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 1ssm_1_D DATA FIRST_RESID 2 DATA SEQUENCE TLDVWQHIRQ EAKELAENEP XLASFFHSTI LKHQNLGGAL SYLLANKLAN DATA SEQUENCE PIXPAISLRE IIEEAYQSNP SIIDCAACDI QAVRHRDPAV ELWSTPLLYL DATA SEQUENCE KGFHAIQSYR ITHYLWNQNR KSLALYLQNQ ISVAFDVDIH PAAKIGHGIX DATA SEQUENCE FDHATGIVVG ETSVIENDVS ILQGVTLGGT GKESGDRHPK VREGVXIGAG DATA SEQUENCE AKILGNIEVG KYAKIGANSV VLNPVPEYAT AAGVPARIV 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 2 T HA 0.000 nan 4.350 nan 0.000 0.228 2 T C 0.000 174.694 174.700 -0.011 0.000 1.109 2 T CA 0.000 62.082 62.100 -0.030 0.000 1.349 2 T CB 0.000 68.833 68.868 -0.058 0.000 0.612 3 L N 2.500 123.713 121.223 -0.017 0.000 2.127 3 L HA -0.044 4.296 4.340 -0.000 0.000 0.211 3 L C 1.892 178.762 176.870 -0.001 0.000 1.089 3 L CA 2.033 56.883 54.840 0.017 0.000 0.757 3 L CB -1.084 40.972 42.059 -0.005 0.000 0.899 3 L HN 0.342 nan 8.230 nan 0.000 0.434 4 D N -0.773 119.582 120.400 -0.075 0.000 2.162 4 D HA -0.079 4.561 4.640 -0.000 0.000 0.203 4 D C 2.366 178.513 176.300 -0.254 0.000 0.967 4 D CA 0.707 54.602 54.000 -0.176 0.000 0.840 4 D CB 0.166 40.867 40.800 -0.165 0.000 0.972 4 D HN 0.105 nan 8.370 nan 0.000 0.482 5 V N 0.889 120.673 119.914 -0.217 0.000 2.287 5 V HA -0.229 3.891 4.120 -0.000 0.000 0.248 5 V C 2.261 178.287 176.094 -0.113 0.000 1.053 5 V CA 1.512 63.626 62.300 -0.310 0.000 1.027 5 V CB -0.719 31.041 31.823 -0.105 0.000 0.646 5 V HN 0.404 nan 8.190 nan 0.000 0.447 6 W N 0.642 121.834 121.300 -0.181 0.000 2.333 6 W HA -0.248 4.412 4.660 -0.000 0.000 0.316 6 W C 2.631 179.061 176.519 -0.148 0.000 1.215 6 W CA 1.834 59.102 57.345 -0.128 0.000 1.278 6 W CB -0.137 29.264 29.460 -0.098 0.000 1.154 6 W HN 0.271 nan 8.180 nan 0.000 0.486 7 Q N -0.164 119.511 119.800 -0.209 0.000 2.077 7 Q HA -0.265 4.074 4.340 -0.000 0.000 0.206 7 Q C 1.822 177.573 176.000 -0.414 0.000 0.989 7 Q CA 2.169 57.752 55.803 -0.367 0.000 0.853 7 Q CB -1.242 27.311 28.738 -0.309 0.000 0.907 7 Q HN 0.626 nan 8.270 nan 0.000 0.418 8 H N -0.050 118.765 119.070 -0.425 0.000 2.353 8 H HA -0.034 4.522 4.556 -0.000 0.000 0.300 8 H C 2.184 177.328 175.328 -0.308 0.000 1.090 8 H CA 1.186 56.974 56.048 -0.433 0.000 1.327 8 H CB 0.019 29.221 29.762 -0.933 0.000 1.383 8 H HN 0.149 nan 8.280 nan 0.000 0.508 9 I N 0.337 120.782 120.570 -0.209 0.000 2.179 9 I HA -0.287 3.883 4.170 -0.000 0.000 0.242 9 I C 2.401 178.298 176.117 -0.367 0.000 1.088 9 I CA 1.277 62.459 61.300 -0.197 0.000 1.357 9 I CB -0.259 37.653 38.000 -0.147 0.000 1.051 9 I HN 0.244 nan 8.210 nan 0.000 0.409 10 R N 0.213 120.327 120.500 -0.644 0.000 2.091 10 R HA -0.250 4.090 4.340 -0.000 0.000 0.238 10 R C 2.317 178.402 176.300 -0.360 0.000 1.136 10 R CA 1.718 57.447 56.100 -0.618 0.000 0.959 10 R CB -0.381 29.467 30.300 -0.755 0.000 0.856 10 R HN 0.469 nan 8.270 nan 0.000 0.437 11 Q N 0.866 120.495 119.800 -0.285 0.000 2.050 11 Q HA -0.196 4.144 4.340 -0.000 0.000 0.202 11 Q C 1.676 177.585 176.000 -0.151 0.000 0.980 11 Q CA 1.633 57.326 55.803 -0.182 0.000 0.840 11 Q CB 0.142 28.804 28.738 -0.128 0.000 0.898 11 Q HN 0.380 nan 8.270 nan 0.000 0.424 12 E N -0.005 120.121 120.200 -0.123 0.000 2.051 12 E HA -0.207 4.143 4.350 -0.000 0.000 0.192 12 E C 1.922 178.383 176.600 -0.232 0.000 0.991 12 E CA 1.055 57.387 56.400 -0.113 0.000 0.799 12 E CB -0.191 29.486 29.700 -0.037 0.000 0.748 12 E HN 0.482 nan 8.360 nan 0.000 0.449 13 A N 1.320 123.973 122.820 -0.277 0.000 1.972 13 A HA -0.229 4.091 4.320 -0.000 0.000 0.219 13 A C 1.915 179.246 177.584 -0.422 0.000 1.169 13 A CA 1.452 53.238 52.037 -0.419 0.000 0.635 13 A CB -0.286 18.548 19.000 -0.277 0.000 0.810 13 A HN 0.051 nan 8.150 nan 0.000 0.446 14 K N -0.444 119.783 120.400 -0.288 0.000 2.057 14 K HA -0.115 4.205 4.320 -0.000 0.000 0.207 14 K C 1.931 178.421 176.600 -0.184 0.000 1.049 14 K CA 1.443 57.602 56.287 -0.213 0.000 0.931 14 K CB -0.062 32.349 32.500 -0.149 0.000 0.714 14 K HN 0.504 nan 8.250 nan 0.000 0.440 15 E N 0.410 120.498 120.200 -0.187 0.000 2.112 15 E HA -0.114 4.236 4.350 -0.000 0.000 0.190 15 E C 1.999 178.484 176.600 -0.192 0.000 0.979 15 E CA 0.549 56.864 56.400 -0.142 0.000 0.814 15 E CB -0.008 29.631 29.700 -0.103 0.000 0.762 15 E HN 0.111 nan 8.360 nan 0.000 0.460 16 L N 1.254 122.266 121.223 -0.352 0.000 2.012 16 L HA -0.152 4.188 4.340 -0.000 0.000 0.210 16 L C 2.404 179.030 176.870 -0.407 0.000 1.073 16 L CA 1.846 56.387 54.840 -0.499 0.000 0.748 16 L CB -1.439 39.974 42.059 -1.076 0.000 0.891 16 L HN 0.035 nan 8.230 nan 0.000 0.431 17 A N -1.275 121.283 122.820 -0.438 0.000 2.015 17 A HA -0.148 4.172 4.320 -0.000 0.000 0.219 17 A C 2.113 179.744 177.584 0.078 0.000 1.163 17 A CA 1.154 53.216 52.037 0.043 0.000 0.646 17 A CB -0.276 18.764 19.000 0.067 0.000 0.806 17 A HN 0.464 nan 8.150 nan 0.000 0.448 18 E N 0.457 120.654 120.200 -0.005 0.000 2.046 18 E HA -0.146 4.204 4.350 -0.000 0.000 0.190 18 E C 1.331 177.954 176.600 0.038 0.000 0.982 18 E CA 1.317 57.731 56.400 0.023 0.000 0.800 18 E CB -0.467 29.228 29.700 -0.008 0.000 0.756 18 E HN 0.636 nan 8.360 nan 0.000 0.449 19 N N 0.806 119.519 118.700 0.021 0.000 2.512 19 N HA -0.084 4.656 4.740 -0.000 0.000 0.183 19 N C 0.045 175.604 175.510 0.082 0.000 1.073 19 N CA 0.576 53.650 53.050 0.040 0.000 0.911 19 N CB 0.214 38.713 38.487 0.020 0.000 0.964 19 N HN -0.000 nan 8.380 nan 0.000 0.447 20 E N 0.014 120.295 120.200 0.134 0.000 2.580 20 E HA 0.329 4.679 4.350 -0.000 0.000 0.248 20 E C -2.653 174.061 176.600 0.190 0.000 1.018 20 E CA -2.403 54.102 56.400 0.174 0.000 0.775 20 E CB 0.811 30.665 29.700 0.256 0.000 1.378 20 E HN -0.052 nan 8.360 nan 0.000 0.401 24 A N -0.234 122.765 122.820 0.299 0.000 1.933 24 A HA -0.136 4.184 4.320 -0.000 0.000 0.218 24 A C 2.225 180.043 177.584 0.391 0.000 1.175 24 A CA 2.075 54.365 52.037 0.422 0.000 0.628 24 A CB -0.584 18.623 19.000 0.346 0.000 0.814 24 A HN 0.644 nan 8.150 nan 0.000 0.444 25 S N -1.013 114.844 115.700 0.261 0.000 2.399 25 S HA -0.184 4.286 4.470 -0.000 0.000 0.231 25 S C 1.775 176.504 174.600 0.214 0.000 1.022 25 S CA 1.403 59.736 58.200 0.221 0.000 0.983 25 S CB -0.712 62.578 63.200 0.149 0.000 0.803 25 S HN 0.550 nan 8.310 nan 0.000 0.480 26 F N 2.028 121.971 119.950 -0.011 0.000 2.113 26 F HA 0.109 4.636 4.527 -0.000 0.000 0.297 26 F C 1.761 177.486 175.800 -0.125 0.000 1.103 26 F CA 0.795 58.726 58.000 -0.116 0.000 1.248 26 F CB -0.633 38.185 39.000 -0.302 0.000 0.999 26 F HN 0.180 nan 8.300 nan 0.000 0.475 27 F N -0.455 119.504 119.950 0.014 0.000 2.171 27 F HA -0.222 4.305 4.527 0.000 0.000 0.300 27 F C 2.746 178.388 175.800 -0.262 0.000 1.090 27 F CA 1.450 59.329 58.000 -0.202 0.000 1.293 27 F CB -0.719 38.202 39.000 -0.131 0.000 1.013 27 F HN 0.073 nan 8.300 nan 0.000 0.486 28 H N -0.769 118.354 119.070 0.088 0.000 2.326 28 H HA -0.091 4.465 4.556 -0.000 0.000 0.301 28 H C 2.484 177.731 175.328 -0.135 0.000 1.081 28 H CA 1.696 57.738 56.048 -0.011 0.000 1.334 28 H CB -0.484 29.284 29.762 0.010 0.000 1.385 28 H HN 0.147 nan 8.280 nan 0.000 0.504 29 S N -0.126 115.550 115.700 -0.040 0.000 2.368 29 S HA -0.130 4.340 4.470 -0.000 0.000 0.225 29 S C 2.379 176.722 174.600 -0.429 0.000 1.030 29 S CA 1.846 59.893 58.200 -0.256 0.000 0.999 29 S CB -0.222 62.950 63.200 -0.046 0.000 0.844 29 S HN 0.719 nan 8.310 nan 0.000 0.459 30 T N -0.890 113.525 114.554 -0.232 0.000 2.978 30 T HA 0.251 4.601 4.350 -0.000 0.000 0.262 30 T C 1.554 176.340 174.700 0.144 0.000 1.063 30 T CA 0.617 62.666 62.100 -0.084 0.000 1.140 30 T CB -0.132 68.501 68.868 -0.391 0.000 0.886 30 T HN 0.357 nan 8.240 nan 0.000 0.470 31 I N -0.594 120.027 120.570 0.085 0.000 3.746 31 I HA 0.287 4.457 4.170 -0.000 0.000 0.262 31 I C 2.003 178.219 176.117 0.164 0.000 1.153 31 I CA -0.067 61.369 61.300 0.226 0.000 1.395 31 I CB 0.236 38.254 38.000 0.031 0.000 1.589 31 I HN 0.021 nan 8.210 nan 0.000 0.441 32 L N 1.921 123.120 121.223 -0.039 0.000 2.265 32 L HA -0.158 4.182 4.340 -0.000 0.000 0.215 32 L C 2.244 179.118 176.870 0.007 0.000 1.117 32 L CA 1.383 56.192 54.840 -0.052 0.000 0.782 32 L CB -0.594 41.367 42.059 -0.164 0.000 0.914 32 L HN 0.348 nan 8.230 nan 0.000 0.441 33 K N -1.377 118.960 120.400 -0.106 0.000 2.444 33 K HA 0.040 4.360 4.320 -0.000 0.000 0.193 33 K C 0.316 176.757 176.600 -0.266 0.000 1.024 33 K CA 0.011 56.179 56.287 -0.197 0.000 1.077 33 K CB 0.119 32.427 32.500 -0.320 0.000 0.833 33 K HN 0.241 nan 8.250 nan 0.000 0.517 34 H N 1.319 120.464 119.070 0.124 0.000 2.496 34 H HA 0.187 4.743 4.556 -0.000 0.000 0.342 34 H C 0.098 175.580 175.328 0.257 0.000 1.170 34 H CA -0.311 55.821 56.048 0.140 0.000 1.274 34 H CB 1.680 31.517 29.762 0.126 0.000 1.538 34 H HN 0.181 nan 8.280 nan 0.000 0.542 35 Q N 0.702 120.641 119.800 0.232 0.000 2.219 35 Q HA 0.112 4.452 4.340 -0.000 0.000 0.209 35 Q C -0.513 175.474 176.000 -0.023 0.000 0.854 35 Q CA -0.164 55.756 55.803 0.196 0.000 0.960 35 Q CB 0.376 29.165 28.738 0.086 0.000 1.116 35 Q HN 0.647 nan 8.270 nan 0.000 0.500 36 N N -2.271 116.066 118.700 -0.604 0.000 3.545 36 N HA -0.010 4.730 4.740 -0.000 0.000 0.227 36 N C -0.359 174.117 175.510 -1.722 0.000 1.380 36 N CA -0.616 51.638 53.050 -1.326 0.000 0.892 36 N CB 0.132 38.283 38.487 -0.560 0.000 1.441 36 N HN -0.092 nan 8.380 nan 0.000 0.497 37 L N 0.313 120.688 121.223 -1.414 0.000 2.191 37 L HA 0.260 4.600 4.340 -0.000 0.000 0.212 37 L C 1.839 178.408 176.870 -0.501 0.000 1.103 37 L CA 2.527 56.852 54.840 -0.857 0.000 0.769 37 L CB -0.958 40.906 42.059 -0.325 0.000 0.908 37 L HN 0.904 nan 8.230 nan 0.000 0.438 38 G N -1.218 107.325 108.800 -0.428 0.000 2.394 38 G HA2 -0.149 3.811 3.960 -0.000 0.000 0.215 38 G HA3 -0.149 3.811 3.960 -0.000 0.000 0.215 38 G C 1.513 176.366 174.900 -0.079 0.000 1.165 38 G CA 0.452 45.429 45.100 -0.206 0.000 0.784 38 G HN 0.554 nan 8.290 nan 0.000 0.535 39 G N 1.035 109.706 108.800 -0.216 0.000 2.422 39 G HA2 0.071 4.031 3.960 -0.000 0.000 0.218 39 G HA3 0.071 4.031 3.960 -0.000 0.000 0.218 39 G C 1.998 176.595 174.900 -0.505 0.000 1.146 39 G CA 1.518 46.495 45.100 -0.204 0.000 0.769 39 G HN 0.614 nan 8.290 nan 0.000 0.547 40 A N 0.442 122.921 122.820 -0.568 0.000 1.873 40 A HA 0.122 4.442 4.320 -0.000 0.000 0.215 40 A C 2.328 179.829 177.584 -0.140 0.000 1.186 40 A CA 1.572 53.309 52.037 -0.501 0.000 0.616 40 A CB -0.499 18.446 19.000 -0.091 0.000 0.823 40 A HN 0.408 nan 8.150 nan 0.000 0.442 41 L N 0.968 122.170 121.223 -0.035 0.000 2.083 41 L HA -0.141 4.199 4.340 -0.000 0.000 0.209 41 L C 2.738 179.683 176.870 0.125 0.000 1.083 41 L CA 2.781 57.689 54.840 0.112 0.000 0.752 41 L CB -0.664 41.480 42.059 0.142 0.000 0.899 41 L HN 0.518 nan 8.230 nan 0.000 0.433 42 S N -1.894 113.878 115.700 0.120 0.000 2.402 42 S HA -0.270 4.200 4.470 -0.000 0.000 0.229 42 S C 2.149 176.751 174.600 0.003 0.000 1.021 42 S CA 1.126 59.333 58.200 0.011 0.000 0.974 42 S CB -1.199 61.960 63.200 -0.069 0.000 0.800 42 S HN 0.592 nan 8.310 nan 0.000 0.484 43 Y N 1.938 122.170 120.300 -0.113 0.000 2.163 43 Y HA 0.066 4.616 4.550 -0.000 0.000 0.288 43 Y C 2.049 177.943 175.900 -0.010 0.000 1.136 43 Y CA 1.393 59.464 58.100 -0.049 0.000 1.147 43 Y CB -0.398 38.039 38.460 -0.040 0.000 0.987 43 Y HN 0.209 nan 8.280 nan 0.000 0.509 44 L N -0.438 120.836 121.223 0.085 0.000 1.994 44 L HA -0.261 4.079 4.340 -0.000 0.000 0.208 44 L C 2.411 179.244 176.870 -0.061 0.000 1.071 44 L CA 1.506 56.355 54.840 0.015 0.000 0.745 44 L CB -0.586 41.508 42.059 0.058 0.000 0.892 44 L HN 0.287 nan 8.230 nan 0.000 0.431 45 L N -1.072 120.136 121.223 -0.025 0.000 2.093 45 L HA -0.165 4.175 4.340 -0.000 0.000 0.208 45 L C 2.827 179.695 176.870 -0.003 0.000 1.085 45 L CA 0.957 55.806 54.840 0.015 0.000 0.755 45 L CB -0.830 41.254 42.059 0.040 0.000 0.904 45 L HN 0.249 nan 8.230 nan 0.000 0.435 46 A N 0.495 123.278 122.820 -0.062 0.000 1.865 46 A HA -0.238 4.082 4.320 -0.000 0.000 0.217 46 A C 2.123 179.646 177.584 -0.102 0.000 1.191 46 A CA 2.034 54.022 52.037 -0.082 0.000 0.623 46 A CB -0.658 18.274 19.000 -0.114 0.000 0.826 46 A HN 0.442 nan 8.150 nan 0.000 0.444 47 N N -0.159 118.434 118.700 -0.178 0.000 2.120 47 N HA -0.120 4.620 4.740 -0.000 0.000 0.188 47 N C 1.528 176.997 175.510 -0.068 0.000 1.024 47 N CA 1.333 54.285 53.050 -0.164 0.000 0.852 47 N CB -0.205 38.125 38.487 -0.262 0.000 1.003 47 N HN 0.431 nan 8.380 nan 0.000 0.424 48 K N 0.859 121.244 120.400 -0.025 0.000 2.217 48 K HA 0.041 4.361 4.320 -0.000 0.000 0.202 48 K C 1.933 178.483 176.600 -0.083 0.000 1.051 48 K CA 0.448 56.746 56.287 0.018 0.000 0.952 48 K CB -0.096 32.525 32.500 0.201 0.000 0.736 48 K HN 0.260 nan 8.250 nan 0.000 0.453 49 L N 0.844 122.036 121.223 -0.052 0.000 2.529 49 L HA 0.148 4.488 4.340 -0.000 0.000 0.223 49 L C 1.053 177.899 176.870 -0.041 0.000 1.113 49 L CA -0.358 54.430 54.840 -0.087 0.000 0.861 49 L CB -0.180 41.870 42.059 -0.013 0.000 1.012 49 L HN -0.070 nan 8.230 nan 0.000 0.461 50 A N 1.595 124.396 122.820 -0.031 0.000 2.507 50 A HA 0.299 4.619 4.320 -0.000 0.000 0.235 50 A C 0.017 177.597 177.584 -0.007 0.000 1.070 50 A CA 0.277 52.307 52.037 -0.010 0.000 0.768 50 A CB -0.077 18.905 19.000 -0.030 0.000 1.011 50 A HN 0.604 nan 8.150 nan 0.000 0.502 51 N N -0.858 117.851 118.700 0.016 0.000 3.116 51 N HA 0.512 5.252 4.740 -0.000 0.000 0.244 51 N C -2.790 172.731 175.510 0.018 0.000 1.485 51 N CA -1.160 51.898 53.050 0.015 0.000 0.884 51 N CB 0.447 38.951 38.487 0.028 0.000 1.415 51 N HN 0.099 nan 8.380 nan 0.000 0.524 52 P HA 0.044 nan 4.420 nan 0.000 0.219 52 P C -0.085 177.221 177.300 0.010 0.000 1.146 52 P CA 0.980 64.086 63.100 0.010 0.000 0.808 52 P CB 0.136 31.841 31.700 0.008 0.000 0.779 56 A N -0.034 122.766 122.820 -0.033 0.000 1.892 56 A HA -0.202 4.118 4.320 -0.000 0.000 0.218 56 A C 1.901 179.456 177.584 -0.047 0.000 1.188 56 A CA 2.285 54.287 52.037 -0.057 0.000 0.631 56 A CB -1.055 17.890 19.000 -0.092 0.000 0.822 56 A HN 0.623 nan 8.150 nan 0.000 0.447 57 I N -0.462 120.090 120.570 -0.031 0.000 2.361 57 I HA -0.220 3.950 4.170 -0.000 0.000 0.251 57 I C 2.298 178.399 176.117 -0.027 0.000 1.133 57 I CA 1.769 63.058 61.300 -0.019 0.000 1.413 57 I CB 0.015 38.012 38.000 -0.006 0.000 1.073 57 I HN 0.283 nan 8.210 nan 0.000 0.424 58 S N 0.712 116.392 115.700 -0.034 0.000 2.371 58 S HA -0.028 4.442 4.470 -0.000 0.000 0.224 58 S C 1.842 176.412 174.600 -0.049 0.000 1.029 58 S CA 0.991 59.164 58.200 -0.046 0.000 0.978 58 S CB -0.226 62.939 63.200 -0.060 0.000 0.833 58 S HN 0.404 nan 8.310 nan 0.000 0.466 59 L N 1.013 122.212 121.223 -0.040 0.000 2.056 59 L HA -0.022 4.318 4.340 -0.000 0.000 0.207 59 L C 2.757 179.593 176.870 -0.057 0.000 1.078 59 L CA 1.061 55.881 54.840 -0.033 0.000 0.749 59 L CB -0.484 41.573 42.059 -0.003 0.000 0.901 59 L HN 0.239 nan 8.230 nan 0.000 0.433 60 R N 0.483 120.946 120.500 -0.062 0.000 2.103 60 R HA -0.251 4.089 4.340 -0.000 0.000 0.242 60 R C 2.237 178.481 176.300 -0.093 0.000 1.142 60 R CA 1.983 58.036 56.100 -0.079 0.000 0.960 60 R CB -0.156 30.119 30.300 -0.043 0.000 0.858 60 R HN 0.384 nan 8.270 nan 0.000 0.439 61 E N 0.274 120.434 120.200 -0.066 0.000 2.085 61 E HA -0.219 4.131 4.350 -0.000 0.000 0.194 61 E C 1.961 178.511 176.600 -0.083 0.000 0.994 61 E CA 1.561 57.923 56.400 -0.063 0.000 0.801 61 E CB -0.096 29.578 29.700 -0.043 0.000 0.743 61 E HN 0.391 nan 8.360 nan 0.000 0.453 62 I N 0.635 121.158 120.570 -0.078 0.000 2.179 62 I HA -0.292 3.878 4.170 -0.000 0.000 0.242 62 I C 2.370 178.402 176.117 -0.142 0.000 1.088 62 I CA 1.036 62.293 61.300 -0.071 0.000 1.357 62 I CB -0.227 37.749 38.000 -0.040 0.000 1.051 62 I HN 0.189 nan 8.210 nan 0.000 0.409 63 I N 0.503 120.946 120.570 -0.213 0.000 2.226 63 I HA -0.279 3.891 4.170 -0.000 0.000 0.245 63 I C 2.394 178.131 176.117 -0.633 0.000 1.100 63 I CA 1.538 62.579 61.300 -0.432 0.000 1.374 63 I CB -0.436 37.297 38.000 -0.446 0.000 1.057 63 I HN 0.238 nan 8.210 nan 0.000 0.413 64 E N 0.251 120.215 