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 1nc9_1_B DATA FIRST_RESID 16 DATA SEQUENCE GITGTWYNQL GSTFIVTAGA DGALTGTAEX XXXNAESRYV LTGRYDSAPA DATA SEQUENCE TDGSGTALGW TVAWKNNYRN AHSATTWSGQ YVGGAEARIN TQWLLTSGTT DATA SEQUENCE EANAWKSTLV GHDTFTKV 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 16 G HA2 0.000 nan 3.960 nan 0.000 0.244 16 G HA3 0.000 3.887 3.960 -0.122 0.000 0.244 16 G C 0.000 174.855 174.900 -0.074 0.000 0.946 16 G CA 0.000 45.106 45.100 0.010 0.000 0.502 17 I N 1.509 121.886 120.570 -0.322 0.000 2.494 17 I HA 0.058 4.155 4.170 -0.122 0.000 0.250 17 I C 1.202 177.370 176.117 0.085 0.000 1.112 17 I CA 0.835 62.015 61.300 -0.201 0.000 1.438 17 I CB -0.215 37.449 38.000 -0.561 0.000 1.111 17 I HN -0.054 nan 8.210 nan 0.000 0.431 18 T N 2.121 116.625 114.554 -0.085 0.000 2.871 18 T HA 0.376 4.653 4.350 -0.122 0.000 0.296 18 T C 0.287 174.958 174.700 -0.049 0.000 0.998 18 T CA 0.914 62.975 62.100 -0.064 0.000 1.162 18 T CB 0.366 69.180 68.868 -0.091 0.000 0.947 18 T HN 0.696 nan 8.240 nan 0.000 0.536 19 G N 2.884 111.649 108.800 -0.059 0.000 2.339 19 G HA2 0.222 4.108 3.960 -0.122 0.000 0.275 19 G HA3 0.222 4.108 3.960 -0.122 0.000 0.275 19 G C -0.890 173.882 174.900 -0.212 0.000 1.323 19 G CA -0.929 44.067 45.100 -0.172 0.000 0.927 19 G HN 0.633 nan 8.290 nan 0.000 0.486 20 T N 0.792 115.132 114.554 -0.357 0.000 2.767 20 T HA 0.581 4.858 4.350 -0.122 0.000 0.288 20 T C -1.081 173.229 174.700 -0.651 0.000 0.963 20 T CA 0.287 62.153 62.100 -0.391 0.000 1.019 20 T CB 0.762 69.416 68.868 -0.358 0.000 0.923 20 T HN 0.433 nan 8.240 nan 0.000 0.468 21 W N 2.152 123.227 121.300 -0.375 0.000 2.736 21 W HA 0.614 5.201 4.660 -0.121 0.000 0.335 21 W C -1.045 175.341 176.519 -0.222 0.000 1.059 21 W CA -0.945 56.276 57.345 -0.207 0.000 1.226 21 W CB 1.203 30.610 29.460 -0.090 0.000 1.416 21 W HN 0.586 nan 8.180 nan 0.000 0.505 22 Y N 2.658 123.240 120.300 0.469 0.000 2.409 22 Y HA 0.301 4.778 4.550 -0.123 0.000 0.343 22 Y C 0.585 176.625 175.900 0.233 0.000 0.973 22 Y CA -1.250 57.059 58.100 0.348 0.000 1.064 22 Y CB 1.197 39.773 38.460 0.193 0.000 1.207 22 Y HN 0.429 nan 8.280 nan 0.000 0.452 23 N N 1.035 119.858 118.700 0.205 0.000 2.566 23 N HA 0.046 4.713 4.740 -0.122 0.000 0.299 23 N C 0.560 176.050 175.510 -0.034 0.000 1.277 23 N CA -0.632 52.274 53.050 -0.240 0.000 0.965 23 N CB 0.411 38.503 38.487 -0.658 0.000 1.142 23 N HN 0.668 nan 8.380 nan 0.000 0.596 24 Q N -0.772 118.971 119.800 -0.095 0.000 2.482 24 Q HA 0.073 4.340 4.340 -0.122 0.000 0.209 24 Q C 0.629 176.636 176.000 0.012 0.000 0.961 24 Q CA 0.632 56.428 55.803 -0.013 0.000 0.945 24 Q CB -0.217 28.509 28.738 -0.019 0.000 1.012 24 Q HN 0.607 nan 8.270 nan 0.000 0.515 25 L N 0.160 121.399 121.223 0.027 0.000 2.741 25 L HA 0.223 4.490 4.340 -0.122 0.000 0.237 25 L C 0.838 177.755 176.870 0.078 0.000 1.178 25 L CA 0.677 55.545 54.840 0.046 0.000 0.973 25 L CB -0.140 41.949 42.059 0.049 0.000 1.255 25 L HN 0.492 nan 8.230 nan 0.000 0.498 26 G N -0.305 108.553 108.800 0.097 0.000 2.550 26 G HA2 -0.324 3.562 3.960 -0.122 0.000 0.233 26 G HA3 -0.324 3.562 3.960 -0.122 0.000 0.233 26 G C 0.626 175.656 174.900 0.217 0.000 1.170 26 G CA 0.450 45.621 45.100 0.119 0.000 0.693 26 G HN 0.383 nan 8.290 nan 0.000 0.512 27 S N 1.343 117.189 115.700 0.242 0.000 2.554 27 S HA 0.428 4.825 4.470 -0.122 0.000 0.290 27 S C 0.391 175.269 174.600 0.464 0.000 1.309 27 S CA 1.137 59.529 58.200 0.320 0.000 1.047 27 S CB 0.794 64.231 63.200 0.395 0.000 0.828 27 S HN 0.691 nan 8.310 nan 0.000 0.509 28 T N 3.732 118.470 114.554 0.306 0.000 2.812 28 T HA 0.550 4.827 4.350 -0.122 0.000 0.282 28 T C -1.050 173.683 174.700 0.054 0.000 0.990 28 T CA -0.265 61.988 62.100 0.255 0.000 0.960 28 T CB 0.278 69.250 68.868 0.174 0.000 0.948 28 T HN 0.312 nan 8.240 nan 0.000 0.438 29 F N 3.515 123.430 119.950 -0.058 0.000 2.449 29 F HA 0.545 4.998 4.527 -0.123 0.000 0.342 29 