364 S CA 0.765 58.931 58.200 -0.057 0.000 0.972 364 S CB -0.755 62.401 63.200 -0.072 0.000 0.814 364 S HN 0.381 nan 8.310 nan 0.000 0.477 365 F N 2.050 121.833 119.950 -0.279 0.000 2.075 365 F HA -0.086 4.441 4.527 0.000 0.000 0.297 365 F C 2.030 177.829 175.800 -0.001 0.000 1.113 365 F CA 1.071 58.975 58.000 -0.161 0.000 1.218 365 F CB -0.813 38.009 39.000 -0.298 0.000 0.984 365 F HN 0.199 nan 8.300 nan 0.000 0.472 366 Y N 0.099 120.310 120.300 -0.148 0.000 2.114 366 Y HA -0.328 4.222 4.550 0.000 0.000 0.282 366 Y C 2.669 178.496 175.900 -0.123 0.000 1.165 366 Y CA 1.347 59.347 58.100 -0.166 0.000 1.148 366 Y CB -0.542 37.846 38.460 -0.119 0.000 0.972 366 Y HN 0.068 nan 8.280 nan 0.000 0.504 367 K N 0.008 120.461 120.400 0.088 0.000 2.097 367 K HA -0.175 4.145 4.320 0.000 0.000 0.205 367 K C 2.509 179.106 176.600 -0.005 0.000 1.050 367 K CA 1.250 57.577 56.287 0.067 0.000 0.938 367 K CB -0.195 32.348 32.500 0.072 0.000 0.718 367 K HN 0.058 nan 8.250 nan 0.000 0.442 368 S N -0.269 115.390 115.700 -0.069 0.000 2.368 368 S HA -0.089 4.381 4.470 0.000 0.000 0.224 368 S C 1.835 176.350 174.600 -0.143 0.000 1.029 368 S CA 1.207 59.352 58.200 -0.092 0.000 0.988 368 S CB -0.149 63.002 63.200 -0.082 0.000 0.838 368 S HN 0.188 nan 8.310 nan 0.000 0.462 369 V N 1.660 121.409 119.914 -0.276 0.000 2.237 369 V HA -0.087 4.033 4.120 0.000 0.000 0.245 369 V C 2.785 178.838 176.094 -0.067 0.000 1.046 369 V CA 1.911 64.063 62.300 -0.246 0.000 1.007 369 V CB -1.653 29.957 31.823 -0.356 0.000 0.638 369 V HN 0.620 nan 8.190 nan 0.000 0.445 370 G N -0.834 107.971 108.800 0.009 0.000 2.549 370 G HA2 -0.323 3.637 3.960 0.000 0.000 0.222 370 G HA3 -0.323 3.637 3.960 0.000 0.000 0.222 370 G C 1.469 176.402 174.900 0.056 0.000 1.100 370 G CA 1.032 46.180 45.100 0.079 0.000 0.739 370 G HN 0.634 nan 8.290 nan 0.000 0.577 371 E N -0.265 119.946 120.200 0.018 0.000 2.208 371 E HA 0.045 4.395 4.350 0.000 0.000 0.193 371 E C 1.851 178.467 176.600 0.026 0.000 0.988 371 E CA 0.054 56.466 56.400 0.019 0.000 0.828 371 E CB -0.147 29.553 29.700 -0.001 0.000 0.763 371 E HN 0.456 nan 8.360 nan 0.000 0.478 372 L N 1.212 122.441 121.223 0.010 0.000 2.660 372 L HA 0.078 4.418 4.340 0.000 0.000 0.238 372 L C 0.232 177.169 176.870 0.112 0.000 1.161 372 L CA -0.052 54.804 54.840 0.027 0.000 0.937 372 L CB -0.331 41.687 42.059 -0.069 0.000 1.122 372 L HN -0.027 nan 8.230 nan 0.000 0.435 373 K N 2.048 122.508 120.400 0.099 0.000 4.756 373 K HA -0.190 4.131 4.320 0.000 0.000 0.273 373 K C -0.133 176.557 176.600 0.151 0.000 0.695 373 K CA 0.630 56.990 56.287 0.121 0.000 0.712 373 K CB -0.486 32.070 32.500 0.093 0.000 2.076 373 K HN 0.350 nan 8.250 nan 0.000 0.384 374 M N 1.595 121.295 119.600 0.167 0.000 2.216 374 M HA 0.085 4.565 4.480 0.000 0.000 0.356 374 M C 1.054 177.505 176.300 0.252 0.000 1.205 374 M CA -0.523 54.861 55.300 0.140 0.000 1.122 374 M CB 0.955 33.457 32.600 -0.163 0.000 1.571 374 M HN 0.393 nan 8.290 nan 0.000 0.464 375 T N -1.344 113.331 114.554 0.202 0.000 2.813 375 T HA 0.044 4.394 4.350 0.000 0.000 0.297 375 T C 0.837 175.710 174.700 0.288 0.000 1.036 375 T CA -0.528 61.703 62.100 0.219 0.000 1.044 375 T CB 1.167 70.166 68.868 0.218 0.000 0.993 375 T HN 0.822 nan 8.240 nan 0.000 0.535 376 Q N 0.256 120.198 119.800 0.236 0.000 2.226 376 Q HA -0.174 4.167 4.340 0.000 0.000 0.204 376 Q C 2.197 178.296 176.000 0.165 0.000 0.975 376 Q CA 1.740 57.687 55.803 0.240 0.000 0.866 376 Q CB -0.077 28.769 28.738 0.180 0.000 0.915 376 Q HN 0.929 nan 8.270 nan 0.000 0.440 377 E N -0.149 120.125 120.200 0.122 0.000 2.106 377 E HA -0.214 4.137 4.350 0.000 0.000 0.192 377 