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 2j4h_1_A DATA FIRST_RESID 1 DATA SEQUENCE MRLCDRDIEA WLDEGRLSIN PRPPVERING ATVDVRLGNK FRTFRGHTAA DATA SEQUENCE FIDLSGPKDE VSAALDRVMS DEIVLDEGEA FYLHPGELAL AVTLESVTLP DATA SEQUENCE ADLVGWLDGR SSLARLGLMV AVTAHRIDPG WSGCIVLEFY NSGKLPLALR DATA SEQUENCE PGMLIGALSF EPLSGPAVRP YNRR 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 1 M HA 0.000 nan 4.480 nan 0.000 0.227 1 M C 0.000 176.312 176.300 0.020 0.000 1.140 1 M CA 0.000 55.314 55.300 0.023 0.000 0.988 1 M CB 0.000 32.618 32.600 0.031 0.000 1.302 2 R N 3.684 124.193 120.500 0.015 0.000 2.490 2 R HA 0.509 4.883 4.340 0.057 0.000 0.280 2 R C -0.660 175.644 176.300 0.006 0.000 1.077 2 R CA -0.437 55.674 56.100 0.019 0.000 1.065 2 R CB 0.431 30.742 30.300 0.018 0.000 1.003 2 R HN 0.781 nan 8.270 nan 0.000 0.470 3 L N 3.295 124.509 121.223 -0.015 0.000 2.453 3 L HA 0.046 4.420 4.340 0.057 0.000 0.272 3 L C 1.051 177.932 176.870 0.018 0.000 1.182 3 L CA -0.387 54.430 54.840 -0.038 0.000 0.858 3 L CB 0.027 41.993 42.059 -0.155 0.000 1.120 3 L HN 0.733 nan 8.230 nan 0.000 0.474 4 C N 0.351 119.666 119.300 0.026 0.000 2.480 4 C HA 0.234 4.728 4.460 0.057 0.000 0.358 4 C C 1.694 176.710 174.990 0.043 0.000 1.309 4 C CA -0.453 58.587 59.018 0.036 0.000 2.465 4 C CB 0.794 28.555 27.740 0.035 0.000 2.379 4 C HN 0.928 nan 8.230 nan 0.000 0.642 5 D N 1.016 121.443 120.400 0.045 0.000 2.116 5 D HA -0.252 4.422 4.640 0.057 0.000 0.193 5 D C 1.838 178.166 176.300 0.047 0.000 0.998 5 D CA 1.750 55.778 54.000 0.048 0.000 0.836 5 D CB -0.573 40.253 40.800 0.042 0.000 0.951 5 D HN 0.652 nan 8.370 nan 0.000 0.449 6 R N 0.614 121.142 120.500 0.047 0.000 2.081 6 R HA -0.092 4.282 4.340 0.057 0.000 0.235 6 R C 1.383 177.729 176.300 0.076 0.000 1.131 6 R CA 1.649 57.780 56.100 0.052 0.000 0.960 6 R CB -0.506 29.822 30.300 0.047 0.000 0.856 6 R HN 0.180 nan 8.270 nan 0.000 0.436 7 D N -0.447 120.007 120.400 0.089 0.000 2.234 7 D HA -0.047 4.627 4.640 0.057 0.000 0.205 7 D C 1.877 178.270 176.300 0.155 0.000 0.962 7 D CA 0.912 55.008 54.000 0.159 0.000 0.855 7 D CB -0.046 40.848 40.800 0.157 0.000 0.951 7 D HN 0.282 nan 8.370 nan 0.000 0.500 8 I N 1.315 121.902 120.570 0.029 0.000 2.163 8 I HA -0.260 3.944 4.170 0.057 0.000 0.243 8 I C 2.247 178.380 176.117 0.026 0.000 1.085 8 I CA 1.232 62.502 61.300 -0.050 0.000 1.347 8 I CB -0.204 37.780 38.000 -0.027 0.000 1.044 8 I HN -0.043 nan 8.210 nan 0.000 0.408 9 E N 0.808 121.038 120.200 0.050 0.000 2.118 9 E HA -0.258 4.126 4.350 0.057 0.000 0.195 9 E C 2.324 178.967 176.600 0.072 0.000 0.992 9 E CA 1.349 57.779 56.400 0.050 0.000 0.804 9 E CB -0.222 29.504 29.700 0.042 0.000 0.741 9 E HN 0.557 nan 8.360 nan 0.000 0.458 10 A N 0.831 123.720 122.820 0.117 0.000 1.858 10 A HA -0.186 4.168 4.320 0.057 0.000 0.216 10 A C 1.732 179.385 177.584 0.114 0.000 1.190 10 A CA 1.359 53.461 52.037 0.108 0.000 0.617 10 A CB -1.080 18.002 19.000 0.137 0.000 0.827 10 A HN 0.332 nan 8.150 nan 0.000 0.443 11 W N 0.105 121.361 121.300 -0.073 0.000 2.374 11 W HA -0.055 4.640 4.660 0.058 0.000 0.288 11 W C 2.090 178.546 176.519 -0.106 0.000 1.218 11 W CA 1.089 58.377 57.345 -0.096 0.000 1.245 11 W CB -0.690 28.686 29.460 -0.140 0.000 1.126 11 W HN 0.242 nan 8.180 nan 0.000 0.545 12 L N -0.329 120.961 121.223 0.111 0.000 1.994 12 L HA -0.236 4.138 4.340 0.057 0.000 0.208 12 L C 2.247 179.126 176.870 0.014 0.000 1.071 12 L CA 1.469 56.327 54.840 0.029 0.000 0.745 12 L CB -0.977 41.085 42.059 0.005 0.000 0.892 12 L HN -0.124 nan 8.230 nan 0.000 0.431 13 D N 0.001 120.409 120.400 0.013 0.000 2.116 13 D HA -0.205 4.469 4.640 0.057 0.000 0.193 13 D C 2.064 178.347 176.300 -0.027 0.000 0.998 13 D CA 1.225 55.222 54.000 -0.006 0.000 0.836 13 D CB -0.203 40.594 40.800 -0.004 0.000 0.951 13 D HN 0.272 nan 8.370 nan 0.000 0.449 14 E N -0.222 119.948 120.200 -0.051 0.000 2.409 14 E HA -0.008 4.376 4.350 0.057 0.000 0.198 14 E C 1.395 177.954 176.600 -0.069 0.000 1.024 14 E CA 0.768 57.115 56.400 -0.089 0.000 0.861 14 E CB -0.094 29.500 29.700 -0.176 0.000 0.788 14 E HN 0.411 nan 8.360 nan 0.000 0.521 15 G N 1.614 110.391 108.800 -0.038 0.000 2.147 15 G HA2 -0.348 3.646 3.960 0.057 0.000 0.244 15 G HA3 -0.348 3.646 3.960 0.057 0.000 0.244 15 G C 0.956 175.844 174.900 -0.020 0.000 1.005 15 G CA 0.585 45.670 45.100 -0.025 0.000 0.713 15 G HN 0.278 nan 8.290 nan 0.000 0.515 16 R N -1.496 118.994 120.500 -0.016 0.000 2.237 16 R HA 0.318 4.692 4.340 0.057 0.000 0.195 16 R C 0.645 177.029 176.300 0.141 0.000 0.956 16 R CA 0.364 56.475 56.100 0.019 0.000 1.029 16 R CB 0.339 30.566 30.300 -0.121 0.000 0.972 16 R HN 0.418 nan 8.270 nan 0.000 0.493 17 L N 0.323 121.624 121.223 0.131 0.000 2.365 17 L HA 0.400 4.774 4.340 0.057 0.000 0.273 17 L C -0.898 175.969 176.870 -0.004 0.000 1.000 17 L CA -0.427 54.437 54.840 0.040 0.000 0.819 17 L CB 2.149 44.160 42.059 -0.081 0.000 1.284 17 L HN -0.214 nan 8.230 nan 0.000 0.418 18 S N 5.383 121.079 115.700 -0.005 0.000 2.500 18 S HA 0.802 5.306 4.470 0.057 0.000 0.301 18 S C -0.916 173.691 174.600 0.012 0.000 1.092 18 S CA -0.537 57.662 58.200 -0.001 0.000 1.030 18 S CB 0.719 63.921 63.200 0.002 0.000 1.031 18 S HN 0.539 nan 8.310 nan 0.000 0.483 19 I N 4.703 125.282 120.570 0.014 0.000 2.497 19 I HA 0.385 4.589 4.170 0.057 0.000 0.284 19 I C -0.792 175.343 176.117 0.029 0.000 1.060 19 I CA -0.620 60.703 61.300 0.039 0.000 1.071 19 I CB 1.836 39.867 38.000 0.051 0.000 1.216 19 I HN 0.549 nan 8.210 nan 0.000 0.442 20 N N 7.948 126.665 118.700 0.028 0.000 2.372 20 N HA 0.444 5.218 4.740 0.057 0.000 0.285 20 N C -2.659 172.863 175.510 0.020 0.000 1.008 20 N CA -1.258 51.803 53.050 0.018 0.000 0.880 20 N CB 2.476 40.968 38.487 0.008 0.000 1.239 20 N HN 0.250 nan 8.380 nan 0.000 0.484 21 P HA 0.138 nan 4.420 nan 0.000 0.274 21 P C -0.282 177.031 177.300 0.021 0.000 1.237 21 P CA -0.394 62.716 63.100 0.016 0.000 0.793 21 P CB 1.467 33.176 31.700 0.014 0.000 