F C -0.247 175.438 175.800 -0.191 0.000 1.127 29 F CA -1.544 56.363 58.000 -0.154 0.000 0.975 29 F CB 1.171 40.011 39.000 -0.267 0.000 1.146 29 F HN 0.275 nan 8.300 nan 0.000 0.444 30 I N 5.001 125.514 120.570 -0.095 0.000 2.330 30 I HA 0.443 4.540 4.170 -0.122 0.000 0.289 30 I C -0.392 175.638 176.117 -0.145 0.000 1.001 30 I CA -0.906 60.330 61.300 -0.106 0.000 1.193 30 I CB 1.057 38.991 38.000 -0.110 0.000 1.345 30 I HN 0.171 nan 8.210 nan 0.000 0.461 31 V N 5.573 125.412 119.914 -0.124 0.000 2.588 31 V HA 0.520 4.567 4.120 -0.122 0.000 0.304 31 V C 0.095 176.109 176.094 -0.135 0.000 1.042 31 V CA -0.424 61.761 62.300 -0.193 0.000 0.877 31 V CB 2.378 34.016 31.823 -0.309 0.000 0.996 31 V HN 0.763 nan 8.190 nan 0.000 0.425 32 T N 3.889 118.361 114.554 -0.137 0.000 2.797 32 T HA 0.666 4.942 4.350 -0.122 0.000 0.279 32 T C -0.064 174.563 174.700 -0.122 0.000 0.991 32 T CA -0.277 61.757 62.100 -0.110 0.000 0.979 32 T CB 1.541 70.364 68.868 -0.075 0.000 0.943 32 T HN 0.892 nan 8.240 nan 0.000 0.444 33 A N 2.884 125.611 122.820 -0.156 0.000 2.273 33 A HA 0.727 4.973 4.320 -0.122 0.000 0.320 33 A C 0.797 178.389 177.584 0.013 0.000 1.358 33 A CA -0.677 51.241 52.037 -0.198 0.000 0.910 33 A CB 0.111 18.747 19.000 -0.607 0.000 1.159 33 A HN 0.936 nan 8.150 nan 0.000 0.526 34 G N 0.552 109.434 108.800 0.136 0.000 2.606 34 G HA2 0.453 4.339 3.960 -0.122 0.000 0.252 34 G HA3 0.453 4.339 3.960 -0.122 0.000 0.252 34 G C 1.116 176.127 174.900 0.186 0.000 1.206 34 G CA 0.121 45.296 45.100 0.124 0.000 0.861 34 G HN 1.251 nan 8.290 nan 0.000 0.561 35 A N 0.052 122.931 122.820 0.098 0.000 1.933 35 A HA -0.024 4.222 4.320 -0.122 0.000 0.218 35 A C 1.440 179.041 177.584 0.027 0.000 1.175 35 A CA 1.790 53.872 52.037 0.075 0.000 0.628 35 A CB -0.139 18.884 19.000 0.038 0.000 0.814 35 A HN 0.504 nan 8.150 nan 0.000 0.444 36 D N -1.187 119.216 120.400 0.005 0.000 2.781 36 D HA 0.419 4.985 4.640 -0.122 0.000 0.254 36 D C 1.053 177.298 176.300 -0.093 0.000 1.213 36 D CA 0.549 54.517 54.000 -0.053 0.000 0.994 36 D CB -0.578 40.201 40.800 -0.035 0.000 1.019 36 D HN 0.449 nan 8.370 nan 0.000 0.514 37 G N 1.693 110.352 108.800 -0.235 0.000 2.200 37 G HA2 -0.262 3.625 3.960 -0.122 0.000 0.267 37 G HA3 -0.262 3.625 3.960 -0.122 0.000 0.267 37 G C 0.630 175.505 174.900 -0.041 0.000 0.993 37 G CA 0.459 45.255 45.100 -0.508 0.000 0.701 37 G HN 0.760 nan 8.290 nan 0.000 0.524 38 A N -0.630 122.261 122.820 0.119 0.000 2.354 38 A HA 0.739 4.986 4.320 -0.122 0.000 0.269 38 A C -0.176 177.540 177.584 0.220 0.000 1.109 38 A CA -0.157 51.968 52.037 0.147 0.000 0.800 38 A CB 0.900 19.944 19.000 0.074 0.000 1.045 38 A HN 0.807 nan 8.150 nan 0.000 0.489 39 L N 2.356 123.666 121.223 0.146 0.000 2.325 39 L HA 0.651 4.918 4.340 -0.122 0.000 0.281 39 L C 0.486 177.346 176.870 -0.018 0.000 1.004 39 L CA 0.393 55.256 54.840 0.038 0.000 0.823 39 L CB 1.616 43.706 42.059 0.052 0.000 1.236 39 L HN 0.946 nan 8.230 nan 0.000 0.415 40 T N 0.317 114.830 114.554 -0.069 0.000 2.903 40 T HA 1.003 5.279 4.350 -0.122 0.000 0.299 40 T C -0.219 174.403 174.700 -0.131 0.000 1.093 40 T CA -0.147 61.905 62.100 -0.079 0.000 1.002 40 T CB 2.330 71.171 68.868 -0.046 0.000 1.127 40 T HN 0.935 nan 8.240 nan 0.000 0.488 41 G N 0.691 109.408 108.800 -0.139 0.000 2.399 41 G HA2 0.556 4.442 3.960 -0.122 0.000 0.256 41 G HA3 0.556 4.442 3.960 -0.122 0.000 0.256 41 G C -0.788 174.016 174.900 -0.160 0.000 1.236 41 G CA -0.047 44.959 45.100 -0.156 0.000 0.914 41 G HN 1.681 nan 8.290 nan 0.000 0.482 42 T N -2.409 112.035 114.554 -0.184 0.000 2.896 42 T HA 0.883 5.160 4.350 -0.122 0.000 0.297 42 T C -0.407 174.118 174.700 -0.292 0.000 1.108 42 T CA 0.232 62.226 62.100 -0.177 0.000 1.004 42 T CB 1.788 70.585 68.868 -0.119 0.000 1.159 42 T HN 2.161 nan 8.240 nan 0.000 0.499 43 A N 1.622 124.255 122.820 -0.311 0.000 2.342 43 A HA 0.900 5.147 4.320 -0.122 0.000 0.323 43 A C -0.208 177.266 