E C 1.501 178.106 176.600 0.008 0.000 0.984 377 E CA 1.051 57.479 56.400 0.048 0.000 0.806 377 E CB -0.246 29.485 29.700 0.052 0.000 0.750 377 E HN 0.458 nan 8.360 nan 0.000 0.458 378 E N 0.284 120.509 120.200 0.041 0.000 2.077 378 E HA -0.167 4.183 4.350 0.000 0.000 0.193 378 E C 1.851 178.405 176.600 -0.077 0.000 0.989 378 E CA 1.191 57.585 56.400 -0.010 0.000 0.800 378 E CB -0.235 29.463 29.700 -0.004 0.000 0.746 378 E HN 0.336 nan 8.360 nan 0.000 0.452 379 Y N 0.517 120.779 120.300 -0.063 0.000 2.181 379 Y HA -0.254 4.296 4.550 0.000 0.000 0.288 379 Y C 2.383 178.067 175.900 -0.360 0.000 1.146 379 Y CA 1.260 59.286 58.100 -0.123 0.000 1.164 379 Y CB -0.221 38.208 38.460 -0.051 0.000 0.982 379 Y HN 0.071 nan 8.280 nan 0.000 0.515 380 A N -0.213 122.331 122.820 -0.460 0.000 1.898 380 A HA -0.132 4.188 4.320 0.000 0.000 0.216 380 A C 2.192 179.635 177.584 -0.234 0.000 1.181 380 A CA 1.446 52.988 52.037 -0.825 0.000 0.620 380 A CB -1.017 17.552 19.000 -0.718 0.000 0.819 380 A HN 0.453 nan 8.150 nan 0.000 0.442 381 L N -0.703 120.462 121.223 -0.097 0.000 1.994 381 L HA -0.187 4.153 4.340 0.000 0.000 0.208 381 L C 2.593 179.483 176.870 0.034 0.000 1.071 381 L CA 1.212 56.058 54.840 0.010 0.000 0.745 381 L CB -0.642 41.427 42.059 0.016 0.000 0.892 381 L HN 0.350 nan 8.230 nan 0.000 0.431 382 L N -0.669 120.555 121.223 0.001 0.000 2.043 382 L HA -0.247 4.093 4.340 0.000 0.000 0.212 382 L C 2.633 179.536 176.870 0.054 0.000 1.075 382 L CA 1.746 56.600 54.840 0.023 0.000 0.752 382 L CB -0.893 41.152 42.059 -0.024 0.000 0.891 382 L HN 0.318 nan 8.230 nan 0.000 0.432 383 T N -0.476 114.095 114.554 0.028 0.000 2.788 383 T HA -0.161 4.189 4.350 0.000 0.000 0.268 383 T C 1.967 176.762 174.700 0.158 0.000 1.044 383 T CA 1.195 63.334 62.100 0.064 0.000 1.139 383 T CB -0.258 68.579 68.868 -0.051 0.000 0.867 383 T HN 0.464 nan 8.240 nan 0.000 0.454 384 A N 1.328 124.272 122.820 0.206 0.000 1.855 384 A HA 0.039 4.359 4.320 0.000 0.000 0.215 384 A C 2.292 179.981 177.584 0.175 0.000 1.191 384 A CA 1.041 53.242 52.037 0.273 0.000 0.613 384 A CB -0.784 18.360 19.000 0.240 0.000 0.829 384 A HN 0.479 nan 8.150 nan 0.000 0.442 385 I N -0.423 120.227 120.570 0.133 0.000 2.151 385 I HA -0.263 3.907 4.170 0.000 0.000 0.243 385 I C 2.404 178.587 176.117 0.110 0.000 1.080 385 I CA 1.363 62.730 61.300 0.112 0.000 1.339 385 I CB -0.459 37.600 38.000 0.097 0.000 1.039 385 I HN 0.161 nan 8.210 nan 0.000 0.409 386 V N 1.290 121.270 119.914 0.110 0.000 2.252 386 V HA -0.311 3.810 4.120 0.000 0.000 0.249 386 V C 2.293 178.461 176.094 0.124 0.000 1.056 386 V CA 2.183 64.549 62.300 0.109 0.000 1.022 386 V CB -0.421 31.473 31.823 0.118 0.000 0.641 386 V HN 0.349 nan 8.190 nan 0.000 0.445 387 I N -0.552 120.106 120.570 0.147 0.000 2.454 387 I HA -0.159 4.011 4.170 0.000 0.000 0.254 387 I C 1.010 177.235 176.117 0.179 0.000 1.156 387 I CA 0.847 62.242 61.300 0.158 0.000 1.433 387 I CB -0.134 37.964 38.000 0.163 0.000 1.082 387 I HN 0.244 nan 8.210 nan 0.000 0.432 388 L N 1.018 122.341 121.223 0.166 0.000 3.064 388 L HA 0.216 4.556 4.340 0.000 0.000 0.233 388 L C 0.354 177.295 176.870 0.119 0.000 1.333 388 L CA 0.202 55.141 54.840 0.165 0.000 1.140 388 L CB -0.830 41.322 42.059 0.156 0.000 1.519 388 L HN -0.065 nan 8.230 nan 0.000 0.493 389 S N 2.892 118.657 115.700 0.108 0.000 2.405 389 S HA 0.189 4.659 4.470 0.000 0.000 0.291 389 S C -1.059 173.581 174.600 0.067 0.000 1.137 389 S CA -0.722 57.524 58.200 0.077 0.000 1.061 389 S CB 0.888 64.128 63.200 0.067 0.000 1.001 389 S HN 0.305 nan 8.310 nan 0.000 0.507 390 P HA -0.071 nan 4.420 nan 0.000 0.225 390 P C 0.098 