120.200 -0.392 0.000 2.150 64 E HA -0.232 4.118 4.350 -0.000 0.000 0.193 64 E C 2.105 178.589 176.600 -0.194 0.000 0.985 64 E CA 0.708 56.939 56.400 -0.281 0.000 0.814 64 E CB -0.060 29.559 29.700 -0.135 0.000 0.752 64 E HN 0.382 nan 8.360 nan 0.000 0.466 65 E N 1.003 121.101 120.200 -0.169 0.000 2.072 65 E HA -0.167 4.183 4.350 -0.000 0.000 0.191 65 E C 2.016 178.506 176.600 -0.184 0.000 0.985 65 E CA 1.074 57.411 56.400 -0.105 0.000 0.801 65 E CB -0.013 29.664 29.700 -0.039 0.000 0.750 65 E HN 0.191 nan 8.360 nan 0.000 0.452 66 A N 0.430 123.054 122.820 -0.328 0.000 1.902 66 A HA -0.175 4.145 4.320 -0.000 0.000 0.217 66 A C 2.181 179.522 177.584 -0.406 0.000 1.181 66 A CA 1.334 52.950 52.037 -0.701 0.000 0.623 66 A CB -1.102 17.524 19.000 -0.622 0.000 0.818 66 A HN 0.465 nan 8.150 nan 0.000 0.443 67 Y N -0.925 119.193 120.300 -0.305 0.000 2.352 67 Y HA -0.198 4.352 4.550 0.000 0.000 0.292 67 Y C 2.730 178.519 175.900 -0.184 0.000 1.136 67 Y CA 1.074 59.040 58.100 -0.223 0.000 1.227 67 Y CB 0.011 38.374 38.460 -0.162 0.000 0.991 67 Y HN 0.502 nan 8.280 nan 0.000 0.545 68 Q N -0.377 119.416 119.800 -0.012 0.000 2.269 68 Q HA -0.095 4.245 4.340 -0.000 0.000 0.201 68 Q C 1.943 177.923 176.000 -0.034 0.000 0.946 68 Q CA 0.959 56.749 55.803 -0.022 0.000 0.877 68 Q CB 0.158 28.883 28.738 -0.022 0.000 0.963 68 Q HN 0.207 nan 8.270 nan 0.000 0.472 69 S N 0.582 116.236 115.700 -0.076 0.000 2.439 69 S HA 0.022 4.492 4.470 -0.000 0.000 0.224 69 S C 0.423 175.024 174.600 0.001 0.000 1.029 69 S CA 0.393 58.590 58.200 -0.006 0.000 0.946 69 S CB 0.176 63.431 63.200 0.091 0.000 0.797 69 S HN 0.302 nan 8.310 nan 0.000 0.504 70 N N 0.560 119.203 118.700 -0.095 0.000 2.727 70 N HA 0.345 5.085 4.740 -0.000 0.000 0.252 70 N C -2.629 172.849 175.510 -0.055 0.000 1.283 70 N CA -1.936 51.093 53.050 -0.035 0.000 0.782 70 N CB 1.220 39.706 38.487 -0.002 0.000 1.199 70 N HN -0.162 nan 8.380 nan 0.000 0.520 71 P HA -0.172 nan 4.420 nan 0.000 0.216 71 P C 1.210 178.446 177.300 -0.107 0.000 1.150 71 P CA 1.285 64.338 63.100 -0.079 0.000 0.843 71 P CB 0.187 31.852 31.700 -0.058 0.000 0.787 72 S N -1.329 114.332 115.700 -0.065 0.000 2.500 72 S HA -0.137 4.333 4.470 -0.000 0.000 0.239 72 S C 1.865 176.417 174.600 -0.079 0.000 0.989 72 S CA 0.766 58.929 58.200 -0.060 0.000 0.951 72 S CB -1.560 61.631 63.200 -0.015 0.000 0.759 72 S HN 0.095 nan 8.310 nan 0.000 0.523 73 I N 1.011 121.520 120.570 -0.102 0.000 2.286 73 I HA -0.144 4.026 4.170 -0.000 0.000 0.248 73 I C 2.316 178.294 176.117 -0.233 0.000 1.115 73 I CA 1.341 62.569 61.300 -0.120 0.000 1.392 73 I CB -0.343 37.602 38.000 -0.091 0.000 1.065 73 I HN 0.339 nan 8.210 nan 0.000 0.418 74 I N 0.397 120.749 120.570 -0.363 0.000 2.252 74 I HA -0.288 3.882 4.170 -0.000 0.000 0.245 74 I C 2.119 178.123 176.117 -0.188 0.000 1.102 74 I CA 1.238 62.305 61.300 -0.390 0.000 1.385 74 I CB -0.511 37.216 38.000 -0.454 0.000 1.064 74 I HN 0.226 nan 8.210 nan 0.000 0.414 75 D N 0.756 121.067 120.400 -0.148 0.000 2.133 75 D HA -0.198 4.442 4.640 -0.000 0.000 0.195 75 D C 2.273 178.528 176.300 -0.075 0.000 0.997 75 D CA 1.566 55.506 54.000 -0.100 0.000 0.840 75 D CB -0.325 40.416 40.800 -0.097 0.000 0.947 75 D HN 0.413 nan 8.370 nan 0.000 0.452 76 C N 1.151 120.416 119.300 -0.058 0.000 2.435 76 C HA 0.024 4.484 4.460 -0.000 0.000 0.279 76 C C 2.914 177.939 174.990 0.059 0.000 1.321 76 C CA 0.395 59.416 59.018 0.005 0.000 1.752 76 C CB -1.016 26.760 27.740 0.061 0.000 1.959 76 C HN 0.346 nan 8.230 nan 0.000 0.500 77 A N 0.999 123.841 122.820 0.036 0.000 1.877 77 A HA 0.040 4.360 4.320 -0.000 0.000 0.216 77 A C 2.405 180.131 177.584 0.237 0.000 1.186 77 A CA 2.133 54.270 52.037 0.166 0.000 0.620 77 A CB -0.955 18.119 19.000 0.122 0.000 0.822 77 A HN 0.568 nan 8.150 nan 0.000 0.443 78 A N -1.261 121.629 122.820 0.116 0.000 1.933 78 A HA -0.167 4.153 4.320 -0.000 0.000 0.218 78 A C 2.271 179.936 177.584 0.136 0.000 1.175 78 A CA 1.647 53.755 52.037 0.118 0.000 0.628 78 A CB -1.237 17.795 19.000 0.055 0.000 0.814 78 A HN 0.591 nan 8.150 nan 0.000 0.444 79 C N -0.387 118.967 119.300 0.090 0.000 2.435 79 C HA -0.064 4.396 4.460 -0.000 0.000 0.279 79 C C 2.210 177.294 174.990 0.157 0.000 1.321 79 C CA 1.056 60.132 59.018 0.095 0.000 1.752 79 C CB -1.094 26.638 27.740 -0.014 0.000 1.959 79 C HN 0.586 nan 8.230 nan 0.000 0.500 80 D N 0.723 121.239 120.400 0.193 0.000 2.183 80 D HA -0.011 4.629 4.640 -0.000 0.000 0.203 80 D C 1.949 178.350 176.300 0.168 0.000 0.969 80 D CA 0.904 55.034 54.000 0.217 0.000 0.842 80 D CB -0.267 40.722 40.800 0.316 0.000 0.957 80 D HN 0.457 nan 8.370 nan 0.000 0.484 81 I N 1.016 121.668 120.570 0.137 0.000 2.113 81 I HA -0.327 3.843 4.170 -0.000 0.000 0.238 81 I C 3.047 179.181 176.117 0.028 0.000 1.070 81 I CA 1.643 62.943 61.300 -0.001 0.000 1.332 81 I CB -0.875 37.148 38.000 0.038 0.000 1.044 81 I HN 0.039 nan 8.210 nan 0.000 0.402 82 Q N 1.042 120.931 119.800 0.149 0.000 2.133 82 Q HA -0.277 4.063 4.340 -0.000 0.000 0.208 82 Q C 2.402 178.386 176.000 -0.027 0.000 0.991 82 Q CA 2.508 58.357 55.803 0.076 0.000 0.867 82 Q CB -1.381 27.488 28.738 0.219 0.000 0.911 82 Q HN 0.672 nan 8.270 nan 0.000 0.417 83 A N -0.079 122.763 122.820 0.037 0.000 1.851 83 A HA -0.054 4.266 4.320 -0.000 0.000 0.216 83 A C 2.603 180.175 177.584 -0.020 0.000 1.195 83 A CA 2.076 54.129 52.037 0.026 0.000 0.622 83 A CB -0.828 18.213 19.000 0.069 0.000 0.831 83 A HN 0.679 nan 8.150 nan 0.000 0.444 84 V N -0.072 119.826 119.914 -0.027 0.000 2.255 84 V HA -0.310 3.810 4.120 -0.000 0.000 0.247 84 V C 2.650 178.678 176.094 -0.111 0.000 1.051 84 V CA 2.439 64.706 62.300 -0.056 0.000 1.018 84 V CB -0.846 30.936 31.823 -0.069 0.000 0.641 84 V HN 0.588 nan 8.190 nan 0.000 0.445 85 R N -0.960 119.432 120.500 -0.180 0.000 2.115 85 R HA -0.283 4.057 4.340 -0.000 0.000 0.239 85 R C 2.445 178.613 176.300 -0.219 0.000 1.133 85 R CA 2.514 58.447 56.100 -0.277 0.000 0.935 85 R CB -0.788 29.199 30.300 -0.522 0.000 0.853 85 R HN 0.816 nan 8.270 nan 0.000 0.433 86 H N 0.104 119.065 119.070 -0.181 0.000 2.353 86 H HA 0.043 4.599 4.556 -0.000 0.000 0.300 86 H C 2.111 177.396 175.328 -0.072 0.000 1.090 86 H CA 1.621 57.600 56.048 -0.116 0.000 1.327 86 H CB -0.428 29.294 29.762 -0.067 0.000 1.383 86 H HN 0.266 nan 8.280 nan 0.000 0.508 87 R N 0.039 120.506 120.500 -0.053 0.000 2.307 87 R HA 0.022 4.362 4.340 -0.000 0.000 0.199 87 R C -0.465 175.811 176.300 -0.040 0.000 1.000 87 R CA 0.675 56.756 56.100 -0.031 0.000 1.023 87 R CB 0.292 30.588 30.300 -0.008 0.000 0.908 87 R HN 0.477 nan 8.270 nan 0.000 0.473 88 D N 0.152 120.513 120.400 -0.065 0.000 2.420 88 D HA 0.185 4.824 4.640 -0.000 0.000 0.255 88 D C -2.074 174.182 176.300 -0.072 0.000 1.185 88 D CA -2.474 51.489 54.000 -0.062 0.000 0.904 88 D CB 1.802 42.561 40.800 -0.068 0.000 1.102 88 D HN -0.199 nan 8.370 nan 0.000 0.534 89 P HA -0.060 nan 4.420 nan 0.000 0.226 89 P C 0.896 178.163 177.300 -0.055 0.000 1.146 89 P CA 0.620 63.685 63.100 -0.058 0.000 0.773 89 P CB 0.336 32.013 31.700 -0.039 0.000 0.772 90 A N -0.922 121.869 122.820 -0.048 0.000 2.016 90 A HA 0.012 4.332 4.320 -0.000 0.000 0.217 90 A C 1.072 178.626 177.584 -0.051 0.000 1.162 90 A CA 0.736 52.749 52.037 -0.039 0.000 0.662 90 A CB -0.635 18.350 19.000 -0.025 0.000 0.812 90 A HN 0.074 nan 8.150 nan 0.000 0.450 91 V N 2.076 121.945 119.914 -0.074 0.000 2.304 91 V HA 0.142 4.262 4.120 -0.000 0.000 0.262 91 V C 0.490 176.498 176.094 -0.144 0.000 1.061 91 V CA -0.348 61.896 62.300 -0.093 0.000 0.872 91 V CB 0.640 32.400 31.823 -0.105 0.000 1.077 91 V HN 0.527 nan 8.190 nan 0.000 0.480 92 E N 3.929 124.057 120.200 -0.121 0.000 2.140 92 E HA 0.118 4.468 4.350 -0.000 0.000 0.191 92 E C 0.553 177.032 176.600 -0.203 0.000 0.973 92 E CA 0.373 56.682 56.400 -0.152 0.000 0.829 92 E CB 0.390 30.038 29.700 -0.086 0.000 0.781 92 E HN 0.537 nan 8.360 nan 0.000 0.466 93 L N 0.595 121.745 121.223 -0.123 0.000 2.326 93 L HA 0.176 