177.584 -0.184 0.000 1.125 43 A CA -0.794 50.894 52.037 -0.581 0.000 0.785 43 A CB 0.869 19.475 19.000 -0.657 0.000 1.221 43 A HN 1.106 nan 8.150 nan 0.000 0.463 50 A N 1.478 124.197 122.820 -0.168 0.000 1.927 50 A HA -0.230 4.017 4.320 -0.122 0.000 0.220 50 A C 1.607 179.015 177.584 -0.293 0.000 1.185 50 A CA 2.279 54.189 52.037 -0.212 0.000 0.639 50 A CB -0.765 18.063 19.000 -0.286 0.000 0.820 50 A HN 0.814 nan 8.150 nan 0.000 0.451 51 E N -0.049 119.921 120.200 -0.383 0.000 2.338 51 E HA -0.007 4.270 4.350 -0.122 0.000 0.197 51 E C 1.293 177.790 176.600 -0.171 0.000 1.007 51 E CA 1.029 57.222 56.400 -0.345 0.000 0.849 51 E CB 0.039 29.561 29.700 -0.297 0.000 0.774 51 E HN 0.541 nan 8.360 nan 0.000 0.506 52 S N -0.057 115.566 115.700 -0.129 0.000 2.602 52 S HA 0.184 4.581 4.470 -0.122 0.000 0.240 52 S C 0.317 174.907 174.600 -0.015 0.000 0.992 52 S CA -0.487 57.717 58.200 0.007 0.000 0.971 52 S CB 0.268 63.511 63.200 0.072 0.000 0.855 52 S HN 0.066 nan 8.310 nan 0.000 0.481 53 R N 1.094 121.450 120.500 -0.240 0.000 2.346 53 R HA 0.545 4.812 4.340 -0.122 0.000 0.311 53 R C -1.668 174.431 176.300 -0.335 0.000 0.983 53 R CA -0.224 55.784 56.100 -0.154 0.000 0.880 53 R CB 0.533 30.769 30.300 -0.106 0.000 1.100 53 R HN 0.095 nan 8.270 nan 0.000 0.453 54 Y N 1.620 121.906 120.300 -0.023 0.000 2.581 54 Y HA 0.380 4.857 4.550 -0.120 0.000 0.345 54 Y C -0.423 175.399 175.900 -0.131 0.000 1.036 54 Y CA -1.079 56.986 58.100 -0.057 0.000 1.042 54 Y CB 1.738 40.145 38.460 -0.089 0.000 1.289 54 Y HN 0.190 nan 8.280 nan 0.000 0.471 55 V N 3.693 123.633 119.914 0.042 0.000 2.649 55 V HA 0.334 4.380 4.120 -0.122 0.000 0.292 55 V C -0.457 175.597 176.094 -0.066 0.000 1.055 55 V CA -0.388 61.893 62.300 -0.032 0.000 1.023 55 V CB 0.933 32.743 31.823 -0.023 0.000 0.992 55 V HN 0.551 nan 8.190 nan 0.000 0.480 56 L N 3.401 124.569 121.223 -0.092 0.000 2.362 56 L HA 0.961 5.228 4.340 -0.122 0.000 0.271 56 L C -0.480 176.362 176.870 -0.045 0.000 1.002 56 L CA -0.143 54.647 54.840 -0.084 0.000 0.818 56 L CB 2.073 44.007 42.059 -0.209 0.000 1.298 56 L HN 0.573 nan 8.230 nan 0.000 0.420 57 T N 1.553 116.129 114.554 0.037 0.000 2.952 57 T HA 0.904 5.181 4.350 -0.122 0.000 0.305 57 T C -0.478 174.307 174.700 0.142 0.000 1.064 57 T CA 0.199 62.331 62.100 0.054 0.000 1.008 57 T CB 1.173 70.066 68.868 0.041 0.000 1.078 57 T HN 1.353 nan 8.240 nan 0.000 0.459 58 G N 2.957 111.842 108.800 0.141 0.000 2.634 58 G HA2 0.731 4.618 3.960 -0.122 0.000 0.309 58 G HA3 0.731 4.618 3.960 -0.122 0.000 0.309 58 G C -1.941 173.059 174.900 0.168 0.000 1.299 58 G CA -0.801 44.422 45.100 0.205 0.000 0.798 58 G HN 0.706 nan 8.290 nan 0.000 0.490 59 R N -1.050 119.562 120.500 0.186 0.000 2.740 59 R HA 0.578 4.845 4.340 -0.122 0.000 0.273 59 R C -1.670 174.772 176.300 0.236 0.000 0.998 59 R CA -0.669 55.529 56.100 0.163 0.000 0.900 59 R CB 1.863 32.207 30.300 0.073 0.000 1.223 59 R HN 0.863 nan 8.270 nan 0.000 0.466 60 Y N -2.159 118.158 120.300 0.028 0.000 2.588 60 Y HA 0.419 4.896 4.550 -0.123 0.000 0.343 60 Y C -0.750 175.159 175.900 0.015 0.000 1.065 60 Y CA -1.602 56.511 58.100 0.022 0.000 1.038 60 Y CB 1.102 39.565 38.460 0.005 0.000 1.297 60 Y HN 0.423 nan 8.280 nan 0.000 0.467 61 D N 1.622 122.012 120.400 -0.016 0.000 2.342 61 D HA 0.092 4.659 4.640 -0.122 0.000 0.260 61 D C 0.853 177.062 176.300 -0.152 0.000 1.278 61 D CA 0.650 54.593 54.000 -0.094 0.000 0.910 61 D CB 0.856 41.671 40.800 0.025 0.000 1.079 61 D HN 0.702 nan 8.370 nan 0.000 0.496 62 S N 2.377 117.842 115.700 -0.392 0.000 2.562 62 S HA 0.141 4.538 4.470 -0.122 0.000 0.221 62 S C 0.875 175.445 174.600 -0.050 0.000 0.975 62 S CA 0.001 58.031 58.200 -0.283 0.000 0.918 62 S CB 0.293 63.257 63.200 -0.394 0.000 0.772 62 S HN 0.429 nan 8.310 nan 0.000 0.531 63 A N 2.607 125.406 122.820 -0.035 0.000 3.258 63 A HA 0.611 4.858 4.320 -0.122 0.000 0.318 63 A C -2.601 174.998 177.584 0.025 0.000 0.990 