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 2j3s_1_B DATA FIRST_RESID -1 DATA SEQUENCE MXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX 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PFSVKVTGEG RVKESITRRR DATA SEQUENCE RAPSVANVGX HCDXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XIRFVPAEMG THTVXXXXXX XXXXXXXXXF TVGPXXXGGA HKVRAGGPGL DATA SEQUENCE ERAEAGVPAE FSIWTREAGA GGLAIAVEGP SKAEISFEDR KDGSCGVAYV DATA SEQUENCE VQEPGDYEVS VKFNEEHIPD SPFVVPVASP S 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 0.000 176.447 176.300 0.246 0.000 1.140 -1 M CA 0.000 55.393 55.300 0.156 0.000 0.988 -1 M CB 0.000 32.685 32.600 0.143 0.000 1.302 2046 D N -0.230 120.328 120.400 0.263 0.000 2.336 2046 D HA 0.546 5.188 4.640 0.002 0.000 0.248 2046 D C 1.085 177.461 176.300 0.126 0.000 1.326 2046 D CA 0.234 54.326 54.000 0.153 0.000 0.973 2046 D CB 1.405 42.246 40.800 0.069 0.000 1.255 2046 D HN 0.589 nan 8.370 nan 0.000 0.558 2047 A N 2.332 125.281 122.820 0.216 0.000 2.024 2047 A HA -0.147 4.174 4.320 0.002 0.000 0.220 2047 A C 1.944 179.556 177.584 0.047 0.000 1.164 2047 A CA 1.953 54.106 52.037 0.193 0.000 0.643 2047 A CB -0.265 18.878 19.000 0.238 0.000 0.806 2047 A HN 0.539 nan 8.150 nan 0.000 0.451 2048 S N -1.046 114.677 115.700 0.038 0.000 2.489 2048 S HA -0.010 4.461 4.470 0.002 0.000 0.228 2048 S C 1.632 176.224 174.600 -0.014 0.000 0.995 2048 S CA 0.339 58.550 58.200 0.019 0.000 0.934 2048 S CB -0.180 63.034 63.200 0.023 0.000 0.771 2048 S HN 0.493 nan 8.310 nan 0.000 0.522 2049 R N 1.320 121.791 120.500 -0.049 0.000 2.299 2049 R HA 0.283 4.625 4.340 0.002 0.000 0.197 2049 R C 0.134 176.360 176.300 -0.122 0.000 0.971 2049 R CA 0.003 56.056 56.100 -0.078 0.000 1.030 2049 R CB -0.974 29.274 30.300 -0.087 0.000 0.932 2049 R HN 0.369 nan 8.270 nan 0.000 0.477 2050 V N 2.687 122.506 119.914 -0.157 0.000 2.585 2050 V HA 0.068 4.189 4.120 0.002 0.000 0.296 2050 V C 0.835 176.903 176.094 -0.043 0.000 1.035 2050 V CA 0.178 62.381 62.300 -0.162 0.000 1.084 2050 V CB 0.663 32.368 31.823 -0.196 0.000 0.953 2050 V HN 0.075 nan 8.190 nan 0.000 0.483 2051 R N 3.111 123.591 120.500 -0.034 0.000 2.562 2051 R HA 0.754 5.095 4.340 0.002 0.000 0.298 2051 R C -1.541 174.772 176.300 0.023 0.000 0.961 2051 R CA -0.632 55.474 56.100 0.010 0.000 0.881 2051 R CB 2.251 32.551 30.300 -0.001 0.000 1.159 2051 R HN 0.548 nan 8.270 nan 0.000 0.450 2052 V N 2.051 121.983 119.914 0.031 0.000 2.531 2052 V HA 0.499 4.620 4.120 0.002 0.000 0.301 2052 V C -0.453 175.594 176.094 -0.079 0.000 1.034 2052 V CA -0.690 61.588 62.300 -0.037 0.000 0.865 2052 V CB 1.664 33.370 31.823 -0.195 0.000 0.995 2052 V HN 0.988 nan 8.190 nan 0.000 0.424 2053 S N 2.333 118.016 115.700 -0.028 0.000 2.607 2053 S HA 1.027 5.499 4.470 0.002 0.000 0.273 2053 S C -0.361 174.268 174.600 0.047 0.000 1.148 2053 S CA -0.208 57.984 58.200 -0.014 0.000 0.833 2053 S CB 2.214 65.422 63.200 0.013 0.000 1.130 2053 S HN 2.320 nan 8.310 nan 0.000 0.470 2054 G N 0.581 109.415 108.800 0.057 0.000 2.375 2054 G HA2 0.097 4.058 3.960 0.002 0.000 0.663 2054 G HA3 0.097 4.058 3.960 0.002 0.000 0.663 2054 G C -0.128 174.855 174.900 0.138 0.000 1.391 2054 G CA -0.279 44.884 45.100 0.105 0.000 0.949 2054 G HN 0.673 nan 8.290 nan 0.000 0.646 2055 Q N -0.043 119.831 119.800 0.124 0.000 2.135 2055 Q HA -0.079 4.262 4.340 0.002 0.000 0.204 2055 Q C 2.614 178.603 176.000 -0.018 0.000 0.981 2055 Q