4.516 4.340 -0.000 0.000 0.278 93 L C 0.955 177.762 176.870 -0.105 0.000 1.092 93 L CA -0.692 54.103 54.840 -0.075 0.000 0.810 93 L CB 0.625 42.703 42.059 0.032 0.000 1.153 93 L HN 0.019 nan 8.230 nan 0.000 0.439 94 W N 0.417 121.666 121.300 -0.085 0.000 2.436 94 W HA -0.150 4.509 4.660 -0.000 0.000 0.284 94 W C 2.732 179.198 176.519 -0.087 0.000 1.225 94 W CA 1.049 58.337 57.345 -0.095 0.000 1.271 94 W CB -0.353 29.055 29.460 -0.086 0.000 1.114 94 W HN 0.742 nan 8.180 nan 0.000 0.559 95 S N -1.030 114.767 115.700 0.163 0.000 2.402 95 S HA -0.182 4.288 4.470 -0.000 0.000 0.229 95 S C 1.654 176.264 174.600 0.017 0.000 1.021 95 S CA 1.635 59.880 58.200 0.075 0.000 0.974 95 S CB -1.135 62.100 63.200 0.059 0.000 0.800 95 S HN 0.187 nan 8.310 nan 0.000 0.484 96 T N 4.013 118.607 114.554 0.067 0.000 2.570 96 T HA -0.084 4.266 4.350 -0.000 0.000 0.266 96 T C -0.495 174.210 174.700 0.008 0.000 1.071 96 T CA 2.075 64.260 62.100 0.143 0.000 1.172 96 T CB -1.722 67.235 68.868 0.149 0.000 0.864 96 T HN 0.405 nan 8.240 nan 0.000 0.421 97 P HA -0.088 nan 4.420 nan 0.000 0.215 97 P C 1.708 178.706 177.300 -0.503 0.000 1.163 97 P CA 0.710 63.594 63.100 -0.359 0.000 0.894 97 P CB -0.256 31.119 31.700 -0.542 0.000 0.791 98 L N -1.118 119.801 121.223 -0.507 0.000 1.990 98 L HA -0.195 4.145 4.340 -0.000 0.000 0.213 98 L C 2.208 179.183 176.870 0.176 0.000 1.072 98 L CA 2.003 56.720 54.840 -0.205 0.000 0.755 98 L CB -1.327 40.701 42.059 -0.052 0.000 0.889 98 L HN -0.105 nan 8.230 nan 0.000 0.432 99 L N -2.549 118.663 121.223 -0.018 0.000 2.127 99 L HA -0.111 4.229 4.340 -0.000 0.000 0.203 99 L C 1.905 178.816 176.870 0.069 0.000 1.080 99 L CA 1.044 55.831 54.840 -0.090 0.000 0.768 99 L CB -0.365 41.323 42.059 -0.618 0.000 0.924 99 L HN 0.281 nan 8.230 nan 0.000 0.444 100 Y N -1.435 119.025 120.300 0.267 0.000 2.535 100 Y HA 0.278 4.828 4.550 -0.000 0.000 0.264 100 Y C 0.775 176.698 175.900 0.039 0.000 1.087 100 Y CA -0.679 57.550 58.100 0.214 0.000 1.285 100 Y CB 0.322 38.872 38.460 0.150 0.000 1.200 100 Y HN -0.145 nan 8.280 nan 0.000 0.514 101 L N 3.990 125.193 121.223 -0.033 0.000 2.342 101 L HA 0.152 4.492 4.340 -0.000 0.000 0.285 101 L C 1.396 178.077 176.870 -0.316 0.000 1.095 101 L CA -0.141 54.634 54.840 -0.109 0.000 0.843 101 L CB 0.788 42.812 42.059 -0.058 0.000 1.201 101 L HN 0.322 nan 8.230 nan 0.000 0.445 102 K N 2.084 122.446 120.400 -0.064 0.000 2.281 102 K HA -0.138 4.182 4.320 -0.000 0.000 0.203 102 K C 1.545 178.066 176.600 -0.132 0.000 1.046 102 K CA 1.442 57.712 56.287 -0.028 0.000 0.938 102 K CB -0.095 32.571 32.500 0.277 0.000 0.737 102 K HN 0.690 nan 8.250 nan 0.000 0.458 103 G N 0.927 109.714 108.800 -0.022 0.000 2.396 103 G HA2 -0.221 3.739 3.960 -0.000 0.000 0.214 103 G HA3 -0.221 3.739 3.960 -0.000 0.000 0.214 103 G C 1.216 176.068 174.900 -0.079 0.000 1.166 103 G CA 0.361 45.501 45.100 0.067 0.000 0.793 103 G HN 0.382 nan 8.290 nan 0.000 0.533 104 F N 1.494 121.313 119.950 -0.219 0.000 2.102 104 F HA -0.070 4.457 4.527 -0.000 0.000 0.298 104 F C 2.555 178.221 175.800 -0.222 0.000 1.105 104 F CA 1.994 59.858 58.000 -0.227 0.000 1.239 104 F CB -0.582 38.271 39.000 -0.246 0.000 0.991 104 F HN 0.329 nan 8.300 nan 0.000 0.474 105 H N -0.521 118.307 119.070 -0.404 0.000 2.319 105 H HA -0.099 4.457 4.556 0.000 0.000 0.299 105 H C 2.437 177.318 175.328 -0.744 0.000 1.092 105 H CA 0.893 56.533 56.048 -0.680 0.000 1.302 105 H CB -0.445 28.729 29.762 -0.980 0.000 1.373 105 H HN 0.384 nan 8.280 nan 0.000 0.497 106 A N 1.126 123.606 122.820 -0.567 0.000 1.892 106 A HA -0.194 4.126 4.320 -0.000 0.000 0.218 106 A C 2.398 179.889 177.584 -0.156 0.000 1.188 106 A CA 1.771 53.702 52.037 -0.176 0.000 0.631 106 A CB -0.835 18.196 19.000 0.052 0.000 0.822 106 A HN 0.331 nan 8.150 nan 0.000 0.447 107 I N -0.418 119.949 120.570 -0.339 0.000 2.163 107 I HA -0.313 3.857 4.170 -0.000 0.000 0.243 107 I C 2.677 178.689 176.117 -0.174 0.000 1.085 107 I CA 1.465 62.571 61.300 -0.322 0.000 1.347 107 I CB -0.443 37.258 38.000 -0.499 0.000 1.044 107 I HN 0.296 nan 8.210 nan 0.000 0.408 108 Q N 0.514 120.089 119.800 -0.376 0.000 2.124 108 Q HA -0.137 4.203 4.340 -0.000 0.000 0.202 108 Q C 2.434 178.375 176.000 -0.098 0.000 0.977 108 Q CA 1.757 57.396 55.803 -0.273 0.000 0.850 108 Q CB -0.816 27.670 28.738 -0.421 0.000 0.901 108 Q HN 0.457 nan 8.270 nan 0.000 0.429 109 S N 0.703 116.369 115.700 -0.058 0.000 2.368 109 S HA -0.164 4.306 4.470 -0.000 0.000 0.225 109 S C 1.747 176.364 174.600 0.029 0.000 1.030 109 S CA 1.240 59.464 58.200 0.041 0.000 0.999 109 S CB -0.527 62.769 63.200 0.159 0.000 0.844 109 S HN 0.542 nan 8.310 nan 0.000 0.459 110 Y N 2.949 123.239 120.300 -0.018 0.000 2.165 110 Y HA -0.154 4.396 4.550 -0.000 0.000 0.286 110 Y C 2.144 178.072 175.900 0.046 0.000 1.155 110 Y CA 1.418 59.514 58.100 -0.007 0.000 1.164 110 Y CB -0.490 37.925 38.460 -0.074 0.000 0.978 110 Y HN 0.039 nan 8.280 nan 0.000 0.513 111 R N 0.271 120.376 120.500 -0.659 0.000 2.117 111 R HA -0.178 4.162 4.340 -0.000 0.000 0.243 111 R C 2.287 178.454 176.300 -0.221 0.000 1.143 111 R CA 2.106 57.873 56.100 -0.554 0.000 0.968 111 R CB -0.615 29.576 30.300 -0.182 0.000 0.863 111 R HN 0.451 nan 8.270 nan 0.000 0.444 112 I N 0.395 120.908 120.570 -0.095 0.000 2.252 112 I HA -0.270 3.900 4.170 -0.000 0.000 0.245 112 I C 2.766 178.928 176.117 0.076 0.000 1.102 112 I CA 1.766 63.080 61.300 0.023 0.000 1.385 112 I CB -0.544 37.456 38.000 -0.001 0.000 1.064 112 I HN 0.326 nan 8.210 nan 0.000 0.414 113 T N -2.230 112.325 114.554 0.001 0.000 2.788 113 T HA -0.295 4.055 4.350 -0.000 0.000 0.268 113 T C 1.921 176.686 174.700 0.108 0.000 1.044 113 T CA 1.716 63.858 62.100 0.070 0.000 1.139 113 T CB -0.585 68.327 68.868 0.073 0.000 0.867 113 T HN 0.384 nan 8.240 nan 0.000 0.454 114 H N 0.201 119.170 119.070 -0.168 0.000 2.353 114 H HA -0.056 4.500 4.556 -0.000 0.000 0.300 114 H C 1.956 177.346 175.328 0.105 0.000 1.090 114 H CA 1.924 57.935 56.048 -0.061 0.000 1.327 114 H CB -0.797 28.770 29.762 -0.325 0.000 1.383 114 H HN 0.617 nan 8.280 nan 0.000 0.508 115 Y N 0.386 120.653 120.300 -0.055 0.000 2.145 115 Y HA -0.187 4.363 4.550 -0.000 0.000 0.286 115 Y C 2.088 177.973 175.900 -0.025 0.000 1.145 115 Y CA 1.765 59.831 58.100 -0.055 0.000 1.148 115 Y CB -0.538 37.914 38.460 -0.014 0.000 0.981 115 Y HN 0.204 nan 8.280 nan 0.000 0.507 116 L N -0.658 120.519 121.223 -0.076 0.000 2.017 116 L HA -0.260 4.080 4.340 -0.000 0.000 0.208 116 L C 2.623 179.425 176.870 -0.114 0.000 1.073 116 L CA 1.690 56.435 54.840 -0.159 0.000 0.745 116 L CB -1.024 41.078 42.059 0.072 0.000 0.894 116 L HN 0.533 nan 8.230 nan 0.000 0.432 117 W N 1.690 122.901 121.300 -0.147 0.000 2.335 117 W HA -0.233 4.427 4.660 -0.000 0.000 0.311 117 W C 2.099 178.521 176.519 -0.162 0.000 1.213 117 W CA 1.726 59.007 57.345 -0.108 0.000 1.274 117 W CB -0.359 29.088 29.460 -0.022 0.000 1.148 117 W HN 0.284 nan 8.180 nan 0.000 0.498 118 N N 0.243 118.909 118.700 -0.056 0.000 2.520 118 N HA -0.127 4.613 4.740 -0.000 0.000 0.185 118 N C 1.335 176.712 175.510 -0.222 0.000 1.068 118 N CA 1.085 54.053 53.050 -0.136 0.000 0.911 118 N CB -0.407 37.973 38.487 -0.178 0.000 0.961 118 N HN 0.373 nan 8.380 nan 0.000 0.446 119 Q N -0.007 119.608 119.800 -0.309 0.000 2.198 119 Q HA 0.108 4.448 4.340 -0.000 0.000 0.209 119 Q C -0.172 175.672 176.000 -0.259 0.000 0.848 119 Q CA -0.185 55.432 55.803 -0.309 0.000 0.974 119 Q CB 0.103 28.569 28.738 -0.454 0.000 1.115 119 Q HN 0.162 nan 8.270 nan 0.000 0.494 120 N N 1.564 120.085 118.700 -0.298 0.000 2.714 120 N HA -0.189 4.551 4.740 -0.000 0.000 0.250 120 N C -0.952 174.410 175.510 -0.245 0.000 1.117 120 N CA 0.569 53.428 53.050 -0.319 0.000 0.719 120 N CB -0.688 37.650 38.487 -0.248 0.000 1.081 120 N HN 0.226 nan 8.380 nan 0.000 0.557 121 R N 0.515 120.890 120.500 -0.208 0.000 3.785 121 R HA 0.186 4.526 4.340 -0.000 0.000 0.255 121 R C 1.017 177.266 176.300 -0.086 0.000 1.485 121 R