177.418 177.300 0.033 0.000 1.148 390 P CA 0.956 64.082 63.100 0.043 0.000 0.779 390 P CB 0.229 31.951 31.700 0.036 0.000 0.780 391 D N -0.533 119.883 120.400 0.027 0.000 2.463 391 D HA 0.101 4.742 4.640 0.000 0.000 0.224 391 D C 0.660 176.962 176.300 0.004 0.000 1.174 391 D CA -0.252 53.756 54.000 0.013 0.000 0.829 391 D CB 0.035 40.838 40.800 0.005 0.000 0.993 391 D HN 0.110 nan 8.370 nan 0.000 0.497 392 R N 1.218 121.729 120.500 0.018 0.000 2.594 392 R HA 0.079 4.419 4.340 0.000 0.000 0.272 392 R C 0.478 176.760 176.300 -0.029 0.000 1.074 392 R CA -0.208 55.895 56.100 0.006 0.000 1.105 392 R CB 0.736 31.063 30.300 0.045 0.000 1.008 392 R HN 0.011 nan 8.270 nan 0.000 0.472 393 Q N 2.342 122.069 119.800 -0.120 0.000 2.421 393 Q HA -0.065 4.275 4.340 0.000 0.000 0.255 393 Q C -0.516 175.376 176.000 -0.180 0.000 1.013 393 Q CA 0.503 56.147 55.803 -0.265 0.000 0.895 393 Q CB 0.302 28.709 28.738 -0.552 0.000 1.271 393 Q HN 0.850 nan 8.270 nan 0.000 0.460 394 Y N -0.343 119.970 120.300 0.022 0.000 4.894 394 Y HA -0.251 4.299 4.550 -0.000 0.000 0.270 394 Y C 0.102 176.013 175.900 0.018 0.000 0.930 394 Y CA -0.432 57.680 58.100 0.019 0.000 1.814 394 Y CB -0.962 37.509 38.460 0.020 0.000 1.235 394 Y HN 0.513 nan 8.280 nan 0.000 0.480 395 I N 3.002 123.660 120.570 0.146 0.000 2.587 395 I HA -0.079 4.091 4.170 0.000 0.000 0.284 395 I C 1.248 177.408 176.117 0.072 0.000 1.134 395 I CA 0.743 62.099 61.300 0.093 0.000 1.410 395 I CB 1.238 39.276 38.000 0.063 0.000 1.392 395 I HN 0.281 nan 8.210 nan 0.000 0.545 396 K N 3.182 123.615 120.400 0.055 0.000 2.211 396 K HA -0.002 4.318 4.320 0.000 0.000 0.201 396 K C 0.371 176.985 176.600 0.024 0.000 1.052 396 K CA 0.585 56.895 56.287 0.039 0.000 0.973 396 K CB 0.369 32.887 32.500 0.030 0.000 0.766 396 K HN 0.479 nan 8.250 nan 0.000 0.466 397 D N 1.039 121.449 120.400 0.016 0.000 2.456 397 D HA 0.069 4.709 4.640 0.000 0.000 0.287 397 D C 0.621 176.926 176.300 0.009 0.000 1.186 397 D CA -0.129 53.876 54.000 0.007 0.000 0.916 397 D CB 0.535 41.332 40.800 -0.005 0.000 1.029 397 D HN -0.000 nan 8.370 nan 0.000 0.498 398 R N 1.978 122.487 120.500 0.015 0.000 2.096 398 R HA -0.188 4.152 4.340 0.000 0.000 0.240 398 R C 1.690 177.999 176.300 0.014 0.000 1.139 398 R CA 1.708 57.819 56.100 0.018 0.000 0.952 398 R CB 0.088 30.399 30.300 0.018 0.000 0.854 398 R HN 0.352 nan 8.270 nan 0.000 0.436 399 E N -0.298 119.908 120.200 0.010 0.000 2.118 399 E HA -0.211 4.139 4.350 0.000 0.000 0.195 399 E C 1.782 178.386 176.600 0.006 0.000 0.992 399 E CA 1.265 57.670 56.400 0.009 0.000 0.804 399 E CB -0.134 29.569 29.700 0.006 0.000 0.741 399 E HN 0.522 nan 8.360 nan 0.000 0.458 400 A N 0.410 123.230 122.820 -0.000 0.000 1.877 400 A HA -0.150 4.170 4.320 0.000 0.000 0.216 400 A C 2.410 179.993 177.584 -0.002 0.000 1.186 400 A CA 1.577 53.609 52.037 -0.008 0.000 0.620 400 A CB -0.737 18.249 19.000 -0.023 0.000 0.822 400 A HN 0.230 nan 8.150 nan 0.000 0.443 401 V N 0.049 119.966 119.914 0.004 0.000 2.490 401 V HA -0.246 3.874 4.120 0.000 0.000 0.250 401 V C 2.457 178.574 176.094 0.039 0.000 1.061 401 V CA 2.218 64.533 62.300 0.024 0.000 1.064 401 V CB -0.700 31.144 31.823 0.037 0.000 0.670 401 V HN 0.742 nan 8.190 nan 0.000 0.461 402 E N -0.107 120.111 120.200 0.030 0.000 2.150 402 E HA -0.201 4.149 4.350 0.000 0.000 0.193 402 E C 2.219 178.837 176.600 0.031 0.000 0.985 402 E CA 0.729 57.149 56.400 0.034 0.000 0.814 402 E CB 0.105 29.821 29.700 0.027 0.000 0.752 402 E HN 0.392 nan 8.360 nan 0.000 0.466 403 K N 0.519 120.932 120.400 0.022 0.000 2.057 403 K HA -0.134 4.186 4.320 0.000 0.000 0.207 403 K C 2.219 178.834 176.600 