63 A CA -1.338 50.702 52.037 0.005 0.000 0.885 63 A CB 0.337 19.331 19.000 -0.011 0.000 1.090 63 A HN 0.396 nan 8.150 nan 0.000 0.479 64 P HA 0.469 nan 4.420 nan 0.000 0.274 64 P C 0.481 177.811 177.300 0.050 0.000 1.246 64 P CA -0.088 63.049 63.100 0.062 0.000 0.795 64 P CB 0.841 32.602 31.700 0.101 0.000 1.006 65 A N 0.942 123.788 122.820 0.044 0.000 2.409 65 A HA 0.239 4.486 4.320 -0.122 0.000 0.246 65 A C 1.220 178.829 177.584 0.041 0.000 1.099 65 A CA 0.594 52.653 52.037 0.036 0.000 0.789 65 A CB -0.851 18.167 19.000 0.029 0.000 1.053 65 A HN 0.608 nan 8.150 nan 0.000 0.503 66 T N -0.220 114.354 114.554 0.034 0.000 3.014 66 T HA 0.035 4.311 4.350 -0.122 0.000 0.250 66 T C 0.578 175.297 174.700 0.031 0.000 1.060 66 T CA 0.625 62.746 62.100 0.035 0.000 1.040 66 T CB -0.238 68.648 68.868 0.030 0.000 0.971 66 T HN 0.824 nan 8.240 nan 0.000 0.497 67 D N 2.236 122.652 120.400 0.027 0.000 2.489 67 D HA 0.149 4.716 4.640 -0.122 0.000 0.264 67 D C 1.552 177.865 176.300 0.022 0.000 1.294 67 D CA 0.359 54.372 54.000 0.022 0.000 0.938 67 D CB -1.423 39.388 40.800 0.018 0.000 0.985 67 D HN 0.410 nan 8.370 nan 0.000 0.492 68 G N -0.732 108.084 108.800 0.026 0.000 2.186 68 G HA2 -0.339 3.548 3.960 -0.122 0.000 0.266 68 G HA3 -0.339 3.548 3.960 -0.122 0.000 0.266 68 G C 0.484 175.396 174.900 0.021 0.000 0.982 68 G CA 0.521 45.634 45.100 0.022 0.000 0.670 68 G HN 0.514 nan 8.290 nan 0.000 0.533 69 S N 0.156 115.873 115.700 0.028 0.000 2.584 69 S HA 0.536 4.933 4.470 -0.122 0.000 0.270 69 S C 1.218 175.843 174.600 0.041 0.000 1.346 69 S CA 0.091 58.309 58.200 0.030 0.000 1.018 69 S CB 1.143 64.363 63.200 0.032 0.000 0.899 69 S HN 1.139 nan 8.310 nan 0.000 0.542 70 G N 0.788 109.611 108.800 0.038 0.000 2.599 70 G HA2 0.391 4.278 3.960 -0.122 0.000 0.264 70 G HA3 0.391 4.278 3.960 -0.122 0.000 0.264 70 G C -0.625 174.337 174.900 0.104 0.000 1.200 70 G CA -0.433 44.699 45.100 0.054 0.000 0.896 70 G HN 0.576 nan 8.290 nan 0.000 0.536 71 T N 0.952 115.611 114.554 0.174 0.000 2.753 71 T HA 0.533 4.810 4.350 -0.122 0.000 0.297 71 T C 0.642 175.440 174.700 0.162 0.000 0.981 71 T CA 0.005 62.224 62.100 0.199 0.000 0.956 71 T CB 0.960 70.009 68.868 0.301 0.000 0.936 71 T HN 0.816 nan 8.240 nan 0.000 0.463 72 A N 4.142 127.032 122.820 0.116 0.000 2.462 72 A HA 0.636 4.882 4.320 -0.122 0.000 0.243 72 A C -0.164 177.489 177.584 0.116 0.000 1.076 72 A CA -0.157 51.934 52.037 0.089 0.000 0.773 72 A CB -0.322 18.713 19.000 0.058 0.000 1.010 72 A HN 0.804 nan 8.150 nan 0.000 0.493 73 L N -0.763 120.514 121.223 0.090 0.000 2.801 73 L HA 1.028 5.295 4.340 -0.122 0.000 0.264 73 L C -0.065 176.838 176.870 0.055 0.000 1.086 73 L CA -0.057 54.856 54.840 0.122 0.000 0.920 73 L CB 1.020 43.180 42.059 0.168 0.000 1.529 73 L HN 1.268 nan 8.230 nan 0.000 0.399 74 G N -1.639 107.220 108.800 0.099 0.000 2.632 74 G HA2 0.632 4.518 3.960 -0.122 0.000 0.292 74 G HA3 0.632 4.518 3.960 -0.122 0.000 0.292 74 G C -2.610 172.406 174.900 0.194 0.000 1.465 74 G CA -0.059 45.048 45.100 0.011 0.000 0.824 74 G HN 1.471 nan 8.290 nan 0.000 0.509 75 W N -0.516 120.860 121.300 0.125 0.000 3.074 75 W HA 0.823 5.411 4.660 -0.120 0.000 0.332 75 W C -1.044 175.611 176.519 0.226 0.000 1.253 75 W CA -1.342 56.069 57.345 0.110 0.000 1.180 75 W CB 0.848 30.312 29.460 0.006 0.000 1.445 75 W HN 0.623 nan 8.180 nan 0.000 0.573 76 T N 1.603 116.441 114.554 0.474 0.000 2.893 76 T HA 0.662 4.939 4.350 -0.122 0.000 0.291 76 T C -1.514 173.356 174.700 0.283 0.000 1.028 76 T CA -0.699 61.605 62.100 0.339 0.000 0.995 76 T CB 1.903 70.864 68.868 0.154 0.000 1.051 76 T HN 0.467 nan 8.240 nan 0.000 0.470 77 V N 2.013 122.020 119.914 0.156 0.000 2.524 77 V HA 0.692 4.739 4.120 -0.122 0.000 0.297 77 V C -0.045 175.730 176.094 -0.532 0.000 1.035 77 V CA -0.986 61.179 62.300 -0.225 0.000 0.867 77 V CB 1.468 33.029 31.823 -0.437 0.000 1.004 77 V HN 1.141 nan 8.190 nan 0.000 0.426 78 A N 4.020 