CA -0.371 55.653 56.100 -0.127 0.000 1.555 121 R CB 0.365 30.605 30.300 -0.100 0.000 1.362 121 R HN 0.260 nan 8.270 nan 0.000 0.702 122 K N 0.197 120.514 120.400 -0.139 0.000 2.155 122 K HA -0.095 4.225 4.320 -0.000 0.000 0.203 122 K C 1.927 178.563 176.600 0.060 0.000 1.052 122 K CA 1.536 57.778 56.287 -0.076 0.000 0.948 122 K CB 0.225 32.543 32.500 -0.303 0.000 0.728 122 K HN 0.295 nan 8.250 nan 0.000 0.448 123 S N 1.184 116.900 115.700 0.027 0.000 2.406 123 S HA -0.100 4.370 4.470 -0.000 0.000 0.228 123 S C 1.946 176.611 174.600 0.109 0.000 1.020 123 S CA 0.595 58.836 58.200 0.068 0.000 0.965 123 S CB -0.246 62.974 63.200 0.034 0.000 0.798 123 S HN 0.130 nan 8.310 nan 0.000 0.488 124 L N 1.925 123.197 121.223 0.083 0.000 2.156 124 L HA 0.339 4.679 4.340 -0.000 0.000 0.208 124 L C 2.590 179.558 176.870 0.163 0.000 1.095 124 L CA 1.235 56.143 54.840 0.113 0.000 0.770 124 L CB -1.248 40.846 42.059 0.058 0.000 0.914 124 L HN 0.355 nan 8.230 nan 0.000 0.439 125 A N -0.662 122.250 122.820 0.152 0.000 1.898 125 A HA -0.132 4.188 4.320 -0.000 0.000 0.216 125 A C 2.220 179.894 177.584 0.150 0.000 1.181 125 A CA 1.759 53.905 52.037 0.183 0.000 0.620 125 A CB -0.703 18.480 19.000 0.305 0.000 0.819 125 A HN 0.454 nan 8.150 nan 0.000 0.442 126 L N -2.187 119.132 121.223 0.161 0.000 2.109 126 L HA -0.149 4.191 4.340 -0.000 0.000 0.207 126 L C 2.561 179.472 176.870 0.069 0.000 1.086 126 L CA 1.506 56.409 54.840 0.104 0.000 0.760 126 L CB -0.675 41.464 42.059 0.134 0.000 0.910 126 L HN 0.573 nan 8.230 nan 0.000 0.437 127 Y N 1.140 121.462 120.300 0.037 0.000 2.070 127 Y HA -0.291 4.259 4.550 0.000 0.000 0.280 127 Y C 2.369 178.278 175.900 0.016 0.000 1.148 127 Y CA 1.754 59.866 58.100 0.020 0.000 1.125 127 Y CB -0.362 38.106 38.460 0.013 0.000 0.975 127 Y HN -0.040 nan 8.280 nan 0.000 0.492 128 L N 0.240 121.477 121.223 0.023 0.000 2.046 128 L HA -0.268 4.072 4.340 -0.000 0.000 0.208 128 L C 2.739 179.569 176.870 -0.067 0.000 1.077 128 L CA 1.883 56.708 54.840 -0.025 0.000 0.747 128 L CB -0.896 41.226 42.059 0.106 0.000 0.896 128 L HN 0.360 nan 8.230 nan 0.000 0.432 129 Q N 0.518 120.303 119.800 -0.026 0.000 2.062 129 Q HA -0.285 4.055 4.340 -0.000 0.000 0.209 129 Q C 1.898 177.860 176.000 -0.063 0.000 0.996 129 Q CA 2.290 58.078 55.803 -0.025 0.000 0.859 129 Q CB -0.151 28.550 28.738 -0.061 0.000 0.920 129 Q HN 0.538 nan 8.270 nan 0.000 0.415 130 N N -0.316 118.311 118.700 -0.122 0.000 2.331 130 N HA -0.138 4.602 4.740 -0.000 0.000 0.180 130 N C 1.686 177.071 175.510 -0.210 0.000 1.019 130 N CA 0.942 53.905 53.050 -0.145 0.000 0.881 130 N CB -0.051 38.355 38.487 -0.134 0.000 0.972 130 N HN 0.285 nan 8.380 nan 0.000 0.435 131 Q N 1.098 120.704 119.800 -0.323 0.000 2.311 131 Q HA 0.175 4.515 4.340 -0.000 0.000 0.203 131 Q C 1.853 177.712 176.000 -0.236 0.000 0.954 131 Q CA 0.531 56.134 55.803 -0.332 0.000 0.885 131 Q CB -0.101 28.362 28.738 -0.458 0.000 0.963 131 Q HN 0.368 nan 8.270 nan 0.000 0.471 132 I N -0.639 119.857 120.570 -0.124 0.000 2.439 132 I HA -0.188 3.982 4.170 -0.000 0.000 0.251 132 I C 2.220 178.330 176.117 -0.012 0.000 1.139 132 I CA 0.967 62.267 61.300 -0.000 0.000 1.438 132 I CB -0.163 37.943 38.000 0.177 0.000 1.085 132 I HN 0.116 nan 8.210 nan 0.000 0.427 133 S N 0.083 115.761 115.700 -0.037 0.000 2.383 133 S HA -0.107 4.363 4.470 -0.000 0.000 0.227 133 S C 2.089 176.653 174.600 -0.061 0.000 1.026 133 S CA 1.109 59.299 58.200 -0.016 0.000 0.981 133 S CB -0.095 63.092 63.200 -0.021 0.000 0.818 133 S HN 0.213 nan 8.310 nan 0.000 0.472 134 V N 1.829 121.669 119.914 -0.123 0.000 2.307 134 V HA -0.083 4.037 4.120 -0.000 0.000 0.245 134 V C 2.811 178.795 176.094 -0.183 0.000 1.045 134 V CA 1.826 64.046 62.300 -0.132 0.000 1.024 134 V CB -1.190 30.545 31.823 -0.146 0.000 0.651 134 V HN 0.588 nan 8.190 nan 0.000 0.449 135 A N -0.899 121.708 122.820 -0.356 0.000 1.897 135 A HA -0.039 4.281 4.320 -0.000 0.000 0.215 135 A C 1.906 179.192 177.584 -0.497 0.000 1.181 135 A CA 1.629 53.326 52.037 -0.566 0.000 0.620 135 A CB -0.435 17.942 19.000 -1.038 0.000 0.821 135 A HN 0.560 nan 8.150 nan 0.000 0.443 136 F N -2.213 117.772 119.950 0.058 0.000 2.724 136 F HA 0.247 4.774 4.527 0.000 0.000 0.306 136 F C 0.556 176.402 175.800 0.077 0.000 1.100 136 F CA 0.191 58.245 58.000 0.090 0.000 1.255 136 F CB 0.366 39.436 39.000 0.117 0.000 1.072 136 F HN 0.211 nan 8.300 nan 0.000 0.589 137 D N 0.798 121.290 120.400 0.153 0.000 2.947 137 D HA -0.132 4.508 4.640 -0.000 0.000 0.224 137 D C -1.109 175.265 176.300 0.123 0.000 1.132 137 D CA 0.267 54.330 54.000 0.105 0.000 0.801 137 D CB -0.851 40.006 40.800 0.096 0.000 1.097 137 D HN -0.013 nan 8.370 nan 0.000 0.431 138 V N 0.593 120.607 119.914 0.166 0.000 2.588 138 V HA 0.505 4.625 4.120 -0.000 0.000 0.304 138 V C -0.197 175.971 176.094 0.123 0.000 1.042 138 V CA -0.732 61.668 62.300 0.167 0.000 0.877 138 V CB 2.036 34.017 31.823 0.264 0.000 0.996 138 V HN 0.097 nan 8.190 nan 0.000 0.425 139 D N 4.736 125.182 120.400 0.077 0.000 2.461 139 D HA 0.477 5.117 4.640 -0.000 0.000 0.240 139 D C -0.840 175.478 176.300 0.031 0.000 1.094 139 D CA -0.164 53.862 54.000 0.044 0.000 0.868 139 D CB 1.069 41.879 40.800 0.016 0.000 1.062 139 D HN 0.437 nan 8.370 nan 0.000 0.530 140 I N 3.368 123.959 120.570 0.035 0.000 2.362 140 I HA 0.177 4.347 4.170 -0.000 0.000 0.289 140 I C 0.177 176.291 176.117 -0.007 0.000 0.994 140 I CA -1.022 60.267 61.300 -0.018 0.000 1.158 140 I CB 1.444 39.389 38.000 -0.092 0.000 1.315 140 I HN 0.373 nan 8.210 nan 0.000 0.451 141 H N 8.392 127.397 119.070 -0.109 0.000 2.848 141 H HA 0.100 4.656 4.556 -0.000 0.000 0.341 141 H C -1.833 173.436 175.328 -0.099 0.000 1.060 141 H CA -0.635 55.336 56.048 -0.130 0.000 1.444 141 H CB 1.195 30.840 29.762 -0.196 0.000 1.446 141 H HN 0.310 nan 8.280 nan 0.000 0.583 142 P HA -0.177 nan 4.420 nan 0.000 0.218 142 P C 0.648 177.917 177.300 -0.051 0.000 1.148 142 P CA 2.003 65.009 63.100 -0.156 0.000 0.822 142 P CB 0.121 31.687 31.700 -0.224 0.000 0.784 143 A N -0.585 122.070 122.820 -0.275 0.000 2.119 143 A HA 0.237 4.557 4.320 -0.000 0.000 0.217 143 A C 1.285 178.922 177.584 0.089 0.000 1.153 143 A CA 0.533 52.434 52.037 -0.227 0.000 0.692 143 A CB -1.248 17.532 19.000 -0.368 0.000 0.799 143 A HN 0.235 nan 8.150 nan 0.000 0.458 144 A N 0.499 123.350 122.820 0.052 0.000 2.586 144 A HA 0.281 4.601 4.320 -0.000 0.000 0.231 144 A C 0.250 177.754 177.584 -0.133 0.000 1.055 144 A CA 0.381 52.374 52.037 -0.072 0.000 0.756 144 A CB -0.006 18.859 19.000 -0.225 0.000 0.988 144 A HN 0.423 nan 8.150 nan 0.000 0.509 145 K N 2.065 122.393 120.400 -0.120 0.000 2.389 145 K HA 0.501 4.821 4.320 -0.000 0.000 0.261 145 K C -1.321 175.200 176.600 -0.131 0.000 1.014 145 K CA 0.118 56.333 56.287 -0.120 0.000 0.920 145 K CB 1.150 33.652 32.500 0.003 0.000 1.149 145 K HN 0.604 nan 8.250 nan 0.000 0.444 146 I N 1.899 122.386 120.570 -0.139 0.000 2.389 146 I HA 0.226 4.396 4.170 -0.000 0.000 0.288 146 I C 0.971 177.070 176.117 -0.031 0.000 0.999 146 I CA -0.668 60.564 61.300 -0.113 0.000 1.129 146 I CB 1.850 39.706 38.000 -0.240 0.000 1.288 146 I HN 0.635 nan 8.210 nan 0.000 0.444 147 G N 5.048 113.804 108.800 -0.073 0.000 2.481 147 G HA2 0.208 4.168 3.960 -0.000 0.000 0.251 147 G HA3 0.208 4.168 3.960 -0.000 0.000 0.251 147 G C -0.163 174.684 174.900 -0.088 0.000 1.492 147 G CA -0.099 44.932 45.100 -0.116 0.000 1.060 147 G HN 0.759 nan 8.290 nan 0.000 0.553 148 H N -3.611 115.467 119.070 0.013 0.000 2.864 148 H HA 0.497 5.053 4.556 -0.000 0.000 0.354 148 H C 0.634 175.976 175.328 0.024 0.000 1.208 148 H CA -0.443 55.617 56.048 0.020 0.000 1.191 148 H CB 1.180 30.961 29.762 0.032 0.000 1.889 148 H HN 1.526 nan 8.280 nan 0.000 0.574 149 G N 0.629 109.568 108.800 0.232 0.000 2.160 149 G HA2 -0.222 3.738 3.960 -0.000 0.000 0.244 149 G HA3 -0.222 3.738 3.960 -0.000 0.000 0.244 149 G C -0.001 174.946 174.900 0.079 0.000 1.022 149 G CA 0.346 45.540 45.100 0.157 0.000 