0.024 0.000 1.049 403 K CA 0.904 57.202 56.287 0.017 0.000 0.931 403 K CB -0.447 32.057 32.500 0.007 0.000 0.714 403 K HN 0.287 nan 8.250 nan 0.000 0.440 404 L N 0.995 122.238 121.223 0.033 0.000 2.093 404 L HA -0.190 4.150 4.340 0.000 0.000 0.208 404 L C 2.681 179.587 176.870 0.061 0.000 1.085 404 L CA 1.459 56.327 54.840 0.048 0.000 0.755 404 L CB -0.578 41.522 42.059 0.068 0.000 0.904 404 L HN 0.289 nan 8.230 nan 0.000 0.435 405 Q N 0.207 120.046 119.800 0.066 0.000 2.389 405 Q HA -0.154 4.186 4.340 0.000 0.000 0.204 405 Q C 1.875 177.916 176.000 0.067 0.000 0.944 405 Q CA 0.869 56.717 55.803 0.075 0.000 0.908 405 Q CB -0.039 28.749 28.738 0.083 0.000 1.002 405 Q HN 0.482 nan 8.270 nan 0.000 0.493 406 E N 1.343 121.574 120.200 0.053 0.000 2.031 406 E HA -0.140 4.210 4.350 0.000 0.000 0.193 406 E C -0.612 176.011 176.600 0.039 0.000 0.994 406 E CA 1.410 57.839 56.400 0.048 0.000 0.800 406 E CB -0.480 29.241 29.700 0.034 0.000 0.752 406 E HN 0.448 nan 8.360 nan 0.000 0.447 407 P HA -0.171 nan 4.420 nan 0.000 0.216 407 P C 1.582 178.893 177.300 0.019 0.000 1.150 407 P CA 1.179 64.287 63.100 0.014 0.000 0.837 407 P CB -0.112 31.594 31.700 0.010 0.000 0.786 408 L N -1.024 120.224 121.223 0.042 0.000 2.012 408 L HA -0.173 4.168 4.340 0.000 0.000 0.210 408 L C 2.928 179.832 176.870 0.057 0.000 1.073 408 L CA 1.388 56.260 54.840 0.053 0.000 0.748 408 L CB -1.200 40.905 42.059 0.078 0.000 0.891 408 L HN -0.115 nan 8.230 nan 0.000 0.431 409 L N -0.178 121.098 121.223 0.088 0.000 2.042 409 L HA -0.261 4.079 4.340 0.000 0.000 0.210 409 L C 2.348 179.222 176.870 0.008 0.000 1.076 409 L CA 1.657 56.587 54.840 0.151 0.000 0.749 409 L CB -0.641 41.544 42.059 0.210 0.000 0.893 409 L HN 0.352 nan 8.230 nan 0.000 0.432 410 D N -0.223 120.162 120.400 -0.024 0.000 2.123 410 D HA -0.173 4.467 4.640 0.000 0.000 0.196 410 D C 2.026 178.240 176.300 -0.143 0.000 0.992 410 D CA 1.423 55.363 54.000 -0.100 0.000 0.833 410 D CB 0.041 40.811 40.800 -0.050 0.000 0.954 410 D HN 0.049 nan 8.370 nan 0.000 0.455 411 V N 0.301 120.164 119.914 -0.085 0.000 2.295 411 V HA -0.171 3.950 4.120 0.000 0.000 0.246 411 V C 2.523 178.540 176.094 -0.128 0.000 1.049 411 V CA 1.532 63.778 62.300 -0.090 0.000 1.024 411 V CB -0.727 31.071 31.823 -0.042 0.000 0.648 411 V HN 0.312 nan 8.190 nan 0.000 0.447 412 L N 0.388 121.556 121.223 -0.093 0.000 2.042 412 L HA -0.223 4.118 4.340 0.000 0.000 0.210 412 L C 2.484 179.204 176.870 -0.251 0.000 1.076 412 L CA 2.401 57.198 54.840 -0.072 0.000 0.749 412 L CB -1.019 41.105 42.059 0.108 0.000 0.893 412 L HN 0.470 nan 8.230 nan 0.000 0.432 413 Q N -0.789 118.630 119.800 -0.634 0.000 2.170 413 Q HA -0.270 4.071 4.340 0.000 0.000 0.203 413 Q C 2.262 177.959 176.000 -0.506 0.000 0.976 413 Q CA 1.873 56.994 55.803 -1.138 0.000 0.858 413 Q CB -0.031 27.766 28.738 -1.567 0.000 0.907 413 Q HN 0.558 nan 8.270 nan 0.000 0.433 414 K N -0.461 119.738 120.400 -0.335 0.000 2.076 414 K HA -0.098 4.222 4.320 0.000 0.000 0.204 414 K C 1.934 178.405 176.600 -0.215 0.000 1.051 414 K CA 0.630 56.783 56.287 -0.223 0.000 0.949 414 K CB -0.014 32.384 32.500 -0.169 0.000 0.726 414 K HN 0.127 nan 8.250 nan 0.000 0.443 415 L N 1.262 122.342 121.223 -0.237 0.000 1.990 415 L HA -0.302 4.038 4.340 0.000 0.000 0.213 415 L C 2.312 179.016 176.870 -0.277 0.000 1.072 415 L CA 1.683 56.336 54.840 -0.312 0.000 0.755 415 L CB -0.927 40.965 42.059 -0.278 0.000 0.889 415 L HN 0.352 nan 8.230 nan 0.000 0.432 416 C N -0.728 118.466 119.300 -0.177 0.000 2.398 416 C HA -0.218 4.242 4.460 0.000 0.000 0.276 416 C C 2.525 177.467 174.990 -0.079 0.000 1.222 416 C CA 0.815 59.769 