126.611 122.820 -0.382 0.000 2.331 78 A HA 0.602 4.849 4.320 -0.122 0.000 0.283 78 A C -0.562 176.759 177.584 -0.438 0.000 1.142 78 A CA -0.354 51.482 52.037 -0.335 0.000 0.812 78 A CB 0.302 19.247 19.000 -0.092 0.000 1.074 78 A HN 0.917 nan 8.150 nan 0.000 0.497 79 W N 2.253 123.520 121.300 -0.055 0.000 1.496 79 W HA 0.414 5.000 4.660 -0.123 0.000 0.422 79 W C 0.627 177.209 176.519 0.105 0.000 0.638 79 W CA -0.085 57.150 57.345 -0.183 0.000 2.105 79 W CB 0.131 29.417 29.460 -0.289 0.000 1.639 79 W HN 0.625 nan 8.180 nan 0.000 0.304 80 K N 2.860 123.469 120.400 0.349 0.000 2.471 80 K HA 0.278 4.525 4.320 -0.122 0.000 0.252 80 K C -0.364 176.378 176.600 0.236 0.000 0.938 80 K CA -0.508 55.935 56.287 0.259 0.000 0.796 80 K CB 0.870 33.429 32.500 0.098 0.000 1.161 80 K HN 0.193 nan 8.250 nan 0.000 0.425 81 N N 1.473 120.235 118.700 0.105 0.000 3.379 81 N HA 0.167 4.833 4.740 -0.122 0.000 0.350 81 N C -0.093 175.342 175.510 -0.126 0.000 1.553 81 N CA -0.754 52.261 53.050 -0.059 0.000 0.712 81 N CB 0.036 38.383 38.487 -0.233 0.000 1.880 81 N HN 0.574 nan 8.380 nan 0.000 0.648 82 N N -1.800 116.723 118.700 -0.295 0.000 2.520 82 N HA -0.019 4.648 4.740 -0.122 0.000 0.185 82 N C 0.042 175.158 175.510 -0.657 0.000 1.068 82 N CA 0.855 53.570 53.050 -0.558 0.000 0.911 82 N CB -0.100 37.844 38.487 -0.906 0.000 0.961 82 N HN 0.400 nan 8.380 nan 0.000 0.446 83 Y N -0.599 119.667 120.300 -0.058 0.000 2.483 83 Y HA 0.365 4.841 4.550 -0.123 0.000 0.258 83 Y C 0.628 176.518 175.900 -0.016 0.000 1.083 83 Y CA -0.190 57.886 58.100 -0.040 0.000 1.283 83 Y CB 0.722 39.147 38.460 -0.058 0.000 1.178 83 Y HN -0.221 nan 8.280 nan 0.000 0.515 84 R N 0.682 121.255 120.500 0.121 0.000 2.740 84 R HA 0.359 4.625 4.340 -0.122 0.000 0.273 84 R C -1.750 174.603 176.300 0.088 0.000 0.998 84 R CA -0.788 55.384 56.100 0.119 0.000 0.900 84 R CB 2.066 32.481 30.300 0.193 0.000 1.223 84 R HN -0.051 nan 8.270 nan 0.000 0.466 85 N N 0.554 119.261 118.700 0.012 0.000 2.571 85 N HA 0.258 4.924 4.740 -0.122 0.000 0.286 85 N C -0.876 174.498 175.510 -0.227 0.000 1.138 85 N CA -0.169 52.815 53.050 -0.110 0.000 0.859 85 N CB 1.984 40.322 38.487 -0.249 0.000 1.414 85 N HN 0.689 nan 8.380 nan 0.000 0.529 86 A N 2.236 125.022 122.820 -0.056 0.000 2.307 86 A HA 0.183 4.430 4.320 -0.122 0.000 0.218 86 A C 0.062 177.670 177.584 0.039 0.000 1.228 86 A CA 0.047 52.072 52.037 -0.019 0.000 0.857 86 A CB -0.517 18.505 19.000 0.037 0.000 0.897 86 A HN 0.790 nan 8.150 nan 0.000 0.495 87 H N 0.295 119.435 119.070 0.116 0.000 2.756 87 H HA -0.154 4.329 4.556 -0.123 0.000 0.315 87 H C 0.118 175.501 175.328 0.092 0.000 1.210 87 H CA 0.895 56.994 56.048 0.085 0.000 1.150 87 H CB -2.091 27.703 29.762 0.053 0.000 1.463 87 H HN 0.861 nan 8.280 nan 0.000 0.427 88 S N -1.810 114.021 115.700 0.218 0.000 2.588 88 S HA 0.900 5.296 4.470 -0.122 0.000 0.269 88 S C -0.776 173.975 174.600 0.252 0.000 1.157 88 S CA -0.445 57.888 58.200 0.221 0.000 0.824 88 S CB 3.076 66.405 63.200 0.214 0.000 1.126 88 S HN 0.896 nan 8.310 nan 0.000 0.464 89 A N 0.866 123.800 122.820 0.190 0.000 2.486 89 A HA 0.834 5.081 4.320 -0.122 0.000 0.300 89 A C -0.550 177.097 177.584 0.105 0.000 1.048 89 A CA -0.721 51.351 52.037 0.058 0.000 0.696 89 A CB 1.724 20.733 19.000 0.015 0.000 1.278 89 A HN 0.837 nan 8.150 nan 0.000 0.405 90 T N 2.114 116.698 114.554 0.049 0.000 2.823 90 T HA 0.684 4.961 4.350 -0.122 0.000 0.279 90 T C 0.085 174.717 174.700 -0.113 0.000 0.998 90 T CA -0.096 61.969 62.100 -0.057 0.000 0.994 90 T CB 1.310 70.089 68.868 -0.148 0.000 0.960 90 T HN 0.975 nan 8.240 nan 0.000 0.448 91 T N 0.261 114.730 114.554 -0.141 0.000 2.855 91 T HA 0.619 4.896 4.350 -0.122 0.000 0.281 91 T C -0.950 173.650 174.700 -0.167 0.000 1.007 91 T CA -0.901 61.178 62.100 -0.036 0.000 1.009 91 T CB 1.202 70.076 68.868 0.011 0.000 0.983 91 T HN 0.555 nan 8.240 nan 0.000 0.455 92 W N 1.713 122.851 121.300 -0.269 0.000 