0.977 22 R N 2.722 123.232 120.500 0.017 0.000 2.401 22 R HA 0.218 4.592 4.340 0.057 0.000 0.299 22 R C -1.891 174.423 176.300 0.023 0.000 1.064 22 R CA -1.292 54.819 56.100 0.019 0.000 1.000 22 R CB -0.233 30.075 30.300 0.013 0.000 0.973 22 R HN 0.384 nan 8.270 nan 0.000 0.438 23 P HA 0.246 nan 4.420 nan 0.000 0.284 23 P C -2.619 174.697 177.300 0.027 0.000 1.253 23 P CA -1.548 61.571 63.100 0.031 0.000 0.800 23 P CB 0.965 32.691 31.700 0.043 0.000 0.961 24 P HA 0.040 nan 4.420 nan 0.000 0.277 24 P C 1.098 178.412 177.300 0.024 0.000 1.276 24 P CA -0.341 62.772 63.100 0.021 0.000 0.788 24 P CB 0.781 32.492 31.700 0.018 0.000 1.114 25 V N 0.395 120.322 119.914 0.021 0.000 2.370 25 V HA -0.269 3.885 4.120 0.057 0.000 0.252 25 V C 2.416 178.524 176.094 0.024 0.000 1.068 25 V CA 2.271 64.585 62.300 0.023 0.000 1.061 25 V CB -1.408 30.427 31.823 0.019 0.000 0.656 25 V HN 0.549 nan 8.190 nan 0.000 0.455 26 E N -0.042 120.171 120.200 0.021 0.000 2.171 26 E HA -0.189 4.195 4.350 0.057 0.000 0.197 26 E C 2.068 178.682 176.600 0.024 0.000 0.997 26 E CA 1.097 57.509 56.400 0.020 0.000 0.810 26 E CB -0.201 29.510 29.700 0.017 0.000 0.738 26 E HN 0.532 nan 8.360 nan 0.000 0.467 27 R N -0.039 120.478 120.500 0.028 0.000 2.507 27 R HA 0.315 4.689 4.340 0.057 0.000 0.298 27 R C -0.231 176.095 176.300 0.043 0.000 0.999 27 R CA -0.019 56.101 56.100 0.033 0.000 1.082 27 R CB 0.562 30.882 30.300 0.033 0.000 1.246 27 R HN 0.129 nan 8.270 nan 0.000 0.553 28 I N 1.187 121.782 120.570 0.042 0.000 2.466 28 I HA 0.266 4.470 4.170 0.057 0.000 0.279 28 I C -1.169 174.974 176.117 0.043 0.000 1.033 28 I CA -0.658 60.673 61.300 0.052 0.000 1.123 28 I CB 1.516 39.545 38.000 0.050 0.000 1.237 28 I HN 0.035 nan 8.210 nan 0.000 0.460 29 N N 3.422 122.148 118.700 0.044 0.000 2.264 29 N HA 0.643 5.417 4.740 0.057 0.000 0.288 29 N C 0.549 176.079 175.510 0.034 0.000 1.094 29 N CA -0.139 52.931 53.050 0.034 0.000 0.817 29 N CB 2.280 40.783 38.487 0.027 0.000 1.604 29 N HN 0.692 nan 8.380 nan 0.000 0.473 30 G N 1.451 110.269 108.800 0.029 0.000 3.024 30 G HA2 -0.353 3.641 3.960 0.057 0.000 0.339 30 G HA3 -0.353 3.641 3.960 0.057 0.000 0.339 30 G C 0.488 175.407 174.900 0.032 0.000 1.200 30 G CA 0.956 46.071 45.100 0.026 0.000 0.968 30 G HN 1.069 nan 8.290 nan 0.000 0.593 31 A N -0.015 122.825 122.820 0.033 0.000 2.592 31 A HA 0.695 5.049 4.320 0.057 0.000 0.290 31 A C 0.485 178.100 177.584 0.053 0.000 0.998 31 A CA 1.459 53.521 52.037 0.041 0.000 0.983 31 A CB 0.233 19.247 19.000 0.024 0.000 1.240 31 A HN 1.995 nan 8.150 nan 0.000 0.535 32 T N -2.787 111.802 114.554 0.058 0.000 2.883 32 T HA 0.647 5.031 4.350 0.057 0.000 0.301 32 T C -0.980 173.775 174.700 0.091 0.000 1.158 32 T CA -0.687 61.446 62.100 0.056 0.000 1.007 32 T CB 1.836 70.716 68.868 0.020 0.000 1.186 32 T HN 0.219 nan 8.240 nan 0.000 0.499 33 V N 2.172 122.156 119.914 0.116 0.000 2.384 33 V HA 0.345 4.499 4.120 0.057 0.000 0.287 33 V C -0.339 175.797 176.094 0.071 0.000 1.020 33 V CA -0.901 61.471 62.300 0.121 0.000 0.850 33 V CB 1.406 33.355 31.823 0.210 0.000 0.987 33 V HN 0.924 nan 8.190 nan 0.000 0.436 34 D N 3.423 123.855 120.400 0.053 0.000 2.455 34 D HA 0.281 4.955 4.640 0.057 0.000 0.241 34 D C 0.132 176.457 176.300 0.041 0.000 1.138 34 D CA 0.367 54.390 54.000 0.038 0.000 0.877 34 D CB 1.820 42.639 40.800 0.031 0.000 1.187 34 D HN 0.476 nan 8.370 nan 0.000 0.451 35 V N -0.032 119.902 119.914 0.033 0.000 3.046 35 V HA 0.690 4.844 4.120 0.057 0.000 0.316 35 V C -0.007 176.105 176.094 0.030 0.000 1.104 35 V CA -1.071 61.249 62.300 0.033 0.000 1.006 35 V CB 2.265 34.103 31.823 0.025 0.000 1.058 35 V HN 0.355 nan 8.190 nan 0.000 0.440 36 R N 0.875 121.392 120.500 0.028 0.000 2.873 36 R HA 0.688 5.062 4.340 0.057 0.000 0.264 36 R C -1.290 175.027 176.300 0.029 0.000 1.026 36 R CA -1.034 55.083 56.100 0.028 0.000 1.002 36 R CB 1.950 32.265 30.300 0.024 0.000 1.174 36 R HN 0.719 nan 8.270 nan 0.000 0.488 37 L N 1.439 122.684 121.223 0.037 0.000 2.319 37 L HA 0.311 4.685 4.340 0.057 0.000 0.280 37 L C 0.463 177.334 176.870 0.003 0.000 1.099 37 L CA 0.624 55.489 54.840 0.042 0.000 0.828 37 L CB 1.066 43.177 42.059 0.086 0.000 1.150 37 L HN 0.758 nan 8.230 nan 0.000 0.442 38 G N 2.735 111.496 108.800 -0.066 0.000 2.485 38 G HA2 0.035 4.029 3.960 0.057 0.000 0.260 38 G HA3 0.035 4.029 3.960 0.057 0.000 0.260 38 G C 0.166 174.984 174.900 -0.137 0.000 1.459 38 G CA 0.007 45.049 45.100 -0.096 0.000 1.060 38 G HN 0.684 nan 8.290 nan 0.000 0.546 39 N N -1.442 117.165 118.700 -0.156 0.000 2.232 39 N HA 0.133 4.907 4.740 0.057 0.000 0.240 39 N C -0.727 174.730 175.510 -0.087 0.000 1.307 39 N CA -0.103 52.921 53.050 -0.044 0.000 0.859 39 N CB 0.385 38.901 38.487 0.048 0.000 1.260 39 N HN 0.324 nan 8.380 nan 0.000 0.501 40 K N 0.498 120.697 120.400 -0.335 0.000 2.394 40 K HA 0.365 4.719 4.320 0.057 0.000 0.260 40 K C -1.195 175.126 176.600 -0.465 0.000 0.967 40 K CA -0.424 55.729 56.287 -0.223 0.000 0.855 40 K CB 1.249 33.656 32.500 -0.155 0.000 1.101 40 K HN -0.091 nan 8.250 nan 0.000 0.433 41 F N 1.096 121.010 119.950 -0.060 0.000 2.556 41 F HA 0.588 5.148 4.527 0.055 0.000 0.327 41 F C 0.240 176.009 175.800 -0.050 0.000 1.059 41 F CA -0.915 57.000 58.000 -0.142 0.000 0.953 41 F CB 1.916 40.751 39.000 -0.276 0.000 1.227 41 F HN 0.174 nan 8.300 nan 0.000 0.478 42 R N -0.023 120.548 120.500 0.117 0.000 2.651 42 R HA 0.666 5.040 4.340 0.057 0.000 0.278 42 R C -1.245 175.119 176.300 0.106 0.000 1.010 42 R CA -0.879 55.275 56.100 0.090 0.000 0.896 42 R CB 2.597 32.883 30.300 -0.022 0.000 1.211 42 R HN 0.812 nan 8.270 nan 0.000 0.456 43 T N -1.410 113.224 114.554 0.133 0.000 2.907 43 T HA 0.539 4.923 4.350 0.057 0.000 0.290 43 T C -0.273 174.468 174.700 0.068 0.000 1.066 43 T CA -0.736 61.458 62.100 0.156 0.000 1.012 43 T CB 1.007 70.047 68.868 0.287 0.000 1.184 43 T HN 0.233 nan 8.240 nan 0.000 0.522 44 F N 1.007 121.042 119.950 0.142 0.000 2.399 44 F HA 0.477 