59.018 -0.108 0.000 1.746 416 C CB -0.986 26.787 27.740 0.054 0.000 2.039 416 C HN 0.453 nan 8.230 nan 0.000 0.470 417 K N 0.125 120.472 120.400 -0.088 0.000 2.574 417 K HA -0.018 4.302 4.320 0.000 0.000 0.193 417 K C 1.345 177.924 176.600 -0.036 0.000 1.035 417 K CA 0.613 56.870 56.287 -0.050 0.000 0.982 417 K CB 0.013 32.473 32.500 -0.066 0.000 0.795 417 K HN 0.482 nan 8.250 nan 0.000 0.491 418 I N -1.191 119.344 120.570 -0.058 0.000 3.194 418 I HA -0.091 4.079 4.170 0.000 0.000 0.271 418 I C 1.510 177.749 176.117 0.204 0.000 1.150 418 I CA 1.011 62.314 61.300 0.006 0.000 1.440 418 I CB -0.554 37.377 38.000 -0.115 0.000 1.276 418 I HN 0.138 nan 8.210 nan 0.000 0.457 419 Y N 0.983 121.237 120.300 -0.077 0.000 2.466 419 Y HA 0.172 4.722 4.550 0.000 0.000 0.272 419 Y C 0.407 176.241 175.900 -0.110 0.000 1.169 419 Y CA -0.125 57.924 58.100 -0.085 0.000 1.285 419 Y CB 0.736 39.138 38.460 -0.096 0.000 1.078 419 Y HN 0.181 nan 8.280 nan 0.000 0.523 420 Q N -0.508 119.317 119.800 0.041 0.000 3.316 420 Q HA 0.186 4.526 4.340 0.000 0.000 0.295 420 Q C -2.493 173.520 176.000 0.023 0.000 0.805 420 Q CA -1.269 54.528 55.803 -0.011 0.000 0.914 420 Q CB 1.030 29.690 28.738 -0.130 0.000 1.514 420 Q HN 0.252 nan 8.270 nan 0.000 0.387 421 P HA -0.155 nan 4.420 nan 0.000 0.226 421 P C 1.217 178.537 177.300 0.033 0.000 1.153 421 P CA 1.096 64.214 63.100 0.029 0.000 0.777 421 P CB 0.460 32.176 31.700 0.027 0.000 0.794 422 E N -0.493 119.729 120.200 0.036 0.000 2.250 422 E HA -0.071 4.280 4.350 0.000 0.000 0.192 422 E C 0.548 177.180 176.600 0.052 0.000 0.986 422 E CA 0.692 57.115 56.400 0.038 0.000 0.849 422 E CB -1.124 28.596 29.700 0.033 0.000 0.797 422 E HN 0.273 nan 8.360 nan 0.000 0.482 423 N N 2.301 121.045 118.700 0.074 0.000 3.112 423 N HA 0.147 4.887 4.740 0.000 0.000 0.270 423 N C -1.900 173.684 175.510 0.122 0.000 1.385 423 N CA -1.651 51.460 53.050 0.102 0.000 0.986 423 N CB 0.847 39.423 38.487 0.149 0.000 1.261 423 N HN -0.133 nan 8.380 nan 0.000 0.495 424 P HA -0.118 nan 4.420 nan 0.000 0.240 424 P C 0.171 177.541 177.300 0.116 0.000 1.186 424 P CA 0.884 64.041 63.100 0.095 0.000 0.755 424 P CB 0.367 32.106 31.700 0.064 0.000 0.870 425 Q N -2.215 117.654 119.800 0.115 0.000 2.280 425 Q HA -0.002 4.339 4.340 0.000 0.000 0.228 425 Q C 1.916 177.973 176.000 0.096 0.000 0.857 425 Q CA 0.095 55.949 55.803 0.085 0.000 0.939 425 Q CB -0.715 28.047 28.738 0.039 0.000 1.114 425 Q HN 0.484 nan 8.270 nan 0.000 0.514 426 H N 0.613 119.725 119.070 0.071 0.000 2.321 426 H HA -0.183 4.373 4.556 0.000 0.000 0.295 426 H C 1.585 176.977 175.328 0.107 0.000 1.102 426 H CA 1.637 57.728 56.048 0.073 0.000 1.266 426 H CB -0.087 29.724 29.762 0.081 0.000 1.363 426 H HN 0.187 nan 8.280 nan 0.000 0.492 427 F N 1.117 121.161 119.950 0.156 0.000 2.095 427 F HA -0.148 4.379 4.527 -0.000 0.000 0.298 427 F C 2.668 178.475 175.800 0.013 0.000 1.104 427 F CA 1.631 59.684 58.000 0.089 0.000 1.232 427 F CB -0.962 38.074 39.000 0.060 0.000 0.987 427 F HN 0.215 nan 8.300 nan 0.000 0.475 428 A N -0.586 122.141 122.820 -0.154 0.000 1.902 428 A HA -0.201 4.119 4.320 0.000 0.000 0.217 428 A C 2.396 179.846 177.584 -0.224 0.000 1.181 428 A CA 1.752 53.634 52.037 -0.258 0.000 0.623 428 A CB -1.653 17.284 19.000 -0.105 0.000 0.818 428 A HN 0.553 nan 8.150 nan 0.000 0.443 429 C N -0.581 118.615 119.300 -0.173 0.000 2.425 429 C HA -0.032 4.428 4.460 0.000 0.000 0.277 429 C C 2.607 177.479 174.990 -0.198 0.000 1.280 429 C CA 0.865 59.777 59.018 -0.177 0.000 1.744 429 C CB -1.580 26.042 27.740 -0.197 0.000 1.989 429 C HN 0.616 nan 8.230 nan 0.000 0.491 430 L N 0.331 121.415 121.223 -0.231 0.000 2.017 430 L HA -0.171 4.169 4.340 0.000 0.000 0.208 430 L C 2.600 179.375 176.870 -0.159 0.000 1.073 430 L CA 1.464 56.199 54.840 -0.176 0.000 0.745 430 L CB -0.703 41.301 42.059 -0.091 0.000 0.894 430 L HN 0.358 nan 8.230 nan 0.000 0.432 431 L N -0.393 120.682 121.223 -0.247 0.000 2.083 431 L HA -0.135 4.205 4.340 0.000 0.000 0.209 431 L C 2.676 179.454 176.870 -0.153 0.000 1.083 431 L CA 1.232 55.932 54.840 -0.232 0.000 0.752 431 L CB -1.065 40.766 42.059 -0.380 0.000 0.899 431 L HN 0.332 nan 8.230 nan 0.000 0.433 432 G N -0.166 108.545 108.800 -0.148 0.000 2.459 432 G HA2 -0.248 3.712 3.960 0.000 0.000 0.217 432 G HA3 -0.248 3.712 3.960 0.000 0.000 0.217 432 G C 1.582 176.440 174.900 -0.070 0.000 1.183 432 G CA 0.282 45.320 45.100 -0.104 0.000 0.776 432 G HN 0.174 nan 8.290 nan 0.000 0.552 433 R N 0.127 120.599 120.500 -0.046 0.000 2.159 433 R HA 0.042 4.382 4.340 0.000 0.000 0.237 433 R C 2.471 178.794 176.300 0.038 0.000 1.131 433 R CA 0.416 56.539 56.100 0.039 0.000 0.982 433 R CB -1.223 29.108 30.300 0.051 0.000 0.868 433 R HN 0.448 nan 8.270 nan 0.000 0.453 434 L N 0.423 121.638 121.223 -0.014 0.000 2.093 434 L HA -0.152 4.188 4.340 0.000 0.000 0.208 434 L C 1.775 178.610 176.870 -0.059 0.000 1.085 434 L CA 1.435 56.268 54.840 -0.011 0.000 0.755 434 L CB -0.245 41.800 42.059 -0.023 0.000 0.904 434 L HN 0.167 nan 8.230 nan 0.000 0.435 435 T N -1.282 113.220 114.554 -0.087 0.000 2.812 435 T HA -0.229 4.121 4.350 0.000 0.000 0.264 435 T C 1.627 176.203 174.700 -0.207 0.000 1.042 435 T CA 1.367 63.395 62.100 -0.119 0.000 1.140 435 T CB -0.103 68.704 68.868 -0.103 0.000 0.870 435 T HN 0.398 nan 8.240 nan 0.000 0.445 436 E N 0.964 121.030 120.200 -0.223 0.000 2.097 436 E HA -0.164 4.186 4.350 0.000 0.000 0.196 436 E C 2.144 178.244 176.600 -0.833 0.000 1.000 436 E CA 0.995 57.147 56.400 -0.413 0.000 0.804 436 E CB -0.351 29.209 29.700 -0.233 0.000 0.740 436 E HN 0.403 nan 8.360 nan 0.000 0.454 437 L N 0.166 121.037 121.223 -0.586 0.000 2.051 437 L HA -0.249 4.091 4.340 0.000 0.000 0.214 437 L C 2.676 179.273 176.870 -0.455 0.000 1.076 437 L CA 1.621 56.110 54.840 -0.585 0.000 0.758 437 L CB -0.182 41.837 42.059 -0.066 0.000 0.890 437 L HN 0.108 nan 8.230 nan 0.000 0.433 438 R N -0.731 119.604 120.500 -0.275 0.000 2.148 438 R HA -0.119 4.221 4.340 0.000 0.000 0.227 438 R C 2.230 178.441 176.300 -0.148 0.000 1.103 438 R CA 1.525 57.553 56.100 -0.121 0.000 0.983 438 R CB -0.877 29.381 30.300 -0.070 0.000 0.874 438 R HN 0.525 nan 8.270 nan 0.000 0.451 439 T N -2.169 112.168 114.554 -0.362 0.000 3.007 439 T HA -0.061 4.290 4.350 0.000 0.000 0.270 439 T C 1.579 176.279 174.700 0.000 0.000 1.107 439 T CA 0.884 62.817 62.100 -0.278 0.000 1.118 439 T CB -0.354 68.329 68.868 -0.308 0.000 0.889 439 T HN 0.254 nan 8.240 nan 0.000 0.506 440 F N 1.273 121.173 119.950 -0.083 0.000 2.615 440 F HA 0.177 4.704 4.527 0.000 0.000 0.297 440 F C 2.623 178.550 175.800 0.210 0.000 1.124 440 F CA -0.496 57.458 58.000 -0.077 0.000 1.451 440 F CB -0.381 38.193 39.000 -0.711 0.000 1.103 440 F HN 0.123 nan 8.300 nan 0.000 0.569 441 N N 0.840 119.782 118.700 0.402 0.000 2.018 441 N HA -0.220 4.521 4.740 0.000 0.000 0.196 441 N C 1.561 177.270 175.510 0.330 0.000 1.043 441 N CA 1.904 55.178 53.050 0.373 0.000 0.856 441 N CB -0.614 38.036 38.487 0.272 0.000 1.042 441 N HN 0.321 nan 8.380 nan 0.000 0.423 442 H N 0.360 119.457 119.070 0.045 0.000 2.319 442 H HA -0.054 4.503 4.556 0.000 0.000 0.299 442 H C 2.050 177.359 175.328 -0.031 0.000 1.092 442 H CA 1.399 57.414 56.048 -0.056 0.000 1.302 442 H CB -0.769 28.869 29.762 -0.207 0.000 1.373 442 