2.475 92 W HA 0.562 5.152 4.660 -0.117 0.000 0.317 92 W C 0.032 176.287 176.519 -0.438 0.000 1.046 92 W CA -0.864 56.243 57.345 -0.396 0.000 1.215 92 W CB 2.176 31.086 29.460 -0.917 0.000 1.335 92 W HN 0.712 nan 8.180 nan 0.000 0.471 93 S N 2.116 117.786 115.700 -0.049 0.000 2.502 93 S HA 0.889 5.286 4.470 -0.122 0.000 0.304 93 S C -0.111 174.463 174.600 -0.043 0.000 1.097 93 S CA -0.018 58.143 58.200 -0.064 0.000 1.045 93 S CB 1.383 64.564 63.200 -0.031 0.000 1.019 93 S HN 0.754 nan 8.310 nan 0.000 0.481 94 G N 2.661 111.431 108.800 -0.051 0.000 2.428 94 G HA2 0.531 4.418 3.960 -0.122 0.000 0.305 94 G HA3 0.531 4.418 3.960 -0.122 0.000 0.305 94 G C -2.153 172.751 174.900 0.007 0.000 1.260 94 G CA -0.665 44.427 45.100 -0.013 0.000 0.853 94 G HN 0.895 nan 8.290 nan 0.000 0.480 95 Q N -1.264 118.553 119.800 0.028 0.000 2.340 95 Q HA 0.591 4.857 4.340 -0.122 0.000 0.276 95 Q C -1.908 174.139 176.000 0.079 0.000 1.048 95 Q CA -1.068 54.771 55.803 0.060 0.000 0.832 95 Q CB 2.583 31.353 28.738 0.053 0.000 1.373 95 Q HN 0.794 nan 8.270 nan 0.000 0.409 96 Y N 1.930 122.215 120.300 -0.026 0.000 2.316 96 Y HA 0.530 5.007 4.550 -0.123 0.000 0.331 96 Y C -1.400 174.518 175.900 0.030 0.000 1.083 96 Y CA -0.383 57.694 58.100 -0.038 0.000 1.206 96 Y CB 1.206 39.629 38.460 -0.062 0.000 1.195 96 Y HN 0.509 nan 8.280 nan 0.000 0.497 97 V N 7.135 126.732 119.914 -0.527 0.000 2.495 97 V HA 0.593 4.640 4.120 -0.122 0.000 0.298 97 V C 0.592 176.268 176.094 -0.697 0.000 1.031 97 V CA -0.330 61.683 62.300 -0.477 0.000 0.871 97 V CB 1.164 32.882 31.823 -0.176 0.000 0.988 97 V HN 1.067 nan 8.190 nan 0.000 0.432 98 G N 2.086 110.570 108.800 -0.527 0.000 2.525 98 G HA2 0.754 4.640 3.960 -0.122 0.000 0.287 98 G HA3 0.754 4.640 3.960 -0.122 0.000 0.287 98 G C 0.279 175.128 174.900 -0.084 0.000 1.350 98 G CA 0.159 45.088 45.100 -0.285 0.000 1.039 98 G HN 1.603 nan 8.290 nan 0.000 0.513 99 G N -2.106 106.697 108.800 0.005 0.000 2.447 99 G HA2 0.363 4.250 3.960 -0.122 0.000 0.220 99 G HA3 0.363 4.250 3.960 -0.122 0.000 0.220 99 G C 0.910 175.831 174.900 0.035 0.000 1.261 99 G CA 0.582 45.694 45.100 0.020 0.000 1.000 99 G HN 1.696 nan 8.290 nan 0.000 0.515 100 A N -0.731 122.106 122.820 0.029 0.000 2.072 100 A HA 0.457 4.703 4.320 -0.122 0.000 0.216 100 A C 1.452 179.058 177.584 0.037 0.000 1.156 100 A CA 2.238 54.294 52.037 0.030 0.000 0.701 100 A CB -0.072 18.941 19.000 0.023 0.000 0.816 100 A HN 1.108 nan 8.150 nan 0.000 0.458 101 E N 0.647 120.870 120.200 0.037 0.000 2.698 101 E HA 0.527 4.804 4.350 -0.122 0.000 0.242 101 E C 0.064 176.705 176.600 0.068 0.000 1.243 101 E CA -0.067 56.365 56.400 0.053 0.000 1.483 101 E CB -0.516 29.210 29.700 0.045 0.000 1.495 101 E HN 0.411 nan 8.360 nan 0.000 0.440 102 A N 2.227 125.101 122.820 0.089 0.000 2.584 102 A HA 0.254 4.500 4.320 -0.122 0.000 0.239 102 A C 0.074 177.831 177.584 0.287 0.000 1.043 102 A CA 0.506 52.630 52.037 0.145 0.000 0.756 102 A CB 0.184 19.345 19.000 0.268 0.000 0.963 102 A HN 0.533 nan 8.150 nan 0.000 0.511 103 R N 0.817 121.441 120.500 0.206 0.000 2.774 103 R HA 0.631 4.898 4.340 -0.122 0.000 0.272 103 R C -1.339 175.036 176.300 0.125 0.000 1.000 103 R CA -0.658 55.617 56.100 0.293 0.000 0.906 103 R CB 1.977 32.374 30.300 0.162 0.000 1.227 103 R HN 0.682 nan 8.270 nan 0.000 0.468 104 I N 2.153 122.781 120.570 0.097 0.000 2.382 104 I HA 0.322 4.419 4.170 -0.122 0.000 0.286 104 I C -0.712 175.507 176.117 0.171 0.000 1.002 104 I CA -0.827 60.472 61.300 -0.001 0.000 1.135 104 I CB 1.553 39.373 38.000 -0.301 0.000 1.288 104 I HN 0.338 nan 8.210 nan 0.000 0.448 105 N N 5.071 123.843 118.700 0.121 0.000 2.419 105 N HA 0.466 5.133 4.740 -0.122 0.000 0.277 105 N C -0.346 175.256 175.510 0.153 0.000 1.006 105 N CA -0.204 52.939 53.050 0.155 0.000 0.923 105 N CB 2.136 40.679 38.487 0.094 0.000 1.140 105 N HN 0.657 nan 8.380 nan 0.000 0.488 106 T N -1.179 113.519 114.554 0.239 0.000 