0.741 149 G HN 0.485 nan 8.290 nan 0.000 0.508 153 D N 3.919 124.349 120.400 0.049 0.000 2.295 153 D HA 0.309 4.949 4.640 -0.000 0.000 0.248 153 D C 0.827 177.052 176.300 -0.125 0.000 1.154 153 D CA 1.262 55.194 54.000 -0.113 0.000 0.857 153 D CB 0.419 41.140 40.800 -0.132 0.000 1.117 153 D HN 0.601 nan 8.370 nan 0.000 0.468 154 H N 3.527 122.627 119.070 0.050 0.000 4.836 154 H HA -0.374 4.182 4.556 -0.000 0.000 0.067 154 H C 1.486 176.849 175.328 0.059 0.000 0.594 154 H CA 2.095 58.169 56.048 0.042 0.000 0.978 154 H CB -1.608 28.164 29.762 0.016 0.000 0.436 154 H HN 0.720 nan 8.280 nan 0.000 0.790 155 A N -0.695 122.214 122.820 0.148 0.000 3.746 155 A HA -0.288 4.032 4.320 -0.000 0.000 0.242 155 A C 1.079 178.713 177.584 0.084 0.000 0.736 155 A CA 2.303 54.404 52.037 0.106 0.000 1.370 155 A CB -2.401 16.713 19.000 0.189 0.000 1.130 155 A HN 0.748 nan 8.150 nan 0.000 0.696 156 T N 0.470 115.085 114.554 0.102 0.000 2.849 156 T HA 0.435 4.785 4.350 -0.000 0.000 0.289 156 T C 1.795 176.511 174.700 0.027 0.000 1.010 156 T CA 2.023 64.167 62.100 0.073 0.000 1.161 156 T CB 0.345 69.251 68.868 0.064 0.000 0.989 156 T HN 2.363 nan 8.240 nan 0.000 0.523 157 G N 3.265 112.080 108.800 0.025 0.000 2.159 157 G HA2 -0.231 3.729 3.960 -0.000 0.000 0.256 157 G HA3 -0.231 3.729 3.960 -0.000 0.000 0.256 157 G C 0.243 175.123 174.900 -0.033 0.000 0.977 157 G CA -0.341 44.756 45.100 -0.005 0.000 0.652 157 G HN 0.762 nan 8.290 nan 0.000 0.531 158 I N 1.125 121.670 120.570 -0.041 0.000 2.471 158 I HA 0.355 4.525 4.170 -0.000 0.000 0.286 158 I C 0.362 176.448 176.117 -0.051 0.000 1.079 158 I CA -0.219 61.016 61.300 -0.109 0.000 1.398 158 I CB 1.214 39.072 38.000 -0.237 0.000 1.403 158 I HN -0.109 nan 8.210 nan 0.000 0.530 159 V N 7.620 127.487 119.914 -0.078 0.000 2.531 159 V HA 0.401 4.521 4.120 -0.000 0.000 0.301 159 V C -0.199 175.836 176.094 -0.098 0.000 1.034 159 V CA -0.629 61.634 62.300 -0.062 0.000 0.865 159 V CB 2.254 34.041 31.823 -0.060 0.000 0.995 159 V HN 0.388 nan 8.190 nan 0.000 0.424 160 V N 3.628 123.486 119.914 -0.093 0.000 2.444 160 V HA 0.691 4.811 4.120 -0.000 0.000 0.294 160 V C 0.730 176.702 176.094 -0.204 0.000 1.022 160 V CA -0.375 61.842 62.300 -0.140 0.000 0.850 160 V CB 1.887 33.654 31.823 -0.094 0.000 0.992 160 V HN 0.960 nan 8.190 nan 0.000 0.426 161 G N 1.944 110.506 108.800 -0.396 0.000 2.539 161 G HA2 0.284 4.244 3.960 -0.000 0.000 0.258 161 G HA3 0.284 4.244 3.960 -0.000 0.000 0.258 161 G C 0.704 175.394 174.900 -0.350 0.000 1.202 161 G CA 0.044 44.717 45.100 -0.712 0.000 0.851 161 G HN 0.895 nan 8.290 nan 0.000 0.556 162 E N -0.539 119.525 120.200 -0.225 0.000 2.136 162 E HA -0.240 4.110 4.350 -0.000 0.000 0.202 162 E C 1.979 178.572 176.600 -0.013 0.000 1.019 162 E CA 1.930 58.154 56.400 -0.294 0.000 0.819 162 E CB -0.006 29.332 29.700 -0.604 0.000 0.739 162 E HN 0.526 nan 8.360 nan 0.000 0.458 163 T N -1.698 113.050 114.554 0.324 0.000 3.176 163 T HA 0.269 4.619 4.350 -0.000 0.000 0.263 163 T C 0.207 174.977 174.700 0.116 0.000 1.021 163 T CA -0.403 61.771 62.100 0.123 0.000 0.905 163 T CB 0.568 69.423 68.868 -0.022 0.000 1.057 163 T HN -0.095 nan 8.240 nan 0.000 0.558 164 S N 1.013 116.770 115.700 0.095 0.000 2.593 164 S HA 0.561 5.031 4.470 -0.000 0.000 0.269 164 S C -0.087 174.501 174.600 -0.020 0.000 1.334 164 S CA -0.636 57.577 58.200 0.021 0.000 1.015 164 S CB 1.373 64.535 63.200 -0.063 0.000 0.912 164 S HN 0.325 nan 8.310 nan 0.000 0.541 165 V N 2.378 122.275 119.914 -0.029 0.000 2.709 165 V HA 0.526 4.646 4.120 -0.000 0.000 0.308 165 V C -0.740 175.318 176.094 -0.059 0.000 1.062 165 V CA -0.555 61.721 62.300 -0.041 0.000 0.901 165 V CB 1.665 33.474 31.823 -0.023 0.000 1.003 165 V HN 0.762 nan 8.190 nan 0.000 0.425 166 I N 3.801 124.326 120.570 -0.075 0.000 2.468 166 I HA 0.416 4.586 4.170 -0.000 0.000 0.284 166 I C 0.172 176.236 176.117 -0.089 0.000 1.038 166 I CA -0.368 60.886 61.300 -0.076 0.000 1.083 166 I CB 1.866 39.828 38.000 -0.063 0.000 1.223 166 I HN 0.641 nan 8.210 nan 0.000 0.443 167 E N 4.413 124.552 120.200 -0.101 0.000 2.602 167 E HA 0.307 4.657 4.350 -0.000 0.000 0.255 167 E C -0.365 176.140 176.600 -0.158 0.000 1.268 167 E CA -0.937 55.389 56.400 -0.123 0.000 1.007 167 E CB 0.608 30.238 29.700 -0.116 0.000 1.208 167 E HN 0.432 nan 8.360 nan 0.000 0.584 168 N N 1.626 120.200 118.700 -0.211 0.000 2.267 168 N HA -0.078 4.662 4.740 -0.000 0.000 0.226 168 N C -0.149 175.272 175.510 -0.149 0.000 1.314 168 N CA 0.351 53.255 53.050 -0.242 0.000 0.887 168 N CB 0.005 38.294 38.487 -0.331 0.000 1.120 168 N HN 0.442 nan 8.380 nan 0.000 0.440 169 D N -1.797 118.553 120.400 -0.084 0.000 2.860 169 D HA -0.155 4.485 4.640 -0.000 0.000 0.229 169 D C -0.472 175.788 176.300 -0.066 0.000 1.169 169 D CA 0.571 54.548 54.000 -0.039 0.000 0.737 169 D CB -1.304 39.490 40.800 -0.011 0.000 1.080 169 D HN 0.137 nan 8.370 nan 0.000 0.424 170 V N 0.069 119.944 119.914 -0.065 0.000 2.834 170 V HA 0.359 4.479 4.120 -0.000 0.000 0.301 170 V C 0.834 176.934 176.094 0.011 0.000 1.066 170 V CA -0.070 62.196 62.300 -0.057 0.000 1.052 170 V CB 2.002 33.794 31.823 -0.051 0.000 1.021 170 V HN 0.078 nan 8.190 nan 0.000 0.480 171 S N 4.242 119.939 115.700 -0.004 0.000 2.707 171 S HA 0.657 5.127 4.470 -0.000 0.000 0.303 171 S C -0.686 173.897 174.600 -0.029 0.000 1.132 171 S CA -0.357 57.854 58.200 0.017 0.000 1.046 171 S CB 0.848 64.049 63.200 0.003 0.000 1.004 171 S HN 0.487 nan 8.310 nan 0.000 0.483 172 I N 3.793 124.327 120.570 -0.060 0.000 2.465 172 I HA 0.432 4.602 4.170 -0.000 0.000 0.291 172 I C -0.431 175.558 176.117 -0.213 0.000 1.014 172 I CA -0.670 60.499 61.300 -0.219 0.000 1.093 172 I CB 1.457 39.149 38.000 -0.513 0.000 1.267 172 I HN 0.325 nan 8.210 nan 0.000 0.431 173 L N 4.607 125.744 121.223 -0.143 0.000 2.448 173 L HA 0.301 4.641 4.340 -0.000 0.000 0.258 173 L C 0.529 177.341 176.870 -0.096 0.000 1.104 173 L CA -0.825 53.976 54.840 -0.064 0.000 0.800 173 L CB 0.908 42.965 42.059 -0.003 0.000 1.241 173 L HN 0.620 nan 8.230 nan 0.000 0.472 174 Q N 0.682 120.476 119.800 -0.010 0.000 2.469 174 Q HA -0.008 4.332 4.340 -0.000 0.000 0.279 174 Q C 0.738 176.703 176.000 -0.058 0.000 1.097 174 Q CA 0.569 56.360 55.803 -0.020 0.000 0.951 174 Q CB -0.211 28.541 28.738 0.023 0.000 1.297 174 Q HN 0.865 nan 8.270 nan 0.000 0.465 175 G N -0.003 108.763 108.800 -0.058 0.000 2.175 175 G HA2 -0.321 3.639 3.960 -0.000 0.000 0.265 175 G HA3 -0.321 3.639 3.960 -0.000 0.000 0.265 175 G C 0.215 175.068 174.900 -0.079 0.000 0.979 175 G CA 0.522 45.587 45.100 -0.059 0.000 0.663 175 G HN 1.296 nan 8.290 nan 0.000 0.533 176 V N -1.000 118.843 119.914 -0.118 0.000 2.644 176 V HA 0.873 4.993 4.120 -0.000 0.000 0.295 176 V C 0.194 176.211 176.094 -0.129 0.000 1.053 176 V CA 0.364 62.589 62.300 -0.124 0.000 0.987 176 V CB 1.893 33.626 31.823 -0.151 0.000 1.006 176 V HN 0.348 nan 8.190 nan 0.000 0.472 177 T N 7.002 121.493 114.554 -0.104 0.000 2.829 177 T HA 0.574 4.924 4.350 -0.000 0.000 0.280 177 T C -0.441 174.198 174.700 -0.103 0.000 0.999 177 T CA -0.334 61.706 62.100 -0.100 0.000 0.983 177 T CB 1.151 69.974 68.868 -0.073 0.000 0.968 177 T HN 0.686 nan 8.240 nan 0.000 0.446 178 L N 3.526 124.674 121.223 -0.124 0.000 2.337 178 L HA 0.650 4.990 4.340 -0.000 0.000 0.269 178 L C 0.685 177.454 176.870 -0.168 0.000 1.018 178 L CA -0.428 54.341 54.840 -0.118 0.000 0.876 178 L CB 0.703 42.687 42.059 -0.124 0.000 1.236 178 L HN 0.827 nan 8.230 nan 0.000 0.436 179 G N 1.470 110.213 108.800 -0.095 0.000 3.247 179 G HA2 0.759 4.719 3.960 -0.000 0.000 0.226 179 G HA3 0.759 4.719 3.960 -0.000 0.000 0.226 179 G C -0.758 174.234 174.900 0.153 0.000 1.220 179 G CA -0.295 44.759 45.100 -0.076 0.000 0.875 179 G HN 0.511 nan 8.290 nan 0.000 0.606 180 G N -2.028 106.873 108.800 0.169 0.000 2.644 180 G HA2 0.488 4.448 3.960 -0.000 0.000 0.307 180 G HA3 0.488 4.448 3.960 -0.000 0.000 0.307 180 G C 0.817 175.751 174.900 0.056 0.000 1.250 180 G