5.042 4.527 0.062 0.000 0.342 44 F C 1.502 177.361 175.800 0.098 0.000 1.106 44 F CA -0.601 57.460 58.000 0.102 0.000 1.196 44 F CB 0.918 39.980 39.000 0.104 0.000 1.163 44 F HN 0.224 nan 8.300 nan 0.000 0.547 45 R N 2.308 123.000 120.500 0.320 0.000 2.547 45 R HA 0.166 4.540 4.340 0.057 0.000 0.280 45 R C 0.694 177.024 176.300 0.051 0.000 1.630 45 R CA -0.262 55.955 56.100 0.195 0.000 1.470 45 R CB 1.114 31.495 30.300 0.135 0.000 1.178 45 R HN 0.945 nan 8.270 nan 0.000 0.591 46 G N 1.406 110.258 108.800 0.086 0.000 2.679 46 G HA2 -0.213 3.781 3.960 0.057 0.000 0.212 46 G HA3 -0.213 3.781 3.960 0.057 0.000 0.212 46 G C 1.252 176.124 174.900 -0.047 0.000 1.137 46 G CA 0.184 45.280 45.100 -0.007 0.000 0.787 46 G HN 0.647 nan 8.290 nan 0.000 0.534 47 H N 0.641 119.734 119.070 0.039 0.000 2.491 47 H HA -0.087 4.502 4.556 0.054 0.000 0.290 47 H C 2.030 177.374 175.328 0.026 0.000 1.050 47 H CA 1.541 57.606 56.048 0.028 0.000 1.309 47 H CB -0.977 28.802 29.762 0.028 0.000 1.392 47 H HN 0.351 nan 8.280 nan 0.000 0.554 48 T N -1.273 113.105 114.554 -0.294 0.000 2.995 48 T HA 0.359 4.743 4.350 0.057 0.000 0.269 48 T C 1.048 175.708 174.700 -0.065 0.000 1.091 48 T CA 0.448 62.466 62.100 -0.135 0.000 1.128 48 T CB -0.036 68.716 68.868 -0.195 0.000 0.891 48 T HN 0.567 nan 8.240 nan 0.000 0.492 49 A N -0.175 122.606 122.820 -0.065 0.000 2.401 49 A HA 0.896 5.250 4.320 0.057 0.000 0.310 49 A C 1.171 178.748 177.584 -0.011 0.000 1.075 49 A CA -0.374 51.628 52.037 -0.059 0.000 0.746 49 A CB 1.302 20.247 19.000 -0.092 0.000 1.277 49 A HN 0.231 nan 8.150 nan 0.000 0.425 50 A N 1.162 123.992 122.820 0.017 0.000 1.935 50 A HA 0.538 4.892 4.320 0.057 0.000 0.214 50 A C 0.489 178.236 177.584 0.272 0.000 1.178 50 A CA 1.614 53.742 52.037 0.152 0.000 0.640 50 A CB -0.375 18.781 19.000 0.260 0.000 0.825 50 A HN 1.753 nan 8.150 nan 0.000 0.447 51 F N -3.745 116.201 119.950 -0.007 0.000 2.831 51 F HA 0.734 5.293 4.527 0.053 0.000 0.318 51 F C -1.351 174.453 175.800 0.006 0.000 1.174 51 F CA -1.663 56.332 58.000 -0.008 0.000 0.918 51 F CB 0.907 39.904 39.000 -0.006 0.000 1.364 51 F HN -0.156 nan 8.300 nan 0.000 0.475 52 I N 1.522 122.155 120.570 0.104 0.000 2.465 52 I HA 0.271 4.475 4.170 0.057 0.000 0.291 52 I C -1.343 174.868 176.117 0.156 0.000 1.014 52 I CA -0.655 60.640 61.300 -0.007 0.000 1.093 52 I CB 1.693 39.731 38.000 0.064 0.000 1.267 52 I HN 0.526 nan 8.210 nan 0.000 0.431 53 D N 6.594 127.029 120.400 0.058 0.000 2.347 53 D HA 0.245 4.919 4.640 0.057 0.000 0.235 53 D C 0.610 176.966 176.300 0.094 0.000 1.149 53 D CA -0.023 54.078 54.000 0.169 0.000 0.850 53 D CB 1.450 42.340 40.800 0.150 0.000 1.061 53 D HN 0.492 nan 8.370 nan 0.000 0.487 54 L N 2.365 123.648 121.223 0.099 0.000 2.446 54 L HA -0.001 4.373 4.340 0.057 0.000 0.219 54 L C 1.357 178.259 176.870 0.052 0.000 1.116 54 L CA 0.101 54.981 54.840 0.067 0.000 0.844 54 L CB -0.220 41.877 42.059 0.064 0.000 0.970 54 L HN 0.305 nan 8.230 nan 0.000 0.457 55 S N -0.226 115.507 115.700 0.056 0.000 2.614 55 S HA 0.599 5.103 4.470 0.057 0.000 0.265 55 S C 0.397 175.020 174.600 0.039 0.000 1.303 55 S CA 0.080 58.306 58.200 0.043 0.000 1.000 55 S CB 1.463 64.689 63.200 0.043 0.000 0.935 55 S HN 0.376 nan 8.310 nan 0.000 0.551 56 G N 0.819 109.637 108.800 0.030 0.000 2.712 56 G HA2 0.060 4.054 3.960 0.057 0.000 0.686 56 G HA3 0.060 4.054 3.960 0.057 0.000 0.686 56 G C -3.099 171.812 174.900 0.019 0.000 1.181 56 G CA -0.853 44.261 45.100 0.024 0.000 0.762 56 G HN 0.753 nan 8.290 nan 0.000 0.641 57 P HA 0.144 nan 4.420 nan 0.000 0.271 57 P C 1.277 178.585 177.300 0.012 0.000 1.228 57 P CA 0.014 63.121 63.100 0.011 0.000 0.797 57 P CB 0.364 32.068 31.700 0.007 0.000 0.914 58 K N 0.763 121.170 120.400 0.012 0.000 2.089 58 K HA -0.219 4.135 4.320 0.057 0.000 0.210 58 K C 1.569 178.177 176.600 0.012 0.000 1.048 58 K CA 2.176 58.473 56.287 0.016 0.000 0.926 58 K CB -0.501 32.008 32.500 0.016 0.000 0.714 58 K HN 0.629 nan 8.250 nan 0.000 0.448 59 D N 0.928 121.332 120.400 0.007 0.000 2.123 59 D HA -0.218 4.456 4.640 0.057 0.000 0.196 59 D C 1.443 177.744 176.300 0.002 0.000 0.992 59 D CA 1.190 55.192 54.000 0.003 0.000 0.833 59 D CB -0.283 40.517 40.800 -0.000 0.000 0.954 59 D HN 0.315 nan 8.370 nan 0.000 0.455 60 E N 0.935 121.137 120.200 0.003 0.000 2.028 60 E HA -0.088 4.296 4.350 0.057 0.000 0.191 60 E C 2.656 179.256 176.600 0.000 0.000 0.988 60 E CA 0.539 56.938 56.400 -0.001 0.000 0.799 60 E CB -0.421 29.280 29.700 0.002 0.000 0.755 60 E HN 0.206 nan 8.360 nan 0.000 0.447 61 V N 1.462 121.382 119.914 0.009 0.000 2.568 61 V HA -0.205 3.949 4.120 0.057 0.000 0.253 61 V C 2.490 178.590 176.094 0.011 0.000 1.072 61 V CA 1.850 64.159 62.300 0.015 0.000 1.084 61 V CB -0.319 31.518 31.823 0.022 0.000 0.676 61 V HN 0.223 nan 8.190 nan 0.000 0.469 62 S N -1.001 114.704 115.700 0.008 0.000 2.421 62 S HA 0.048 4.553 4.470 0.057 0.000 0.224 62 S C 2.166 176.765 174.600 -0.001 0.000 1.035 62 S CA 0.973 59.176 58.200 0.005 0.000 0.953 62 S CB -0.088 63.117 63.200 0.009 0.000 0.810 62 S HN 0.586 nan 8.310 nan 0.000 0.497 63 A N 1.695 124.513 122.820 -0.003 0.000 1.883 63 A HA 0.070 4.424 4.320 0.057 0.000 0.217 63 A C 2.391 179.967 177.584 -0.012 0.000 1.186 63 A CA 1.986 54.018 52.037 -0.009 0.000 0.624 63 A CB -1.356 17.637 19.000 -0.012 0.000 0.822 63 A HN 0.672 nan 8.150 nan 0.000 0.444 64 A N -0.563 122.249 122.820 -0.013 0.000 1.877 64 A HA -0.099 4.255 4.320 0.057 0.000 0.216 64 A C 2.188 179.777 177.584 0.008 0.000 1.186 64 A CA 1.574 53.603 52.037 -0.012 0.000 0.620 64 A CB -0.731 18.263 19.000 -0.010 0.000 0.822 64 A HN 0.553 nan 8.150 nan 0.000 0.443 65 L N -0.710 120.517 121.223 0.007 0.000 2.129 65 L HA -0.273 4.101 4.340 0.057 0.000 0.212 65 L C 1.613 178.474 176.870 -0.016 0.000 1.087 65 L CA 2.294 57.131 54.840 -0.005 0.000 0.757 65 L CB -0.253 41.795 42.059 -0.018 0.000 0.896 65 L HN 0.472 nan 8.230 nan 0.000 0.434 66 D N -2.186 118.208 120.400 -0.010 0.000 2.338 66 D HA -0.054 4.620 4.640 0.057 0.000 0.208 66 D C 2.093 178.391 176.300 -0.005 0.000 0.997 66 D CA 0.102 54.096 54.000 -0.009 0.000 0.880 66 D CB 0.056 40.852 40.800 -0.008 0.000 0.980 66 D HN 0.074 nan 8.370 nan 0.000 0.509 67 R N 0.835 121.330 120.500 -0.007 0.000 2.115 67 R HA -0.090 4.284 4.340 0.057 0.000 0.230 67 R C 1.645 177.939 176.300 -0.010 0.000 1.111 67 R CA 1.278 57.369 56.100 -0.015 0.000 0.976 67 R CB 0.151 30.434 30.300 -0.029 0.000 0.870 67 R HN 0.290 nan 8.270 nan 0.000 0.445 68 V N -2.843 117.087 119.914 0.026 0.000 3.621 68 V HA 0.281 4.435 4.120 0.057 0.000 0.263 68 V C 0.746 176.916 176.094 0.127 0.000 1.272 68 V CA -0.190 62.163 62.300 0.088 0.000 1.080 68 V CB 0.419 32.358 31.823 0.192 0.000 0.816 68 V HN -0.065 nan 8.190 nan 0.000 0.451 69 M N 2.655 122.274 119.600 0.031 0.000 2.314 69 M HA 0.459 4.973 4.480 0.057 0.000 0.342 69 M C 0.787 177.096 176.300 0.015 0.000 1.171 69 M CA 0.396 55.677 55.300 -0.031 0.000 1.098 69 M CB 1.361 33.884 32.600 -0.127 0.000 1.559 69 M HN 0.587 nan 8.290 nan 0.000 0.459 70 S N 1.488 117.214 115.700 0.043 0.000 2.592 70 S HA 0.075 4.579 4.470 0.057 0.000 0.256 70 S C -0.011 174.621 174.600 0.053 0.000 1.369 70 S CA -0.372 57.870 58.200 0.069 0.000 0.984 70 S CB 0.365 63.630 63.200 0.108 0.000 0.919 70 S HN 0.613 nan 8.310 nan 0.000 0.576 71 D N 0.809 121.247 120.400 0.064 0.000 2.368 71 D HA 0.135 4.810 4.640 0.057 0.000 0.240 71 D C 0.339 176.682 176.300 0.071 0.000 1.169 71 D CA 0.027 54.061 54.000 0.057 0.000 0.906 71 D CB 0.220 41.056 40.800 0.059 0.000 1.187 71 D HN 0.749 nan 8.370 nan 0.000 0.435 72 E N 0.520 120.754 120.200 0.058 0.000 2.502 72 E HA 0.032 4.416 4.350 0.057 0.000 0.261 72 E C -0.538 176.127 176.600 0.109 0.000 0.974 72 E CA 0.233 56.674 56.400 0.069 0.000 0.936 72 E CB 0.333 30.059 29.700 0.042 0.000 0.926 72 E HN 0.278 nan 8.360 nan 0.000 0.459 73 I N 5.267 125.937 120.570 0.168 0.000 2.382 73 I HA 0.183 4.387 4.170 0.057 0.000 0.285 73 I C -0.955 175.321 176.117 0.265 0.000 1.007 73 I CA -0.843 60.589 61.300 0.221 0.000 1.142 73 I CB 1.569 39.751 38.000 0.305 0.000 1.289 73 I HN 0.228 nan 8.210 nan 0.000 0.453 74 V N 7.102 127.128 119.914 0.187 0.000 2.370 74 V HA 0.410 4.564 4.120 0.057 0.000 0.283 74 V C 0.188 176.383 176.094 0.168 0.000 1.023 74 V CA -0.620 61.786 62.300 0.176 0.000 0.857 74 V CB 1.447 33.333 31.823 0.104 0.000 0.985 74 V HN 0.474 nan 8.190 nan 0.000 0.443 75 L N 3.837 125.181 121.223 0.202 0.000 2.307 75 L HA 0.489 4.863 4.340 0.057 0.000 0.282 75 L C 0.480 177.412 176.870 0.104 0.000 1.051 75 L CA -0.484 54.443 54.840 0.144 0.000 0.804 75 L CB 1.119 43.267 42.059 0.149 0.000 1.197 75 L HN 0.616 nan 8.230 nan 0.000 0.431 76 D N 1.892 122.337 120.400 0.075 0.000 2.372 76 D HA 0.033 4.707 4.640 0.057 0.000 0.243 76 D C 0.046 176.377 176.300 0.052 0.000 1.297 76 D CA -0.067 53.967 54.000 0.057 0.000 0.958 76 D CB 0.772 41.599 40.800 0.045 0.000 1.114 76 D HN 0.519 nan 8.370 nan 0.000 0.496 77 E N -0.811 119.413 120.200 0.041 0.000 2.436 77 E HA 0.210 4.594 4.350 0.057 0.000 0.262 77 E C 1.104 177.722 176.600 0.030 0.000 1.063 77 E CA 0.591 57.011 56.400 0.034 0.000 0.944 77 E CB 0.388 30.104 29.700 0.027 0.000 0.950 77 E HN 0.641 nan 8.360 nan 0.000 0.444 78 G N 2.277 111.092 108.800 0.025 0.000 5.229 78 G HA2 -0.397 3.597 3.960 0.057 0.000 0.250 78 G HA3 -0.397 3.597 3.960 0.057 0.000 0.250 78 G C -0.053 174.855 174.900 0.014 0.000 1.380 78 G CA 0.247 45.359 45.100 0.019 0.000 0.933 78 G HN 0.647 nan 8.290 nan 0.000 0.731 79 E N 1.859 122.071 120.200 0.021 0.000 2.812 79 E HA 0.275 4.659 4.350 0.057 0.000 0.276 79 E C 0.547 177.123 176.600 -0.040 0.000 0.946 79 E CA 0.490 56.896 56.400 0.011 0.000 0.971 79 E CB 0.295 30.014 29.700 0.031 0.000 0.960 79 E HN 1.054 nan 8.360 nan 0.000 0.479 80 A N 3.234 125.982 122.820 -0.121 0.000 2.340 80 A HA 0.519 4.873 4.320 0.057 0.000 0.331 80 A C -1.120 176.228 177.584 -0.392 0.000 1.140 80 A CA -0.603 51.245 52.037 -0.315 0.000 0.801 80 A CB 0.741 19.399 19.000 -0.570 0.000 1.234 80 A HN 0.545 nan 8.150 nan 0.000 0.469 81 F N 1.745 121.329 119.950 -0.609 0.000 2.410 81 F HA 0.619 5.177 4.527 0.053 0.000 0.349 81 F C -1.182 174.255 175.800 -0.606 0.000 1.117 81 F CA -0.374 57.252 58.000 -0.623 0.000 1.104 81 F CB 0.717 39.066 39.000 -1.085 0.000 1.122 81 F HN 0.520 nan 8.300 nan 0.000 0.483 82 Y N 7.091 127.013 120.300 -0.630 0.000 2.367 82 Y HA 0.416 4.998 4.550 0.053 0.000 0.342 82 Y C -0.524 174.986 175.900 -0.649 0.000 0.979 82 Y CA -0.807 56.971 58.100 -0.536 0.000 1.161 82 Y CB 1.262 39.401 38.460 -0.535 0.000 1.155 82 Y HN 0.535 nan 8.280 nan 0.000 0.503 83 L N 5.278 126.384 121.223 -0.194 0.000 2.265 83 L HA 0.420 4.794 4.340 0.057 0.000 0.289 83 L C -0.585 176.187 176.870 -0.164 0.000 1.033 83 L CA -0.201 54.635 54.840 -0.007 0.000 0.814 83 L CB -0.002 42.172 42.059 0.192 0.000 1.203 83 L HN 0.565 nan 8.230 nan 0.000 0.423 84 H N 4.704 123.794 119.070 0.033 0.000 2.482 84 H HA 0.365 4.952 4.556 0.051 0.000 0.344 84 H C -2.269 173.038 175.328 -0.034 0.000 1.151 84 H CA -1.928 54.118 56.048 -0.003 0.000 1.300 84 H CB 1.003 30.756 29.762 -0.014 0.000 1.494 84 H HN 0.451 nan 8.280 nan 0.000 0.542 85 P HA -0.045 nan 4.420 nan 0.000 0.261 85 P C 0.867 178.136 177.300 -0.052 0.000 1.173 85 P CA 1.327 64.412 63.100 -0.025 0.000 0.760 85 P CB 0.235 31.940 31.700 0.008 0.000 0.783 86 G N 1.288 109.960 108.800 -0.213 0.000 2.184 86 G HA2 -0.211 3.783 3.960 0.057 0.000 0.264 86 G HA3 -0.211 3.783 3.960 0.057 0.000 0.264 86 G C 0.088 174.974 174.900 -0.024 0.000 0.975 86 G CA -0.196 44.819 45.100 -0.142 0.000 0.642 86 G HN 0.510 nan 8.290 nan 0.000 0.536 87 E N -0.447 119.728 120.200 -0.041 0.000 2.266 87 E HA 0.582 4.966 4.350 0.057 0.000 0.277 87 E C -0.196 176.554 176.600 0.249 0.000 1.018 87 E CA -0.845 55.656 56.400 0.167 0.000 0.840 87 E CB 1.948 31.774 29.700 0.210 0.000 1.082 87 E HN 0.279 nan 8.360 nan 0.000 