2.883 106 T HA 0.469 4.746 4.350 -0.122 0.000 0.296 106 T C -0.741 174.095 174.700 0.226 0.000 1.117 106 T CA -0.907 61.324 62.100 0.219 0.000 1.006 106 T CB 2.166 71.231 68.868 0.329 0.000 1.191 106 T HN 0.244 nan 8.240 nan 0.000 0.508 107 Q N 0.926 120.798 119.800 0.120 0.000 2.345 107 Q HA 0.490 4.757 4.340 -0.122 0.000 0.268 107 Q C -1.033 174.960 176.000 -0.012 0.000 1.054 107 Q CA -0.901 54.899 55.803 -0.006 0.000 0.835 107 Q CB 2.538 31.227 28.738 -0.081 0.000 1.339 107 Q HN 0.855 nan 8.270 nan 0.000 0.447 108 W N 1.724 122.935 121.300 -0.148 0.000 2.882 108 W HA 0.717 5.303 4.660 -0.122 0.000 0.345 108 W C -1.853 174.512 176.519 -0.257 0.000 1.125 108 W CA -1.050 56.077 57.345 -0.364 0.000 1.167 108 W CB 0.734 29.716 29.460 -0.795 0.000 1.431 108 W HN 0.406 nan 8.180 nan 0.000 0.543 109 L N 3.567 124.833 121.223 0.071 0.000 2.356 109 L HA 0.437 4.704 4.340 -0.122 0.000 0.277 109 L C -0.835 176.129 176.870 0.157 0.000 0.996 109 L CA -1.061 53.827 54.840 0.080 0.000 0.822 109 L CB 1.796 43.855 42.059 0.001 0.000 1.256 109 L HN 0.273 nan 8.230 nan 0.000 0.413 110 L N 3.015 124.384 121.223 0.244 0.000 2.305 110 L HA 0.620 4.886 4.340 -0.122 0.000 0.284 110 L C -0.429 176.501 176.870 0.101 0.000 1.013 110 L CA 0.289 55.219 54.840 0.151 0.000 0.819 110 L CB 1.721 43.861 42.059 0.135 0.000 1.227 110 L HN 0.462 nan 8.230 nan 0.000 0.417 111 T N 3.293 117.894 114.554 0.078 0.000 2.823 111 T HA 0.634 4.911 4.350 -0.122 0.000 0.279 111 T C -0.342 174.396 174.700 0.063 0.000 0.998 111 T CA -0.439 61.693 62.100 0.053 0.000 0.994 111 T CB 1.291 70.183 68.868 0.040 0.000 0.960 111 T HN 0.677 nan 8.240 nan 0.000 0.448 112 S N 1.188 116.909 115.700 0.036 0.000 2.549 112 S HA 0.653 5.050 4.470 -0.122 0.000 0.297 112 S C 0.631 175.248 174.600 0.028 0.000 1.115 112 S CA -0.934 57.293 58.200 0.046 0.000 1.059 112 S CB 1.520 64.733 63.200 0.021 0.000 1.046 112 S HN 0.918 nan 8.310 nan 0.000 0.506 113 G N 1.988 110.817 108.800 0.048 0.000 2.343 113 G HA2 0.448 4.334 3.960 -0.122 0.000 0.254 113 G HA3 0.448 4.334 3.960 -0.122 0.000 0.254 113 G C 0.145 175.032 174.900 -0.022 0.000 1.277 113 G CA -0.170 44.937 45.100 0.012 0.000 0.909 113 G HN 0.712 nan 8.290 nan 0.000 0.502 114 T N -1.028 113.506 114.554 -0.034 0.000 2.864 114 T HA 0.750 5.026 4.350 -0.122 0.000 0.289 114 T C 0.535 175.211 174.700 -0.039 0.000 1.082 114 T CA -0.219 61.851 62.100 -0.051 0.000 1.009 114 T CB 1.430 70.250 68.868 -0.080 0.000 1.234 114 T HN 0.746 nan 8.240 nan 0.000 0.526 115 T N -0.729 113.803 114.554 -0.036 0.000 2.828 115 T HA 0.326 4.603 4.350 -0.122 0.000 0.290 115 T C 0.968 175.666 174.700 -0.003 0.000 1.019 115 T CA -0.413 61.677 62.100 -0.017 0.000 1.031 115 T CB 0.453 69.316 68.868 -0.009 0.000 1.001 115 T HN 0.673 nan 8.240 nan 0.000 0.531 116 E N 0.843 121.050 120.200 0.013 0.000 2.118 116 E HA -0.041 4.236 4.350 -0.122 0.000 0.195 116 E C 2.359 178.995 176.600 0.060 0.000 0.992 116 E CA 1.397 57.816 56.400 0.031 0.000 0.804 116 E CB -0.765 28.955 29.700 0.032 0.000 0.741 116 E HN 0.773 nan 8.360 nan 0.000 0.458 117 A N 1.220 124.076 122.820 0.061 0.000 1.933 117 A HA -0.165 4.082 4.320 -0.122 0.000 0.218 117 A C 1.429 179.110 177.584 0.162 0.000 1.175 117 A CA 1.587 53.688 52.037 0.106 0.000 0.628 117 A CB -0.232 18.816 19.000 0.080 0.000 0.814 117 A HN 0.135 nan 8.150 nan 0.000 0.444 118 N N -0.591 118.132 118.700 0.038 0.000 2.235 118 N HA 0.325 4.991 4.740 -0.122 0.000 0.209 118 N C 1.218 176.564 175.510 -0.274 0.000 1.122 118 N CA 0.685 53.649 53.050 -0.143 0.000 0.845 118 N CB 0.104 38.499 38.487 -0.154 0.000 1.004 118 N HN 0.410 nan 8.380 nan 0.000 0.499 119 A N 1.144 123.921 122.820 -0.072 0.000 1.940 119 A HA -0.138 4.108 4.320 -0.122 0.000 0.219 119 A C 1.850 179.396 177.584 -0.063 0.000 1.176 119 A CA 1.034 53.041 52.037 -0.051 0.000 0.631 119 A CB -0.943 18.080 19.000 0.037 0.000 0.814 119 A HN 0.652 nan 8.150 nan 0.000 0.446 