CA 0.807 45.995 45.100 0.147 0.000 0.996 180 G HN 1.055 nan 8.290 nan 0.000 0.489 181 T N -4.081 110.490 114.554 0.028 0.000 3.044 181 T HA 0.386 4.736 4.350 -0.000 0.000 0.255 181 T C 1.554 176.260 174.700 0.009 0.000 1.073 181 T CA 1.352 63.460 62.100 0.012 0.000 1.125 181 T CB 0.376 69.246 68.868 0.003 0.000 0.908 181 T HN 2.011 nan 8.240 nan 0.000 0.480 182 G N 0.127 108.931 108.800 0.006 0.000 2.559 182 G HA2 0.245 4.205 3.960 -0.000 0.000 0.202 182 G HA3 0.245 4.205 3.960 -0.000 0.000 0.202 182 G C 0.214 175.109 174.900 -0.009 0.000 0.992 182 G CA 0.052 45.154 45.100 0.003 0.000 0.764 182 G HN 0.832 nan 8.290 nan 0.000 0.525 183 K N 0.676 121.062 120.400 -0.023 0.000 2.447 183 K HA 0.652 4.972 4.320 -0.000 0.000 0.281 183 K C 1.067 177.645 176.600 -0.036 0.000 1.031 183 K CA 1.371 57.638 56.287 -0.033 0.000 1.019 183 K CB -0.222 32.247 32.500 -0.050 0.000 0.918 183 K HN 1.296 nan 8.250 nan 0.000 0.476 184 E N 0.643 120.828 120.200 -0.024 0.000 2.358 184 E HA 0.096 4.446 4.350 -0.000 0.000 0.195 184 E C 1.050 177.632 176.600 -0.031 0.000 1.010 184 E CA 1.147 57.537 56.400 -0.017 0.000 0.856 184 E CB -0.190 29.508 29.700 -0.002 0.000 0.795 184 E HN 1.096 nan 8.360 nan 0.000 0.504 185 S N -3.282 112.391 115.700 -0.044 0.000 2.732 185 S HA 0.778 5.247 4.470 -0.000 0.000 0.293 185 S C 0.979 175.533 174.600 -0.076 0.000 1.159 185 S CA -0.268 57.902 58.200 -0.050 0.000 0.847 185 S CB 1.444 64.632 63.200 -0.020 0.000 1.169 185 S HN 1.682 nan 8.310 nan 0.000 0.501 186 G N 0.602 109.362 108.800 -0.067 0.000 2.584 186 G HA2 -0.103 3.857 3.960 -0.000 0.000 0.229 186 G HA3 -0.103 3.857 3.960 -0.000 0.000 0.229 186 G C -1.077 173.752 174.900 -0.119 0.000 1.320 186 G CA 0.034 45.093 45.100 -0.068 0.000 0.891 186 G HN 0.953 nan 8.290 nan 0.000 0.573 187 D N 1.525 121.865 120.400 -0.099 0.000 2.352 187 D HA 0.490 5.130 4.640 -0.000 0.000 0.245 187 D C 1.329 177.532 176.300 -0.162 0.000 1.224 187 D CA -0.049 53.882 54.000 -0.115 0.000 0.879 187 D CB 0.257 41.022 40.800 -0.058 0.000 1.057 187 D HN 0.558 nan 8.370 nan 0.000 0.491 188 R N 1.251 121.566 120.500 -0.309 0.000 2.544 188 R HA 0.286 4.626 4.340 -0.000 0.000 0.426 188 R C -0.221 175.925 176.300 -0.258 0.000 0.943 188 R CA -0.507 55.419 56.100 -0.290 0.000 1.162 188 R CB -0.059 30.055 30.300 -0.309 0.000 1.588 188 R HN 0.272 nan 8.270 nan 0.000 0.563 189 H N -0.060 118.985 119.070 -0.042 0.000 2.731 189 H HA 0.443 4.999 4.556 -0.000 0.000 0.368 189 H C -2.583 172.719 175.328 -0.044 0.000 1.168 189 H CA -2.720 53.299 56.048 -0.048 0.000 1.181 189 H CB 2.098 31.823 29.762 -0.062 0.000 1.743 189 H HN -0.169 nan 8.280 nan 0.000 0.547 190 P HA -0.056 nan 4.420 nan 0.000 0.270 190 P C -0.857 176.447 177.300 0.006 0.000 1.221 190 P CA 0.093 63.206 63.100 0.022 0.000 0.788 190 P CB 0.569 32.265 31.700 -0.007 0.000 0.904 191 K N 1.155 121.547 120.400 -0.012 0.000 2.527 191 K HA 0.355 4.675 4.320 -0.000 0.000 0.240 191 K C -1.402 175.173 176.600 -0.042 0.000 0.989 191 K CA -0.397 55.876 56.287 -0.023 0.000 0.985 191 K CB 0.567 33.056 32.500 -0.018 0.000 1.221 191 K HN 0.056 nan 8.250 nan 0.000 0.458 192 V N 5.021 124.902 119.914 -0.055 0.000 2.348 192 V HA 0.401 4.521 4.120 -0.000 0.000 0.270 192 V C 0.429 176.465 176.094 -0.097 0.000 1.037 192 V CA -0.936 61.318 62.300 -0.077 0.000 0.872 192 V CB 0.647 32.424 31.823 -0.078 0.000 1.002 192 V HN 0.485 nan 8.190 nan 0.000 0.464 193 R N 2.814 123.244 120.500 -0.116 0.000 2.583 193 R HA 0.300 4.640 4.340 -0.000 0.000 0.268 193 R C 0.583 176.748 176.300 -0.225 0.000 1.101 193 R CA -0.685 55.331 56.100 -0.140 0.000 1.180 193 R CB 0.631 30.860 30.300 -0.117 0.000 1.128 193 R HN 0.956 nan 8.270 nan 0.000 0.568 194 E N -0.551 119.498 120.200 -0.251 0.000 2.467 194 E HA 0.077 4.427 4.350 -0.000 0.000 0.264 194 E C 0.540 176.677 176.600 -0.772 0.000 1.020 194 E CA 0.478 56.652 56.400 -0.377 0.000 0.945 194 E CB 0.069 29.611 29.700 -0.262 0.000 0.942 194 E HN 0.716 nan 8.360 nan 0.000 0.449 195 G N 1.250 109.642 108.800 -0.680 0.000 2.196 195 G HA2 -0.326 3.634 3.960 -0.000 0.000 0.268 195 G HA3 -0.326 3.634 3.960 -0.000 0.000 0.268 195 G C 0.445 175.073 174.900 -0.454 0.000 0.975 195 G CA 0.306 44.949 45.100 -0.762 0.000 0.648 195 G HN 0.474 nan 8.290 nan 0.000 0.538 199 G N 3.611 112.383 108.800 -0.046 0.000 2.544 199 G HA2 0.506 4.466 3.960 -0.000 0.000 0.242 199 G HA3 0.506 4.466 3.960 -0.000 0.000 0.242 199 G C 0.438 175.311 174.900 -0.044 0.000 1.247 199 G CA 0.016 45.095 45.100 -0.035 0.000 0.840 199 G HN 0.923 nan 8.290 nan 0.000 0.578 200 A N 0.115 122.915 122.820 -0.032 0.000 2.566 200 A HA 0.484 4.804 4.320 -0.000 0.000 0.245 200 A C 1.758 179.316 177.584 -0.043 0.000 1.056 200 A CA 1.298 53.313 52.037 -0.036 0.000 0.757 200 A CB -0.529 18.455 19.000 -0.028 0.000 0.979 200 A HN 2.650 nan 8.150 nan 0.000 0.508 201 G N 0.995 109.764 108.800 -0.052 0.000 2.184 201 G HA2 0.109 4.069 3.960 -0.000 0.000 0.264 201 G HA3 0.109 4.069 3.960 -0.000 0.000 0.264 201 G C 0.642 175.512 174.900 -0.049 0.000 0.975 201 G CA 0.620 45.691 45.100 -0.048 0.000 0.642 201 G HN 2.279 nan 8.290 nan 0.000 0.536 202 A N -0.131 122.656 122.820 -0.055 0.000 2.462 202 A HA 0.575 4.895 4.320 -0.000 0.000 0.243 202 A C 0.461 178.011 177.584 -0.057 0.000 1.076 202 A CA 0.413 52.419 52.037 -0.052 0.000 0.773 202 A CB 0.405 19.373 19.000 -0.053 0.000 1.010 202 A HN 0.228 nan 8.150 nan 0.000 0.493 203 K N 2.785 123.158 120.400 -0.046 0.000 2.449 203 K HA 0.451 4.771 4.320 -0.000 0.000 0.257 203 K C -1.144 175.433 176.600 -0.037 0.000 0.989 203 K CA 0.086 56.346 56.287 -0.044 0.000 0.916 203 K CB 1.256 33.736 32.500 -0.033 0.000 1.136 203 K HN 0.605 nan 8.250 nan 0.000 0.439 204 I N 5.300 125.844 120.570 -0.043 0.000 2.354 204 I HA 0.338 4.508 4.170 -0.000 0.000 0.286 204 I C -0.345 175.760 176.117 -0.020 0.000 1.007 204 I CA -0.773 60.507 61.300 -0.033 0.000 1.167 204 I CB 0.773 38.747 38.000 -0.043 0.000 1.320 204 I HN 0.272 nan 8.210 nan 0.000 0.458 205 L N 5.737 126.956 121.223 -0.006 0.000 2.362 205 L HA 0.901 5.241 4.340 -0.000 0.000 0.271 205 L C 0.311 177.193 176.870 0.020 0.000 1.002 205 L CA -0.621 54.227 54.840 0.013 0.000 0.818 205 L CB 1.946 44.010 42.059 0.009 0.000 1.298 205 L HN 0.795 nan 8.230 nan 0.000 0.420 206 G N 1.644 110.469 108.800 0.042 0.000 2.629 206 G HA2 -0.219 3.741 3.960 -0.000 0.000 0.686 206 G HA3 -0.219 3.741 3.960 -0.000 0.000 0.686 206 G C -0.804 174.106 174.900 0.016 0.000 1.232 206 G CA -0.782 44.330 45.100 0.019 0.000 0.803 206 G HN 0.775 nan 8.290 nan 0.000 0.638 207 N N 0.488 119.182 118.700 -0.011 0.000 3.103 207 N HA 0.328 5.068 4.740 -0.000 0.000 0.305 207 N C 0.690 176.195 175.510 -0.008 0.000 1.232 207 N CA 0.183 53.224 53.050 -0.014 0.000 1.190 207 N CB -0.781 37.684 38.487 -0.038 0.000 1.461 207 N HN 0.864 nan 8.380 nan 0.000 0.538 208 I N -2.195 118.374 120.570 -0.003 0.000 2.693 208 I HA 0.575 4.745 4.170 -0.000 0.000 0.303 208 I C -0.209 175.903 176.117 -0.009 0.000 1.025 208 I CA -1.042 60.255 61.300 -0.006 0.000 1.086 208 I CB 1.748 39.744 38.000 -0.006 0.000 1.268 208 I HN -0.084 nan 8.210 nan 0.000 0.440 209 E N 3.433 123.627 120.200 -0.010 0.000 2.259 209 E HA 0.346 4.696 4.350 -0.000 0.000 0.281 209 E C -0.970 175.617 176.600 -0.022 0.000 1.027 209 E CA -0.488 55.903 56.400 -0.016 0.000 0.838 209 E CB 2.491 32.185 29.700 -0.011 0.000 1.066 209 E HN 0.416 nan 8.360 nan 0.000 0.401 210 V N 2.808 122.701 119.914 -0.036 0.000 2.347 210 V HA 0.296 4.416 4.120 -0.000 0.000 0.280 210 V C 0.707 176.763 176.094 -0.063 0.000 1.021 210 V CA -0.704 61.568 62.300 -0.047 0.000 0.847 210 V CB 1.543 33.332 31.823 -0.057 0.000 0.990 210 V HN 0.736 nan 8.190 nan 0.000 0.444 211 G N 4.747 113.515 108.800 -0.054 0.000 2.491 211 G HA2 0.196 4.156 3.960 -0.000 0.000 0.238 211 G HA3 0.196 4.156 3.960 -0.000 0.000 0.238 211 G C 0.120 174.936 174.900 -0.141 0.000 1.277 211 G CA -0.533 44.528 45.100 -0.065 0.000 0.851 211 G HN 0.783 