0.395 88 L N 1.961 123.447 121.223 0.438 0.000 2.287 88 L HA 0.577 4.951 4.340 0.057 0.000 0.287 88 L C -0.899 176.163 176.870 0.320 0.000 1.022 88 L CA -0.386 54.728 54.840 0.457 0.000 0.814 88 L CB 1.052 43.428 42.059 0.528 0.000 1.217 88 L HN 0.534 nan 8.230 nan 0.000 0.420 89 A N 5.538 128.517 122.820 0.264 0.000 2.423 89 A HA 0.842 5.196 4.320 0.057 0.000 0.304 89 A C -1.443 176.129 177.584 -0.020 0.000 1.104 89 A CA -0.676 51.472 52.037 0.185 0.000 0.757 89 A CB 1.269 20.480 19.000 0.351 0.000 1.313 89 A HN 0.681 nan 8.150 nan 0.000 0.423 90 L N 0.616 121.775 121.223 -0.106 0.000 2.334 90 L HA 0.803 5.177 4.340 0.057 0.000 0.276 90 L C 0.410 177.098 176.870 -0.303 0.000 1.014 90 L CA -0.362 54.330 54.840 -0.246 0.000 0.815 90 L CB 1.816 43.752 42.059 -0.206 0.000 1.268 90 L HN 0.992 nan 8.230 nan 0.000 0.428 91 A N 2.599 125.136 122.820 -0.472 0.000 2.733 91 A HA 0.903 5.257 4.320 0.057 0.000 0.299 91 A C -1.599 175.730 177.584 -0.425 0.000 1.252 91 A CA -0.527 51.187 52.037 -0.537 0.000 0.677 91 A CB 1.918 20.620 19.000 -0.495 0.000 1.361 91 A HN 0.375 nan 8.150 nan 0.000 0.528 92 V N -0.049 119.637 119.914 -0.379 0.000 3.120 92 V HA 0.596 4.750 4.120 0.057 0.000 0.303 92 V C -0.175 175.822 176.094 -0.161 0.000 1.238 92 V CA 0.163 62.322 62.300 -0.235 0.000 1.008 92 V CB 2.411 34.114 31.823 -0.201 0.000 1.064 92 V HN 1.549 nan 8.190 nan 0.000 0.434 93 T N 2.577 117.076 114.554 -0.092 0.000 2.899 93 T HA 0.293 4.677 4.350 0.057 0.000 0.295 93 T C 0.924 175.604 174.700 -0.034 0.000 1.033 93 T CA -0.012 62.063 62.100 -0.042 0.000 1.084 93 T CB 1.107 69.966 68.868 -0.015 0.000 0.979 93 T HN 0.658 nan 8.240 nan 0.000 0.532 94 L N 0.511 121.724 121.223 -0.016 0.000 2.027 94 L HA 0.173 4.547 4.340 0.057 0.000 0.206 94 L C 0.765 177.639 176.870 0.007 0.000 1.074 94 L CA 1.638 56.474 54.840 -0.007 0.000 0.745 94 L CB -1.236 40.826 42.059 0.005 0.000 0.898 94 L HN 0.767 nan 8.230 nan 0.000 0.433 95 E N 0.063 120.274 120.200 0.020 0.000 2.338 95 E HA 0.220 4.604 4.350 0.057 0.000 0.272 95 E C -0.046 176.583 176.600 0.047 0.000 1.029 95 E CA 0.086 56.507 56.400 0.034 0.000 0.872 95 E CB 0.792 30.520 29.700 0.047 0.000 1.015 95 E HN 0.187 nan 8.360 nan 0.000 0.417 96 S N 1.793 117.520 115.700 0.045 0.000 2.586 96 S HA 0.471 4.975 4.470 0.057 0.000 0.274 96 S C -0.693 173.956 174.600 0.082 0.000 1.281 96 S CA -0.695 57.541 58.200 0.060 0.000 1.035 96 S CB 0.483 63.695 63.200 0.020 0.000 0.962 96 S HN 0.266 nan 8.310 nan 0.000 0.512 97 V N 3.723 123.715 119.914 0.130 0.000 2.638 97 V HA 0.500 4.654 4.120 0.057 0.000 0.306 97 V C -0.521 175.657 176.094 0.139 0.000 1.052 97 V CA -0.693 61.705 62.300 0.162 0.000 0.885 97 V CB 2.192 34.158 31.823 0.239 0.000 0.999 97 V HN 0.950 nan 8.190 nan 0.000 0.424 98 T N 6.146 120.751 114.554 0.085 0.000 2.809 98 T HA 0.668 5.052 4.350 0.057 0.000 0.284 98 T C -0.540 174.207 174.700 0.078 0.000 0.992 98 T CA -0.369 61.758 62.100 0.045 0.000 0.957 98 T CB 1.008 69.869 68.868 -0.012 0.000 0.942 98 T HN 0.363 nan 8.240 nan 0.000 0.439 99 L N 5.099 126.385 121.223 0.106 0.000 2.331 99 L HA 0.600 4.974 4.340 0.057 0.000 0.275 99 L C -2.041 174.885 176.870 0.094 0.000 1.022 99 L CA -2.464 52.442 54.840 0.110 0.000 0.812 99 L CB 1.643 43.779 42.059 0.128 0.000 1.257 99 L HN 0.350 nan 8.230 nan 0.000 0.435 100 P HA 0.157 nan 4.420 nan 0.000 0.282 100 P C -0.013 177.351 177.300 0.107 0.000 1.287 100 P CA -0.500 62.666 63.100 0.109 0.000 0.792 100 P CB 1.008 32.800 31.700 0.153 0.000 1.163 101 A N 0.230 123.105 122.820 0.092 0.000 2.209 101 A HA -0.088 4.266 4.320 0.057 0.000 0.212 101 A C 0.991 178.629 177.584 0.090 0.000 1.158 101 A CA 1.412 53.498 52.037 0.082 0.000 0.742 101 A CB -1.115 17.923 19.000 0.064 0.000 0.790 101 A HN 0.636 nan 8.150 nan 0.000 0.472 102 D N -1.886 118.589 120.400 0.125 0.000 2.535 102 D HA 0.342 5.016 4.640 0.057 0.000 0.229 102 D C -0.292 176.098 176.300 0.149 0.000 1.238 102 D CA -0.233 53.852 54.000 0.141 0.000 0.824 102 D CB -0.117 40.786 40.800 0.171 0.000 1.045 102 D HN 0.184 nan 8.370 nan 0.000 0.500 103 L N 0.414 121.701 121.223 0.107 0.000 2.370 103 L HA 0.615 4.989 4.340 0.057 0.000 0.266 103 L C -1.379 175.488 176.870 -0.006 0.000 1.002 103 L CA -1.186 53.670 54.840 0.027 0.000 0.818 103 L CB 2.379 44.437 42.059 -0.003 0.000 1.325 103 L HN -0.097 nan 8.230 nan 0.000 0.418 104 V N 3.363 123.239 119.914 -0.063 0.000 2.604 104 V HA 0.889 5.043 4.120 0.057 0.000 0.305 104 V C 0.071 175.917 176.094 -0.413 0.000 1.043 104 V CA -0.049 62.104 62.300 -0.246 0.000 0.888 104 V CB 1.757 33.414 31.823 -0.277 0.000 0.995 104 V HN 0.858 nan 8.190 nan 0.000 0.429 105 G N 4.683 113.125 108.800 -0.597 0.000 2.412 105 G HA2 0.580 4.574 3.960 0.057 0.000 0.318 105 G HA3 0.580 4.574 3.960 0.057 0.000 0.318 105 G C -1.684 172.508 174.900 -1.180 0.000 1.146 105 G CA -0.551 44.111 45.100 -0.730 0.000 0.882 105 G HN 0.736 nan 8.290 nan 0.000 0.501 106 W N 0.996 122.012 121.300 -0.473 0.000 2.781 106 W HA 0.475 5.168 4.660 0.055 0.000 0.333 106 W C -0.710 175.605 176.519 -0.340 0.000 1.047 106 W CA -0.895 56.174 57.345 -0.459 0.000 1.236 106 W CB 2.113 31.306 29.460 -0.446 0.000 1.394 106 W HN 0.375 nan 8.180 nan 0.000 0.466 107 L N 4.755 125.957 121.223 -0.035 0.000 2.264 107 L HA 0.468 4.842 4.340 0.057 0.000 0.289 107 L C -0.409 176.532 176.870 0.119 0.000 1.044 107 L CA 0.058 54.892 54.840 -0.010 0.000 0.807 107 L CB 0.194 42.216 42.059 -0.062 0.000 1.192 107 L HN 0.296 nan 8.230 nan 0.000 0.425 108 D N 3.521 123.964 120.400 0.072 0.000 2.181 108 D HA 0.484 5.158 4.640 0.057 0.000 0.248 108 D C 0.103 176.431 176.300 0.047 0.000 1.020 108 D CA -0.118 53.924 54.000 0.071 0.000 0.891 108 D CB 1.925 42.753 40.800 0.047 0.000 1.187 108 D HN 0.733 nan 8.370 nan 0.000 0.443 109 G N 0.665 109.494 108.800 0.048 0.000 2.616 109 G HA2 0.310 4.304 3.960 0.057 0.000 0.268 109 G HA3 0.310 4.304 3.960 0.057 0.000 0.268 109 G C -0.064 174.857 174.900 