H HN 0.435 nan 8.280 nan 0.000 0.497 443 H N -0.746 118.512 119.070 0.313 0.000 2.319 443 H HA -0.158 4.398 4.556 0.000 0.000 0.299 443 H C 2.370 177.880 175.328 0.303 0.000 1.092 443 H CA 1.813 58.032 56.048 0.285 0.000 1.302 443 H CB -0.655 29.264 29.762 0.261 0.000 1.373 443 H HN 0.566 nan 8.280 nan 0.000 0.497 444 H N 0.751 120.057 119.070 0.394 0.000 2.353 444 H HA -0.053 4.503 4.556 0.000 0.000 0.300 444 H C 2.273 177.567 175.328 -0.056 0.000 1.090 444 H CA 1.827 57.992 56.048 0.195 0.000 1.327 444 H CB -0.055 29.869 29.762 0.270 0.000 1.383 444 H HN 0.309 nan 8.280 nan 0.000 0.508 445 A N 0.812 123.685 122.820 0.088 0.000 1.908 445 A HA -0.198 4.122 4.320 0.000 0.000 0.218 445 A C 2.310 179.851 177.584 -0.072 0.000 1.181 445 A CA 1.845 53.874 52.037 -0.013 0.000 0.627 445 A CB -0.496 18.507 19.000 0.005 0.000 0.818 445 A HN 0.662 nan 8.150 nan 0.000 0.445 446 E N -1.008 119.173 120.200 -0.032 0.000 2.015 446 E HA -0.187 4.163 4.350 0.000 0.000 0.191 446 E C 2.099 178.641 176.600 -0.096 0.000 0.991 446 E CA 1.156 57.540 56.400 -0.027 0.000 0.802 446 E CB -0.338 29.384 29.700 0.036 0.000 0.759 446 E HN 0.622 nan 8.360 nan 0.000 0.447 447 M N 1.164 120.629 119.600 -0.225 0.000 2.146 447 M HA -0.241 4.239 4.480 0.000 0.000 0.256 447 M C 2.082 178.249 176.300 -0.220 0.000 1.075 447 M CA 1.524 56.572 55.300 -0.420 0.000 1.082 447 M CB -0.430 31.455 32.600 -1.192 0.000 1.355 447 M HN 0.133 nan 8.290 nan 0.000 0.402 448 L N -0.277 120.815 121.223 -0.218 0.000 2.131 448 L HA -0.251 4.090 4.340 0.000 0.000 0.210 448 L C 2.541 179.486 176.870 0.126 0.000 1.092 448 L CA 1.169 56.008 54.840 -0.002 0.000 0.759 448 L CB -0.540 41.420 42.059 -0.165 0.000 0.903 448 L HN 0.412 nan 8.230 nan 0.000 0.435 449 M N -0.876 118.753 119.600 0.048 0.000 2.358 449 M HA -0.130 4.350 4.480 0.000 0.000 0.264 449 M C 2.195 178.549 176.300 0.090 0.000 1.064 449 M CA 1.823 57.166 55.300 0.071 0.000 1.093 449 M CB -0.326 32.295 32.600 0.036 0.000 1.401 449 M HN 0.376 nan 8.290 nan 0.000 0.440 450 S N -1.943 113.814 115.700 0.094 0.000 2.506 450 S HA 0.008 4.478 4.470 0.000 0.000 0.219 450 S C 0.222 174.927 174.600 0.175 0.000 1.031 450 S CA -0.641 57.616 58.200 0.095 0.000 0.911 450 S CB -0.277 62.953 63.200 0.050 0.000 0.812 450 S HN 0.527 nan 8.310 nan 0.000 0.497 451 W N 4.870 126.172 121.300 0.004 0.000 2.397 451 W HA 0.402 5.062 4.660 0.000 0.000 0.327 451 W C 0.850 177.353 176.519 -0.027 0.000 1.421 451 W CA -0.951 56.407 57.345 0.023 0.000 1.288 451 W CB 0.196 29.736 29.460 0.133 0.000 1.312 451 W HN 0.383 nan 8.180 nan 0.000 0.559 452 R N 2.855 123.318 120.500 -0.063 0.000 3.718 452 R HA 0.268 4.608 4.340 0.000 0.000 0.136 452 R C 1.015 176.870 176.300 -0.742 0.000 0.698 452 R CA 0.203 56.055 56.100 -0.413 0.000 1.110 452 R CB -0.129 30.060 30.300 -0.185 0.000 1.594 452 R HN 0.104 nan 8.270 nan 0.000 0.490 453 V N 1.253 120.924 119.914 -0.405 0.000 2.199 453 V HA -0.329 3.792 4.120 0.000 0.000 0.113 453 V C -1.148 174.736 176.094 -0.350 0.000 0.603 453 V CA 1.342 63.420 62.300 -0.369 0.000 1.413 453 V CB -1.464 30.017 31.823 -0.569 0.000 1.568 453 V HN 0.714 nan 8.190 nan 0.000 0.958 454 N N 0.373 118.874 118.700 -0.331 0.000 4.393 454 N HA -0.175 4.565 4.740 0.000 0.000 0.333 454 N C 0.377 175.674 175.510 -0.354 0.000 1.900 454 N CA 1.589 54.477 53.050 -0.270 0.000 3.025 454 N CB -0.377 37.993 38.487 -0.195 0.000 0.337 454 N HN 1.182 nan 8.380 nan 0.000 0.842 455 D N -0.995 119.254 120.400 -0.252 0.000 2.997 455 D HA -0.308 4.332 4.640 0.000 0.000 0.226 455 D C -0.656 175.547 176.300 -0.162 0.000 1.189 455 D CA 1.777 55.644 54.000 -0.222 0.000 0.834 