120 W N 1.253 122.556 121.300 0.005 0.000 2.387 120 W HA -0.125 4.533 4.660 -0.003 0.000 0.272 120 W C 0.711 177.233 176.519 0.004 0.000 1.224 120 W CA 1.229 58.576 57.345 0.003 0.000 1.210 120 W CB -0.485 28.975 29.460 0.001 0.000 1.125 120 W HN 0.500 nan 8.180 nan 0.000 0.572 121 K N 1.451 121.325 120.400 -0.876 0.000 2.699 121 K HA 0.254 4.501 4.320 -0.122 0.000 0.210 121 K C 1.120 177.500 176.600 -0.367 0.000 1.076 121 K CA 0.540 56.394 56.287 -0.723 0.000 1.109 121 K CB -0.031 31.725 32.500 -1.239 0.000 0.862 121 K HN -0.005 nan 8.250 nan 0.000 0.470 122 S N -0.371 115.200 115.700 -0.215 0.000 2.501 122 S HA 0.014 4.411 4.470 -0.122 0.000 0.220 122 S C 0.450 175.017 174.600 -0.056 0.000 0.997 122 S CA -0.024 58.103 58.200 -0.122 0.000 0.919 122 S CB -0.036 63.119 63.200 -0.075 0.000 0.778 122 S HN 0.212 nan 8.310 nan 0.000 0.523 123 T N 2.580 117.111 114.554 -0.039 0.000 2.840 123 T HA 0.582 4.858 4.350 -0.122 0.000 0.287 123 T C -0.633 174.072 174.700 0.009 0.000 0.991 123 T CA -0.587 61.514 62.100 0.001 0.000 0.964 123 T CB 1.459 70.330 68.868 0.005 0.000 0.954 123 T HN 0.184 nan 8.240 nan 0.000 0.438 124 L N 2.753 124.008 121.223 0.053 0.000 2.360 124 L HA 0.809 5.076 4.340 -0.122 0.000 0.271 124 L C -0.122 176.735 176.870 -0.023 0.000 1.057 124 L CA -1.016 53.859 54.840 0.060 0.000 0.803 124 L CB 1.565 43.738 42.059 0.190 0.000 1.207 124 L HN 0.329 nan 8.230 nan 0.000 0.445 125 V N 0.912 120.685 119.914 -0.235 0.000 2.823 125 V HA 0.988 5.035 4.120 -0.122 0.000 0.312 125 V C -0.185 175.300 176.094 -1.015 0.000 1.072 125 V CA 0.165 62.145 62.300 -0.533 0.000 0.937 125 V CB 1.856 33.492 31.823 -0.311 0.000 1.013 125 V HN 0.886 nan 8.190 nan 0.000 0.430 126 G N 3.598 111.387 108.800 -1.684 0.000 2.561 126 G HA2 0.607 4.493 3.960 -0.122 0.000 0.310 126 G HA3 0.607 4.493 3.960 -0.122 0.000 0.310 126 G C -1.582 172.614 174.900 -1.172 0.000 1.292 126 G CA -0.063 44.156 45.100 -1.468 0.000 0.811 126 G HN 1.610 nan 8.290 nan 0.000 0.482 127 H N -1.361 117.415 119.070 -0.491 0.000 2.928 127 H HA 0.849 5.331 4.556 -0.124 0.000 0.371 127 H C -1.841 173.689 175.328 0.338 0.000 1.186 127 H CA -0.830 55.162 56.048 -0.094 0.000 1.134 127 H CB 2.928 32.651 29.762 -0.064 0.000 1.824 127 H HN 0.403 nan 8.280 nan 0.000 0.554 128 D N 0.527 121.090 120.400 0.271 0.000 2.645 128 D HA 0.371 4.938 4.640 -0.122 0.000 0.228 128 D C -0.980 175.382 176.300 0.104 0.000 1.148 128 D CA -0.430 53.623 54.000 0.089 0.000 0.860 128 D CB 2.875 43.787 40.800 0.188 0.000 1.548 128 D HN 0.682 nan 8.370 nan 0.000 0.460 129 T N 1.713 116.224 114.554 -0.072 0.000 2.812 129 T HA 0.515 4.792 4.350 -0.122 0.000 0.282 129 T C -0.613 174.029 174.700 -0.098 0.000 0.990 129 T CA -0.406 61.722 62.100 0.046 0.000 0.960 129 T CB 0.458 69.406 68.868 0.133 0.000 0.948 129 T HN 0.086 nan 8.240 nan 0.000 0.438 130 F N 2.264 122.298 119.950 0.139 0.000 2.469 130 F HA 0.624 5.077 4.527 -0.123 0.000 0.332 130 F C 1.056 177.112 175.800 0.426 0.000 1.103 130 F CA -0.707 57.425 58.000 0.219 0.000 0.979 130 F CB 2.001 41.047 39.000 0.076 0.000 1.137 130 F HN 0.511 nan 8.300 nan 0.000 0.463 131 T N -1.370 113.561 114.554 0.628 0.000 2.916 131 T HA 0.409 4.686 4.350 -0.122 0.000 0.292 131 T C 0.326 175.248 174.700 0.371 0.000 1.064 131 T CA -1.048 61.351 62.100 0.498 0.000 1.011 131 T CB 2.285 71.326 68.868 0.288 0.000 1.152 131 T HN 0.565 nan 8.240 nan 0.000 0.510 132 K N -0.063 120.383 120.400 0.076 0.000 2.361 132 K HA 0.248 4.494 4.320 -0.122 0.000 0.196 132 K C 0.810 177.477 176.600 0.111 0.000 1.039 132 K CA 0.299 56.482 56.287 -0.174 0.000 1.001 132 K CB 0.089 32.380 32.500 -0.348 0.000 0.795 132 K HN 0.605 nan 8.250 nan 0.000 0.495 133 V N 0.000 120.004 119.914 0.149 0.000 2.409 133 V HA 0.000 4.047 4.120 -0.122 0.000 0.244 133 V CA 0.000 62.354 62.300 0.091 0.000 1.235 133 V CB 0.000 31.838 31.823 0.026 0.000 1.184 133 V HN 0.000 nan 8.190 nan 0.000 0.556