nan 8.290 nan 0.000 0.573 212 K N 1.022 121.318 120.400 -0.172 0.000 2.561 212 K HA -0.108 4.212 4.320 -0.000 0.000 0.280 212 K C -0.260 176.078 176.600 -0.437 0.000 0.975 212 K CA 0.206 56.286 56.287 -0.345 0.000 1.024 212 K CB 0.263 32.632 32.500 -0.219 0.000 0.883 212 K HN 0.635 nan 8.250 nan 0.000 0.496 213 Y N -2.139 117.940 120.300 -0.368 0.000 4.819 213 Y HA -0.354 4.196 4.550 -0.000 0.000 0.230 213 Y C 0.836 176.558 175.900 -0.296 0.000 1.009 213 Y CA 0.607 58.461 58.100 -0.409 0.000 1.971 213 Y CB -2.069 35.931 38.460 -0.766 0.000 1.587 213 Y HN 0.791 nan 8.280 nan 0.000 0.587 214 A N 0.922 123.645 122.820 -0.162 0.000 2.406 214 A HA 0.511 4.831 4.320 -0.000 0.000 0.243 214 A C 0.453 178.010 177.584 -0.045 0.000 1.082 214 A CA -0.202 51.794 52.037 -0.069 0.000 0.786 214 A CB 0.451 19.412 19.000 -0.066 0.000 1.029 214 A HN 0.293 nan 8.150 nan 0.000 0.495 215 K N 1.136 121.528 120.400 -0.012 0.000 2.345 215 K HA 0.514 4.834 4.320 -0.000 0.000 0.255 215 K C -1.365 175.226 176.600 -0.015 0.000 0.934 215 K CA -0.592 55.689 56.287 -0.011 0.000 0.801 215 K CB 1.756 34.262 32.500 0.010 0.000 1.137 215 K HN 0.465 nan 8.250 nan 0.000 0.424 216 I N 2.119 122.674 120.570 -0.025 0.000 2.378 216 I HA 0.241 4.411 4.170 -0.000 0.000 0.291 216 I C 0.827 176.930 176.117 -0.023 0.000 0.992 216 I CA -0.534 60.751 61.300 -0.026 0.000 1.154 216 I CB 1.059 39.035 38.000 -0.039 0.000 1.315 216 I HN 0.669 nan 8.210 nan 0.000 0.448 217 G N 4.163 112.952 108.800 -0.017 0.000 2.503 217 G HA2 0.478 4.438 3.960 -0.000 0.000 0.257 217 G HA3 0.478 4.438 3.960 -0.000 0.000 0.257 217 G C 0.220 175.107 174.900 -0.021 0.000 1.214 217 G CA -0.388 44.703 45.100 -0.015 0.000 0.839 217 G HN 0.838 nan 8.290 nan 0.000 0.559 218 A N 1.736 124.544 122.820 -0.020 0.000 2.587 218 A HA 0.210 4.530 4.320 -0.000 0.000 0.233 218 A C 1.277 178.846 177.584 -0.024 0.000 1.049 218 A CA 0.641 52.664 52.037 -0.024 0.000 0.754 218 A CB -0.186 18.801 19.000 -0.021 0.000 0.977 218 A HN 1.182 nan 8.150 nan 0.000 0.509 219 N N -0.247 118.436 118.700 -0.028 0.000 2.678 219 N HA -0.160 4.580 4.740 -0.000 0.000 0.250 219 N C -0.033 175.463 175.510 -0.024 0.000 1.136 219 N CA 1.488 54.523 53.050 -0.026 0.000 0.757 219 N CB -1.853 36.620 38.487 -0.022 0.000 1.135 219 N HN 0.649 nan 8.380 nan 0.000 0.565 220 S N -0.138 115.547 115.700 -0.024 0.000 2.564 220 S HA 0.383 4.853 4.470 -0.000 0.000 0.278 220 S C 0.634 175.220 174.600 -0.023 0.000 1.333 220 S CA -0.579 57.608 58.200 -0.021 0.000 1.048 220 S CB 1.949 65.138 63.200 -0.020 0.000 0.900 220 S HN 0.081 nan 8.310 nan 0.000 0.505 221 V N 3.853 123.756 119.914 -0.018 0.000 2.328 221 V HA 0.274 4.394 4.120 -0.000 0.000 0.278 221 V C -0.298 175.787 176.094 -0.016 0.000 1.021 221 V CA -0.618 61.671 62.300 -0.018 0.000 0.838 221 V CB 1.170 32.984 31.823 -0.014 0.000 0.999 221 V HN 0.672 nan 8.190 nan 0.000 0.447 222 V N 7.218 127.121 119.914 -0.018 0.000 2.333 222 V HA 0.351 4.471 4.120 -0.000 0.000 0.274 222 V C 0.581 176.668 176.094 -0.012 0.000 1.028 222 V CA -0.093 62.198 62.300 -0.016 0.000 0.851 222 V CB 1.298 33.109 31.823 -0.021 0.000 1.000 222 V HN 0.768 nan 8.190 nan 0.000 0.456 223 L N 3.466 124.684 121.223 -0.009 0.000 2.858 223 L HA 0.425 4.765 4.340 -0.000 0.000 0.251 223 L C 0.336 177.203 176.870 -0.005 0.000 1.149 223 L CA 0.154 54.991 54.840 -0.006 0.000 0.955 223 L CB 0.249 42.305 42.059 -0.005 0.000 1.289 223 L HN 0.550 nan 8.230 nan 0.000 0.542 224 N N 0.219 118.916 118.700 -0.005 0.000 2.240 224 N HA 0.403 5.143 4.740 -0.000 0.000 0.302 224 N C -2.650 172.858 175.510 -0.004 0.000 1.106 224 N CA -1.375 51.673 53.050 -0.004 0.000 0.778 224 N CB 1.784 40.270 38.487 -0.002 0.000 1.431 224 N HN -0.299 nan 8.380 nan 0.000 0.479 225 P HA -0.006 nan 4.420 nan 0.000 0.264 225 P C -0.590 176.710 177.300 -0.001 0.000 1.183 225 P CA 0.141 63.239 63.100 -0.003 0.000 0.763 225 P CB 0.599 32.299 31.700 0.000 0.000 0.807 226 V N 6.676 126.587 119.914 -0.004 0.000 2.384 226 V HA 0.308 4.428 4.120 -0.000 0.000 0.287 226 V C -2.011 174.087 176.094 0.006 0.000 1.020 226 V CA -1.971 60.328 62.300 -0.001 0.000 0.850 226 V CB 1.501 33.318 31.823 -0.011 0.000 0.987 226 V HN 0.500 nan 8.190 nan 0.000 0.436 227 P HA 0.136 nan 4.420 nan 0.000 0.269 227 P C -0.057 177.277 177.300 0.058 0.000 1.215 227 P CA -0.243 62.884 63.100 0.046 0.000 0.780 227 P CB 0.499 32.233 31.700 0.057 0.000 0.898 228 E N 1.058 121.311 120.200 0.089 0.000 2.438 228 E HA -0.096 4.254 4.350 -0.000 0.000 0.261 228 E C -0.058 176.660 176.600 0.197 0.000 1.103 228 E CA 0.141 56.592 56.400 0.085 0.000 0.959 228 E CB -0.249 29.595 29.700 0.239 0.000 0.958 228 E HN 0.434 nan 8.360 nan 0.000 0.447 229 Y N -2.087 118.272 120.300 0.100 0.000 4.860 229 Y HA -0.361 4.189 4.550 0.000 0.000 0.229 229 Y C 0.695 176.626 175.900 0.052 0.000 0.996 229 Y CA 0.710 58.862 58.100 0.088 0.000 1.957 229 Y CB -1.881 36.617 38.460 0.062 0.000 1.564 229 Y HN 0.593 nan 8.280 nan 0.000 0.553 230 A N 0.026 122.928 122.820 0.137 0.000 2.287 230 A HA 0.655 4.975 4.320 -0.000 0.000 0.273 230 A C 0.515 178.130 177.584 0.050 0.000 1.091 230 A CA 0.390 52.480 52.037 0.087 0.000 0.817 230 A CB 0.468 19.506 19.000 0.063 0.000 1.069 230 A HN 0.175 nan 8.150 nan 0.000 0.492 231 T N 0.978 115.556 114.554 0.040 0.000 2.792 231 T HA 0.612 4.961 4.350 -0.000 0.000 0.280 231 T C -0.247 174.461 174.700 0.014 0.000 0.990 231 T CA 0.226 62.340 62.100 0.024 0.000 0.960 231 T CB 1.220 70.105 68.868 0.028 0.000 0.939 231 T HN 1.078 nan 8.240 nan 0.000 0.439 232 A N 2.514 125.336 122.820 0.004 0.000 2.342 232 A HA 0.971 5.291 4.320 -0.000 0.000 0.323 232 A C -0.418 177.164 177.584 -0.004 0.000 1.125 232 A CA -0.700 51.337 52.037 -0.000 0.000 0.785 232 A CB 1.045 20.042 19.000 -0.005 0.000 1.221 232 A HN 1.107 nan 8.150 nan 0.000 0.463 233 A N 0.931 123.749 122.820 -0.004 0.000 2.606 233 A HA 0.998 5.318 4.320 -0.000 0.000 0.293 233 A C 0.076 177.657 177.584 -0.006 0.000 1.082 233 A CA 0.083 52.117 52.037 -0.006 0.000 0.685 233 A CB 0.951 19.949 19.000 -0.004 0.000 1.284 233 A HN 2.892 nan 8.150 nan 0.000 0.408 234 G N -1.608 107.187 108.800 -0.008 0.000 2.541 234 G HA2 0.428 4.388 3.960 -0.000 0.000 0.686 234 G HA3 0.428 4.388 3.960 -0.000 0.000 0.686 234 G C -1.131 173.764 174.900 -0.009 0.000 1.286 234 G CA -0.239 44.856 45.100 -0.007 0.000 0.894 234 G HN 1.839 nan 8.290 nan 0.000 0.575 235 V N 2.451 122.360 119.914 -0.008 0.000 2.398 235 V HA 0.489 4.609 4.120 -0.000 0.000 0.282 235 V C -1.330 174.760 176.094 -0.007 0.000 1.014 235 V CA -0.838 61.457 62.300 -0.009 0.000 0.838 235 V CB 0.896 32.713 31.823 -0.010 0.000 1.018 235 V HN 0.862 nan 8.190 nan 0.000 0.432 236 P HA 0.552 nan 4.420 nan 0.000 0.275 236 P C -0.174 177.122 177.300 -0.007 0.000 1.270 236 P CA -0.365 62.731 63.100 -0.007 0.000 0.791 236 P CB 0.568 32.264 31.700 -0.005 0.000 1.089 237 A N 0.892 123.708 122.820 -0.007 0.000 2.340 237 A HA 0.564 4.884 4.320 -0.000 0.000 0.268 237 A C 0.078 177.660 177.584 -0.004 0.000 1.100 237 A CA -0.199 51.834 52.037 -0.007 0.000 0.803 237 A CB 0.156 19.150 19.000 -0.009 0.000 1.043 237 A HN 0.375 nan 8.150 nan 0.000 0.488 238 R N 0.788 121.287 120.500 -0.002 0.000 2.771 238 R HA 0.381 4.721 4.340 -0.000 0.000 0.274 238 R C -1.152 175.150 176.300 0.003 0.000 0.987 238 R CA -1.007 55.093 56.100 0.001 0.000 0.908 238 R CB 1.131 31.432 30.300 0.001 0.000 1.213 238 R HN 0.589 nan 8.270 nan 0.000 0.468 239 I N 3.412 123.986 120.570 0.006 0.000 2.494 239 I HA 0.040 4.210 4.170 -0.000 0.000 0.289 239 I C 1.049 177.172 176.117 0.011 0.000 1.106 239 I CA -0.020 61.286 61.300 0.011 0.000 1.369 239 I CB -0.274 37.735 38.000 0.015 0.000 1.410 239 I HN 0.310 nan 8.210 nan 0.000 0.523 240 V N 0.000 119.921 119.914 0.012 0.000 2.409 240 V HA 0.000 4.120 4.120 -0.000 0.000 0.244 240 V CA 0.000 62.307 62.300 0.011 0.000 1.235 240 V CB 0.000 31.828 31.823 0.008 0.000 1.184 240 V HN 0.000 nan 8.190 nan 0.000 0.556