455 D CB -1.944 38.705 40.800 -0.252 0.000 1.105 455 D HN 0.782 nan 8.370 nan 0.000 0.415 456 H N -0.473 118.496 119.070 -0.167 0.000 2.689 456 H HA 0.500 5.056 4.556 0.000 0.000 0.346 456 H C 0.140 175.371 175.328 -0.162 0.000 1.037 456 H CA -1.195 54.781 56.048 -0.119 0.000 1.234 456 H CB 1.346 31.056 29.762 -0.086 0.000 1.572 456 H HN -0.104 nan 8.280 nan 0.000 0.524 457 K N 1.730 122.173 120.400 0.071 0.000 2.240 457 K HA 0.403 4.723 4.320 0.000 0.000 0.237 457 K C -0.777 175.797 176.600 -0.043 0.000 1.027 457 K CA -0.584 55.702 56.287 -0.001 0.000 0.937 457 K CB 1.002 33.535 32.500 0.056 0.000 1.171 457 K HN 0.242 nan 8.250 nan 0.000 0.479 458 F N 0.353 120.359 119.950 0.093 0.000 2.399 458 F HA 0.249 4.776 4.527 0.001 0.000 0.328 458 F C 0.843 176.623 175.800 -0.033 0.000 1.084 458 F CA -0.619 57.391 58.000 0.016 0.000 1.053 458 F CB 1.304 40.334 39.000 0.050 0.000 1.209 458 F HN 0.456 nan 8.300 nan 0.000 0.502 459 T N 0.070 114.700 114.554 0.127 0.000 2.930 459 T HA 0.123 4.473 4.350 0.000 0.000 0.306 459 T C -2.036 172.678 174.700 0.023 0.000 1.045 459 T CA -1.404 60.710 62.100 0.023 0.000 1.134 459 T CB 1.084 69.925 68.868 -0.045 0.000 0.961 459 T HN 0.285 nan 8.240 nan 0.000 0.545 460 P HA -0.156 nan 4.420 nan 0.000 0.216 460 P C 1.722 179.003 177.300 -0.031 0.000 1.157 460 P CA 0.504 63.605 63.100 0.002 0.000 0.880 460 P CB -0.066 31.633 31.700 -0.002 0.000 0.791 461 L N -0.948 120.238 121.223 -0.062 0.000 2.013 461 L HA -0.190 4.150 4.340 0.000 0.000 0.212 461 L C 2.224 178.992 176.870 -0.169 0.000 1.073 461 L CA 1.852 56.632 54.840 -0.100 0.000 0.753 461 L CB -1.418 40.573 42.059 -0.113 0.000 0.890 461 L HN -0.084 nan 8.230 nan 0.000 0.432 462 L N -1.586 119.499 121.223 -0.230 0.000 2.046 462 L HA -0.303 4.037 4.340 0.000 0.000 0.208 462 L C 2.612 179.349 176.870 -0.223 0.000 1.077 462 L CA 1.530 56.116 54.840 -0.424 0.000 0.747 462 L CB -0.750 41.054 42.059 -0.426 0.000 0.896 462 L HN 0.408 nan 8.230 nan 0.000 0.432 463 C N -0.243 119.013 119.300 -0.075 0.000 2.411 463 C HA -0.149 4.312 4.460 0.000 0.000 0.279 463 C C 2.611 177.612 174.990 0.018 0.000 1.288 463 C CA 0.690 59.709 59.018 0.002 0.000 1.764 463 C CB -0.821 26.948 27.740 0.048 0.000 1.974 463 C HN 0.513 nan 8.230 nan 0.000 0.498 464 E N 0.934 121.126 120.200 -0.012 0.000 2.051 464 E HA -0.115 4.235 4.350 0.000 0.000 0.189 464 E C 1.769 178.388 176.600 0.032 0.000 0.979 464 E CA 1.331 57.736 56.400 0.008 0.000 0.803 464 E CB -0.119 29.576 29.700 -0.009 0.000 0.761 464 E HN 0.774 nan 8.360 nan 0.000 0.451 465 I N -2.217 118.350 120.570 -0.005 0.000 3.059 465 I HA -0.009 4.161 4.170 0.000 0.000 0.270 465 I C 1.552 177.835 176.117 0.276 0.000 1.238 465 I CA 0.508 61.848 61.300 0.066 0.000 1.478 465 I CB -0.242 37.750 38.000 -0.013 0.000 1.097 465 I HN 0.056 nan 8.210 nan 0.000 0.455 466 W N 0.714 122.007 121.300 -0.012 0.000 2.726 466 W HA 0.269 4.929 4.660 -0.000 0.000 0.285 466 W C 1.417 177.936 176.519 -0.000 0.000 1.110 466 W CA 0.444 57.792 57.345 0.006 0.000 1.579 466 W CB -0.129 29.316 29.460 -0.026 0.000 1.118 466 W HN 0.192 nan 8.180 nan 0.000 0.556 467 D N -2.955 117.571 120.400 0.209 0.000 4.401 467 D HA -0.136 4.504 4.640 0.000 0.000 0.105 467 D C 0.419 176.765 176.300 0.076 0.000 0.401 467 D CA 0.233 54.300 54.000 0.112 0.000 0.582 467 D CB -0.612 40.246 40.800 0.096 0.000 1.635 467 D HN -0.259 nan 8.370 nan 0.000 0.095 468 V N 0.000 119.945 119.914 0.052 0.000 2.409 468 V HA 0.000 4.120 4.120 0.000 0.000 0.244 468 V CA 0.000 62.341 62.300 0.069 0.000 1.235 468 V CB 0.000 31.837 31.823 0.024 0.000 1.184 468 V HN 0.000 nan 8.190 nan 0.000 0.556