0.034 0.000 1.213 109 G CA -0.603 44.529 45.100 0.054 0.000 0.926 109 G HN 0.311 nan 8.290 nan 0.000 0.523 110 R N 0.132 120.649 120.500 0.029 0.000 2.340 110 R HA 0.235 4.609 4.340 0.057 0.000 0.300 110 R C 1.288 177.595 176.300 0.011 0.000 1.069 110 R CA -0.082 56.027 56.100 0.015 0.000 0.984 110 R CB 1.437 31.743 30.300 0.009 0.000 1.003 110 R HN 0.526 nan 8.270 nan 0.000 0.459 111 S N 1.511 117.215 115.700 0.006 0.000 2.368 111 S HA -0.160 4.344 4.470 0.057 0.000 0.224 111 S C 1.957 176.558 174.600 0.002 0.000 1.029 111 S CA 1.825 60.027 58.200 0.004 0.000 0.988 111 S CB -0.047 63.153 63.200 0.000 0.000 0.838 111 S HN 0.771 nan 8.310 nan 0.000 0.462 112 S N 1.551 117.251 115.700 -0.001 0.000 2.399 112 S HA -0.000 4.504 4.470 0.057 0.000 0.231 112 S C 1.871 176.466 174.600 -0.008 0.000 1.022 112 S CA 1.174 59.371 58.200 -0.004 0.000 0.983 112 S CB -0.762 62.435 63.200 -0.005 0.000 0.803 112 S HN 0.576 nan 8.310 nan 0.000 0.480 113 L N 1.054 122.271 121.223 -0.010 0.000 2.131 113 L HA 0.116 4.490 4.340 0.057 0.000 0.206 113 L C 3.233 180.097 176.870 -0.009 0.000 1.087 113 L CA 0.978 55.806 54.840 -0.020 0.000 0.767 113 L CB -1.062 40.978 42.059 -0.032 0.000 0.917 113 L HN 0.453 nan 8.230 nan 0.000 0.441 114 A N 0.540 123.362 122.820 0.005 0.000 1.940 114 A HA -0.221 4.133 4.320 0.057 0.000 0.219 114 A C 2.384 179.975 177.584 0.013 0.000 1.176 114 A CA 1.514 53.561 52.037 0.017 0.000 0.631 114 A CB -0.506 18.506 19.000 0.020 0.000 0.814 114 A HN 0.322 nan 8.150 nan 0.000 0.446 115 R N -0.783 119.720 120.500 0.005 0.000 2.152 115 R HA 0.004 4.378 4.340 0.057 0.000 0.232 115 R C 1.169 177.470 176.300 0.002 0.000 1.117 115 R CA 1.168 57.271 56.100 0.004 0.000 0.981 115 R CB -0.332 29.969 30.300 0.001 0.000 0.870 115 R HN 0.518 nan 8.270 nan 0.000 0.451 116 L N -0.894 120.327 121.223 -0.004 0.000 2.611 116 L HA 0.247 4.621 4.340 0.057 0.000 0.229 116 L C 1.078 177.942 176.870 -0.011 0.000 1.137 116 L CA 0.306 55.141 54.840 -0.009 0.000 0.901 116 L CB 0.611 42.659 42.059 -0.018 0.000 1.098 116 L HN 0.428 nan 8.230 nan 0.000 0.456 117 G N 0.185 108.986 108.800 0.000 0.000 2.201 117 G HA2 -0.248 3.746 3.960 0.057 0.000 0.212 117 G HA3 -0.248 3.746 3.960 0.057 0.000 0.212 117 G C -0.088 174.820 174.900 0.013 0.000 0.994 117 G CA -0.442 44.661 45.100 0.006 0.000 0.644 117 G HN 0.115 nan 8.290 nan 0.000 0.508 118 L N 2.183 123.408 121.223 0.003 0.000 2.485 118 L HA 0.707 5.081 4.340 0.057 0.000 0.279 118 L C 0.618 177.537 176.870 0.081 0.000 1.124 118 L CA 0.236 55.082 54.840 0.011 0.000 0.888 118 L CB 0.275 42.300 42.059 -0.057 0.000 1.217 118 L HN 0.276 nan 8.230 nan 0.000 0.464 119 M N 5.267 124.962 119.600 0.159 0.000 2.129 119 M HA 0.463 4.977 4.480 0.057 0.000 0.348 119 M C -1.002 175.443 176.300 0.241 0.000 1.116 119 M CA -0.481 54.934 55.300 0.191 0.000 1.022 119 M CB 1.267 34.017 32.600 0.250 0.000 1.599 119 M HN 0.312 nan 8.290 nan 0.000 0.449 120 V N 2.499 122.523 119.914 0.184 0.000 2.680 120 V HA 0.549 4.703 4.120 0.057 0.000 0.309 120 V C 0.326 176.464 176.094 0.072 0.000 1.052 120 V CA -1.553 60.853 62.300 0.177 0.000 0.908 120 V CB 1.577 33.529 31.823 0.215 0.000 1.001 120 V HN 0.941 nan 8.190 nan 0.000 0.431 121 A N 3.039 125.873 122.820 0.024 0.000 2.188 121 A HA 0.213 4.567 4.320 0.057 0.000 0.321 121 A C 1.244 178.826 177.584 -0.003 0.000 0.965 121 A CA 1.480 53.516 52.037 -0.002 0.000 1.361 121 A CB -0.924 18.062 19.000 -0.023 0.000 0.707 121 A HN 1.880 nan 8.150 nan 0.000 0.338 122 V N 1.140 121.019 119.914 -0.058 0.000 0.584 122 V HA -0.347 3.807 4.120 0.057 0.000 0.092 122 V C 2.008 178.056 176.094 -0.077 0.000 1.858 122 V CA 2.764 65.032 62.300 -0.054 0.000 3.412 122 V CB -1.745 30.076 31.823 -0.004 0.000 0.701 122 V HN 0.953 nan 8.190 nan 0.000 0.725 123 T N -1.323 113.205 114.554 -0.043 0.000 3.098 123 T HA 0.588 4.972 4.350 0.057 0.000 0.246 123 T C 0.246 174.959 174.700 0.023 0.000 0.983 123 T CA 0.911 62.996 62.100 -0.025 0.000 1.094 123 T CB 0.862 69.718 68.868 -0.020 0.000 1.035 123 T HN 1.326 nan 8.240 nan 0.000 0.456 124 A N 2.558 125.402 122.820 0.040 0.000 2.483 124 A HA 0.521 4.875 4.320 0.057 0.000 0.308 124 A C 0.228 177.890 177.584 0.129 0.000 1.291 124 A CA -0.612 51.480 52.037 0.091 0.000 0.774 124 A CB 0.019 19.022 19.000 0.005 0.000 1.134 124 A HN 0.539 nan 8.150 nan 0.000 0.471 125 H N 0.909 120.007 119.070 0.046 0.000 2.517 125 H HA 0.224 4.815 4.556 0.058 0.000 0.282 125 H C 0.265 175.597 175.328 0.007 0.000 1.023 125 H CA -0.269 55.808 56.048 0.048 0.000 1.169 125 H CB -0.144 29.694 29.762 0.126 0.000 1.454 125 H HN 0.532 nan 8.280 nan 0.000 0.556 126 R N 1.536 121.931 120.500 -0.174 0.000 2.254 126 R HA 0.290 4.664 4.340 0.057 0.000 0.318 126 R C -0.782 175.127 176.300 -0.652 0.000 1.031 126 R CA -0.628 55.050 56.100 -0.703 0.000 0.905 126 R CB 0.496 30.455 30.300 -0.569 0.000 1.050 126 R HN 0.056 nan 8.270 nan 0.000 0.456 127 I N 4.021 124.128 120.570 -0.772 0.000 2.321 127 I HA 0.230 4.434 4.170 0.057 0.000 0.291 127 I C 0.160 175.980 176.117 -0.494 0.000 0.998 127 I CA -0.597 60.319 61.300 -0.640 0.000 1.227 127 I CB 1.210 38.893 38.000 -0.528 0.000 1.368 127 I HN 0.504 nan 8.210 nan 0.000 0.466 128 D N 7.876 128.065 120.400 -0.352 0.000 2.313 128 D HA 0.247 4.921 4.640 0.057 0.000 0.247 128 D C -2.229 174.054 176.300 -0.029 0.000 1.094 128 D CA -1.012 52.883 54.000 -0.174 0.000 0.925 128 D CB 1.139 41.913 40.800 -0.043 0.000 1.188 128 D HN 0.264 nan 8.370 nan 0.000 0.430 129 P HA -0.029 nan 4.420 nan 0.000 0.260 129 P C 0.774 178.150 177.300 0.127 0.000 1.172 129 P CA 0.566 63.703 63.100 0.061 0.000 0.760 129 P CB 0.436 32.170 31.700 0.057 0.000 0.773 130 G N 2.537 111.413 108.800 0.126 0.000 2.195 130 G HA2 -0.213 3.781 3.960 0.057 0.000 0.246 130 G HA3 -0.213 3.781 3.960 0.057 0.000 0.246 130 G C -0.034 174.957 174.900 0.150 0.000 0.984 130 G CA -0.305 44.878 45.100 0.139 0.000 0.633 130 G HN 0.624 nan 8.290 nan 0.000 0.525 131 W N 1.813 123.084 121.300 -0.049 0.000 2.223 131 W HA 0.567 5.262 4.660 0.059 0.000 0.334 131 W C -0.234 176.242 176.519 -0.072 0.000 1.334 131 W CA 0.847 58.083 57.345 -0.182 0.000 1.246 131 W CB 1.084 30.340 29.460 -0.339 0.000 1.184 131 W HN 0.347 nan 8.180 nan 0.000 0.563 132 S N 4.554 119.677 115.700 -0.962 0.000 2.779 132 S HA 0.720 5.224 4.470 0.057 0.000 0.293 132 S C -0.352 173.674 174.600 -0.957 0.000 1.150 132 S CA 0.335 58.125 58.200 -0.683 0.000 1.057 132 S CB 0.526 63.526 63.200 -0.333 0.000 1.021 132 S HN 1.074 nan 8.310 nan 0.000 0.485 133 G N 2.230 110.712 108.800 -0.530 0.000 2.359 133 G HA2 0.217 4.211 3.960 0.057 0.000 0.293 133 G HA3 0.217 4.211 3.960 0.057 0.000 0.293 133 G C -0.649 174.379 174.900 0.214 0.000 1.300 133 G CA -0.425 44.547 45.100 -0.213 0.000 0.888 133 G HN 0.878 nan 8.290 nan 0.000 0.541 134 C N -0.332 119.074 119.300 0.176 0.000 2.727 134 C HA 0.447 4.941 4.460 0.057 0.000 0.401 134 C C 1.081 176.244 174.990 0.288 0.000 1.294 134 C CA 0.185 59.312 59.018 0.181 0.000 2.134 134 C CB -0.730 27.054 27.740 0.073 0.000 2.724 134 C HN 0.482 nan 8.230 nan 0.000 0.677 135 I N 2.243 122.866 120.570 0.088 0.000 2.321 135 I HA 0.208 4.412 4.170 0.057 0.000 0.291 135 I C -0.045 176.000 176.117 -0.120 0.000 0.998 135 I CA -0.129 61.119 61.300 -0.087 0.000 1.227 135 I CB 0.784 38.677 38.000 -0.179 0.000 1.368 135 I HN 0.349 nan 8.210 nan 0.000 0.466 136 V N 7.733 127.559 119.914 -0.146 0.000 2.585 136 V HA 0.120 4.274 4.120 0.057 0.000 0.296 136 V C 0.289 176.232 176.094 -0.250 0.000 1.035 136 V CA 0.013 62.205 62.300 -0.180 0.000 1.084 136 V CB 0.519 32.258 31.823 -0.140 0.000 0.953 136 V HN 0.454 nan 8.190 nan 0.000 0.483 137 L N 4.935 125.955 121.223 -0.339 0.000 2.334 137 L HA 0.613 4.987 4.340 0.057 0.000 0.276 137 L C -0.500 176.017 176.870 -0.589 0.000 1.014 137 L CA -0.758 53.799 54.840 -0.471 0.000 0.815 137 L CB 1.935 43.618 42.059 -0.626 0.000 1.268 137 L HN 0.616 nan 8.230 nan 0.000 0.428 138 E N 2.578 122.504 120.200 -0.456 0.000 2.145 138 E HA 0.535 4.919 4.350 0.057 0.000 0.270 138 E C -1.304 175.119 176.600 -0.295 0.000 0.906 138 E CA -0.239 55.959 56.400 -0.337 0.000 0.761 138 E CB 1.228 30.854 29.700 -0.122 0.000 1.116 138 E HN 0.199 nan 8.360 nan 0.000 0.408 139 F N 1.858 121.843 119.950 0.058 0.000 2.425 139 F HA 0.486 5.044 4.527 0.052 0.000 0.331 139 F C -0.426 175.498 175.800 0.206 0.000 1.085 139 F CA -1.264 56.798 58.000 0.104 0.000 1.028 139 F CB 1.090 40.137 39.000 0.078 0.000 1.177 139 F HN 0.408 nan 8.300 nan 0.000 0.487 140 Y N 2.393 122.852 120.300 0.266 0.000 2.373 140 Y HA 0.336 4.897 4.550 0.017 0.000 0.336 140 Y C -0.831 175.158 175.900 0.149 0.000 0.979 140 Y CA -1.346 56.866 58.100 0.187 0.000 1.080 140 Y CB 1.220 39.761 38.460 0.135 0.000 1.190 140 Y HN 0.536 nan 8.280 nan 0.000 0.446 141 N N 2.995 121.419 118.700 -0.461 0.000 2.521 141 N HA 0.064 4.838 4.740 0.057 0.000 0.236 141 N C 0.165 175.376 175.510 -0.499 0.000 1.067 141 N CA 0.365 53.216 53.050 -0.332 0.000 0.939 141 N CB 0.787 39.161 38.487 -0.190 0.000 1.201 141 N HN 0.667 nan 8.380 nan 0.000 0.511 142 S N 0.651 116.236 115.700 -0.193 0.000 2.593 142 S HA 0.200 4.704 4.470 0.057 0.000 0.217 142 S C 1.013 175.610 174.600 -0.005 0.000 0.966 142 S CA -0.303 57.895 58.200 -0.004 0.000 0.914 142 S CB 0.033 63.349 63.200 0.193 0.000 0.776 142 S HN 0.414 nan 8.310 nan 0.000 0.523 143 G N 0.801 109.576 108.800 -0.040 0.000 2.568 143 G HA2 0.427 4.421 3.960 0.057 0.000 0.293 143 G HA3 0.427 4.421 3.960 0.057 0.000 0.293 143 G C 0.282 175.172 174.900 -0.015 0.000 1.347 143 G CA -0.756 44.335 45.100 -0.015 0.000 1.039 143 G HN 0.204 nan 8.290 nan 0.000 0.523 144 K N -1.584 118.814 120.400 -0.003 0.000 2.242 144 K HA 0.186 4.540 4.320 0.057 0.000 0.200 144 K C 0.278 176.883 176.600 0.009 0.000 1.050 144 K CA 0.158 56.448 56.287 0.004 0.000 0.981 144 K CB -0.125 32.379 32.500 0.006 0.000 0.795 144 K HN 0.214 nan 8.250 nan 0.000 0.477 145 L N 1.277 122.503 121.223 0.006 0.000 2.358 145 L HA 0.380 4.754 4.340 0.057 0.000 0.268 145 L C -2.377 174.500 176.870 0.013 0.000 1.032 145 L CA -2.418 52.431 54.840 0.016 0.000 0.805 145 L CB 0.830 42.896 42.059 0.010 0.000 1.253 145 L HN -0.070 nan 8.230 nan 0.000 0.452 146 P HA 0.223 nan 4.420 nan 0.000 0.269 146 P C -1.201 176.072 177.300 -0.044 0.000 1.209 146 P CA -0.029 63.047 63.100 -0.041 0.000 0.776 146 P CB 0.409 32.071 31.700 -0.064 0.000 0.876 147 L N 1.620 122.791 121.223 -0.088 0.000 2.325 147 L HA 0.624 4.998 4.340 0.057 0.000 0.281 147 L C 0.226 177.016 176.870 -0.133 0.000 1.004 147 L CA -0.981 53.807 54.840 -0.087 0.000 0.823 147 L CB 1.681 43.681 42.059 -0.100 0.000 1.236 147 L HN 0.312 nan 8.230 nan 0.000 0.415 148 A N 5.587 128.315 122.820 -0.155 0.000 2.276 148 A HA 0.742 5.096 4.320 0.057 0.000 0.300 148 A C -0.487 176.944 177.584 -0.256 0.000 1.235 148 A CA -0.331 51.498 52.037 -0.346 0.000 0.867 148 A CB 0.201 18.972 19.000 -0.381 0.000 1.137 148 A HN 0.676 nan 8.150 nan 0.000 0.527 149 L N 2.975 124.045 121.223 -0.255 0.000 2.322 149 L HA 0.614 4.988 4.340 0.057 0.000 0.281 149 L C 0.275 177.078 176.870 -0.111 0.000 1.014 149 L CA -0.441 54.306 54.840 -0.156 0.000 0.815 149 L CB 1.622 43.602 42.059 -0.132 0.000 1.247 149 L HN 0.717 nan 8.230 nan 0.000 0.421 150 R N 2.690 123.162 120.500 -0.047 0.000 2.494 150 R HA 0.460 4.834 4.340 0.057 0.000 0.305 150 R C -2.545 173.800 176.300 0.076 0.000 0.959 150 R CA -1.922 54.179 56.100 0.001 0.000 0.864 150 R CB 1.769 32.054 30.300 -0.025 0.000 1.159 150 R HN 0.278 nan 8.270 nan 0.000 0.446 151 P HA -0.098 nan 4.420 nan 0.000 0.263 151 P C 0.626 177.962 177.300 0.061 0.000 1.175 151 P CA 1.307 64.478 63.100 0.119 0.000 0.761 151 P CB 0.562 32.338 31.700 0.127 0.000 0.794 152 G N 1.882 110.709 108.800 0.046 0.000 2.234 152 G HA2 -0.248 3.746 3.960 0.057 0.000 0.235 152 G HA3 -0.248 3.746 3.960 0.057 0.000 0.235 152 G C 0.245 175.159 174.900 0.024 0.000 0.997 152 G CA 0.232 45.350 45.100 0.030 0.000 0.623 152 G HN 0.670 nan 8.290 nan 0.000 0.514 153 M N 1.083 120.697 119.600 0.023 0.000 2.245 153 M HA 0.647 5.161 4.480 0.057 0.000 0.330 153 M C 0.633 176.942 176.300 0.015 0.000 1.098 153 M CA -0.305 55.001 55.300 0.010 0.000 1.172 153 M CB 0.439 33.036 32.600 -0.005 0.000 1.467 153 M HN 0.042 nan 8.290 nan 0.000 0.454 154 L N 2.696 123.926 121.223 0.011 0.000 2.513 154 L HA 0.022 4.396 4.340 0.057 0.000 0.272 154 L C 0.646 177.524 176.870 0.014 0.000 1.187 154 L CA 0.027 54.876 54.840 0.015 0.000 0.895 154 L CB 0.249 42.315 42.059 0.012 0.000 1.147 154 L HN 0.831 nan 8.230 nan 0.000 0.483 155 I N 1.138 121.726 120.570 0.031 0.000 4.592 155 I HA 0.416 4.620 4.170 0.057 0.000 0.329 155 I C 0.618 176.773 176.117 0.063 0.000 1.309 155 I CA 0.294 61.624 61.300 0.050 0.000 1.243 155 I CB 0.853 38.913 38.000 0.099 0.000 1.241 155 I HN 0.616 nan 8.210 nan 0.000 0.434 156 G N 0.209 109.034 108.800 0.043 0.000 2.489 156 G HA2 0.704 4.698 3.960 0.057 0.000 0.305 156 G HA3 0.704 4.698 3.960 0.057 0.000 0.305 156 G C -1.948 172.963 174.900 0.018 0.000 1.311 156 G CA -0.082 45.039 45.100 0.035 0.000 0.813 156 G HN 0.337 nan 8.290 nan 0.000 0.480 157 A N -0.288 122.535 122.820 0.005 0.000 2.408 157 A HA 0.740 5.094 4.320 0.057 0.000 0.295 157 A C -0.977 176.575 177.584 -0.055 0.000 1.040 157 A CA -0.414 51.618 52.037 -0.008 0.000 0.707 157 A CB 1.167 20.169 19.000 0.002 0.000 1.235 157 A HN 0.752 nan 8.150 nan 0.000 0.418 158 L N 2.537 123.701 121.223 -0.099 0.000 2.307 158 L HA 0.612 4.986 4.340 0.057 0.000 0.282 158 L C 0.662 177.293 176.870 -0.398 0.000 1.051 158 L CA -0.270 54.386 54.840 -0.306 0.000 0.804 158 L CB 1.849 43.699 42.059 -0.349 0.000 1.197 158 L HN 0.890 nan 8.230 nan 0.000 0.431 159 S N 2.102 117.495 115.700 -0.511 0.000 2.600 159 S HA 0.774 5.278 4.470 0.057 0.000 0.300 159 S C -0.965 173.234 174.600 -0.668 0.000 1.087 159 S CA -0.698 57.272 58.200 -0.385 0.000 0.965 159 S CB 1.761 64.911 63.200 -0.083 0.000 1.089 159 S HN 0.276 nan 8.310 nan 0.000 0.496 160 F N 0.250 120.178 119.950 -0.037 0.000 2.547 160 F HA 0.587 5.149 4.527 0.058 0.000 0.316 160 F C 0.165 175.894 175.800 -0.118 0.000 1.121 160 F CA -0.538 57.387 58.000 -0.125 0.000 0.911 160 F CB 2.167 41.018 39.000 -0.247 0.000 1.179 160 F HN 0.737 nan 8.300 nan 0.000 0.443 161 E N 4.313 124.562 120.200 0.083 0.000 2.216 161 E HA 0.409 4.793 4.350 0.057 0.000 0.260 161 E C -2.772 173.829 176.600 0.002 0.000 0.880 161 E CA -2.594 53.847 56.400 0.067 0.000 0.765 161 E CB 2.084 31.912 29.700 0.213 0.000 1.174 161 E HN 0.176 nan 8.360 nan 0.000 0.417 162 P HA -0.004 nan 4.420 nan 0.000 0.265 162 P C -0.421 176.919 177.300 0.067 0.000 1.193 162 P CA 0.311 63.418 63.100 0.012 0.000 0.765 162 P CB 0.513 32.252 31.700 0.065 0.000 0.823 163 L N 1.602 122.875 121.223 0.083 0.000 2.479 163 L HA 0.161 4.535 4.340 0.057 0.000 0.249 163 L C 1.812 178.732 176.870 0.083 0.000 1.178 163 L CA -0.083 54.806 54.840 0.081 0.000 0.811 163 L CB 0.154 42.258 42.059 0.076 0.000 1.187 163 L HN 0.401 nan 8.230 nan 0.000 0.480 164 S N -1.319 114.423 115.700 0.070 0.000 2.522 164 S HA 0.197 4.701 4.470 0.057 0.000 0.227 164 S C 0.557 175.193 174.600 0.061 0.000 0.986 164 S CA 0.223 58.460 58.200 0.062 0.000 0.929 164 S CB -0.149 63.081 63.200 0.051 0.000 0.769 164 S HN 0.904 nan 8.310 nan 0.000 0.529 165 G N 0.920 109.759 108.800 0.066 0.000 2.466 165 G HA2 0.490 4.484 3.960 0.057 0.000 0.291 165 G HA3 0.490 4.484 3.960 0.057 0.000 0.291 165 G C -3.580 171.360 174.900 0.066 0.000 1.460 165 G CA -1.106 44.030 45.100 0.061 0.000 0.791 165 G HN 0.036 nan 8.290 nan 0.000 0.505 166 P HA 0.450 nan 4.420 nan 0.000 0.271 166 P C 0.149 177.479 177.300 0.051 0.000 1.220 166 P CA 0.107 63.243 63.100 0.061 0.000 0.768 166 P CB 1.232 32.962 31.700 0.050 0.000 0.848 167 A N 3.657 126.509 122.820 0.054 0.000 2.440 167 A HA 0.160 4.514 4.320 0.057 0.000 0.251 167 A C 1.533 179.141 177.584 0.039 0.000 1.089 167 A CA -0.376 51.689 52.037 0.048 0.000 0.779 167 A CB -0.083 18.949 19.000 0.053 0.000 1.022 167 A HN 0.400 nan 8.150 nan 0.000 0.492 168 V N 2.923 122.856 119.914 0.032 0.000 2.427 168 V HA -0.111 4.043 4.120 0.057 0.000 0.248 168 V C 1.324 177.431 176.094 0.022 0.000 1.051 168 V CA 1.784 64.098 62.300 0.024 0.000 1.048 168 V CB -0.655 31.180 31.823 0.020 0.000 0.666 168 V HN 0.807 nan 8.190 nan 0.000 0.456 169 R N 0.758 121.273 120.500 0.025 0.000 2.724 169 R HA 0.308 4.682 4.340 0.057 0.000 0.284 169 R C -2.498 173.825 176.300 0.038 0.000 1.481 169 R CA -1.382 54.730 56.100 0.021 0.000 1.652 169 R CB 0.612 30.919 30.300 0.011 0.000 1.175 169 R HN 0.380 nan 8.270 nan 0.000 0.613 170 P HA -0.060 nan 4.420 nan 0.000 0.277 170 P C 0.233 177.604 177.300 0.118 0.000 1.276 170 P CA -0.359 62.797 63.100 0.092 0.000 0.788 170 P CB 0.750 32.502 31.700 0.086 0.000 1.114 171 Y N 1.293 121.618 120.300 0.041 0.000 2.145 171 Y HA -0.262 4.322 4.550 0.056 0.000 0.286 171 Y C 2.384 178.295 175.900 0.017 0.000 1.145 171 Y CA 2.633 60.766 58.100 0.055 0.000 1.148 171 Y CB -0.713 37.823 38.460 0.127 0.000 0.981 171 Y HN 0.365 nan 8.280 nan 0.000 0.507 172 N N 0.913 119.704 118.700 0.151 0.000 2.205 172 N HA -0.199 4.575 4.740 0.057 0.000 0.186 172 N C 0.037 175.530 175.510 -0.029 0.000 1.015 172 N CA 1.230 54.299 53.050 0.033 0.000 0.862 172 N CB -0.653 37.848 38.487 0.023 0.000 0.986 172 N HN 0.293 nan 8.380 nan 0.000 0.429 173 R N 0.336 120.826 120.500 -0.018 0.000 2.369 173 R HA 0.464 4.838 4.340 0.057 0.000 0.310 173 R C -0.078 176.192 176.300 -0.050 0.000 1.141 173 R CA -0.264 55.818 56.100 -0.031 0.000 1.116 173 R CB 0.959 31.253 30.300 -0.011 0.000 1.135 173 R HN 0.152 nan 8.270 nan 0.000 0.529 174 R N 0.000 120.454 120.500 -0.077 0.000 2.786 174 R HA 0.000 4.374 4.340 0.057 0.000 0.208 174 R CA 0.000 56.050 56.100 -0.083 0.000 0.921 174 R CB 0.000 30.222 30.300 -0.130 0.000 0.687 174 R HN 0.000 nan 8.270 nan 0.000 0.535