CA 1.831 57.689 55.803 0.092 0.000 0.856 2055 Q CB -0.096 28.652 28.738 0.017 0.000 0.902 2055 Q HN 0.974 nan 8.270 nan 0.000 0.425 2056 G N 0.252 109.098 108.800 0.077 0.000 2.708 2056 G HA2 -0.115 3.846 3.960 0.002 0.000 0.210 2056 G HA3 -0.115 3.846 3.960 0.002 0.000 0.210 2056 G C 1.177 176.198 174.900 0.203 0.000 1.141 2056 G CA 0.049 45.248 45.100 0.165 0.000 0.788 2056 G HN 0.193 nan 8.290 nan 0.000 0.531 2057 L N -0.237 121.007 121.223 0.035 0.000 2.395 2057 L HA 0.080 4.422 4.340 0.002 0.000 0.218 2057 L C 2.151 179.074 176.870 0.088 0.000 1.130 2057 L CA 1.334 56.079 54.840 -0.159 0.000 0.826 2057 L CB -0.009 41.840 42.059 -0.350 0.000 0.941 2057 L HN 0.665 nan 8.230 nan 0.000 0.451 2058 H N -3.578 115.516 119.070 0.040 0.000 3.680 2058 H HA 0.392 4.949 4.556 0.002 0.000 0.260 2058 H C 0.026 175.402 175.328 0.079 0.000 1.183 2058 H CA -0.474 55.617 56.048 0.072 0.000 1.159 2058 H CB 0.691 30.491 29.762 0.064 0.000 1.567 2058 H HN 0.115 nan 8.280 nan 0.000 0.648 2059 E N 0.273 120.299 120.200 -0.291 0.000 2.388 2059 E HA 0.505 4.856 4.350 0.002 0.000 0.289 2059 E C -1.333 175.166 176.600 -0.167 0.000 0.944 2059 E CA -0.726 55.499 56.400 -0.292 0.000 0.792 2059 E CB 1.865 31.189 29.700 -0.628 0.000 1.239 2059 E HN 0.490 nan 8.360 nan 0.000 0.412 2060 G N 1.844 110.592 108.800 -0.087 0.000 2.695 2060 G HA2 0.532 4.493 3.960 0.002 0.000 0.290 2060 G HA3 0.532 4.493 3.960 0.002 0.000 0.290 2060 G C -1.943 172.949 174.900 -0.015 0.000 1.410 2060 G CA -0.576 44.462 45.100 -0.103 0.000 0.844 2060 G HN 0.504 nan 8.290 nan 0.000 0.478 2061 H N -0.984 118.011 119.070 -0.124 0.000 2.894 2061 H HA 0.562 5.120 4.556 0.002 0.000 0.367 2061 H C -0.101 175.192 175.328 -0.058 0.000 1.144 2061 H CA -0.374 55.637 56.048 -0.061 0.000 1.180 2061 H CB 1.994 31.734 29.762 -0.037 0.000 1.758 2061 H HN 0.531 nan 8.280 nan 0.000 0.541 2062 T N 5.096 119.469 114.554 -0.303 0.000 2.800 2062 T HA -0.046 4.306 4.350 0.002 0.000 0.283 2062 T C -0.068 174.764 174.700 0.220 0.000 0.999 2062 T CA 1.365 63.405 62.100 -0.100 0.000 1.176 2062 T CB -0.558 68.258 68.868 -0.087 0.000 0.973 2062 T HN 0.612 nan 8.240 nan 0.000 0.519 2063 F N 0.940 120.884 119.950 -0.010 0.000 3.057 2063 F HA -0.193 4.336 4.527 0.003 0.000 0.287 2063 F C 0.711 176.518 175.800 0.013 0.000 0.834 2063 F CA 0.514 58.519 58.000 0.007 0.000 1.147 2063 F CB -1.593 37.420 39.000 0.022 0.000 1.245 2063 F HN 0.577 nan 8.300 nan 0.000 0.509 2064 E N 0.576 120.828 120.200 0.088 0.000 2.272 2064 E HA 0.377 4.728 4.350 0.002 0.000 0.269 2064 E C -2.445 174.093 176.600 -0.103 0.000 0.877 2064 E CA -2.170 54.243 56.400 0.022 0.000 0.755 2064 E CB 2.137 31.870 29.700 0.055 0.000 1.192 2064 E HN -0.226 nan 8.360 nan 0.000 0.422 2065 P HA 0.163 nan 4.420 nan 0.000 0.276 2065 P C -1.308 175.827 177.300 -0.275 0.000 1.235 2065 P CA -0.224 62.755 63.100 -0.202 0.000 0.772 2065 P CB 1.015 32.638 31.700 -0.129 0.000 0.871 2066 A N 3.223 125.743 122.820 -0.500 0.000 2.337 2066 A HA 0.660 4.981 4.320 0.002 0.000 0.329 2066 A C -0.215 177.175 177.584 -0.324 0.000 1.146 2066 A CA -0.552 51.187 52.037 -0.497 0.000 0.800 2066 A CB 1.007 19.520 19.000 -0.811 0.000 1.220 2066 A HN 0.643 nan 8.150 nan 0.000 0.472 2067 E N 0.629 120.782 120.200 -0.079 0.000 2.314 2067 E HA 0.759 5.110 4.350 0.002 0.000 0.272 2067 E C -1.169 175.522 176.600 0.152 0.000 0.884 2067 E CA -0.678 55.711 56.400 -0.019 0.000 0.753 2067 E CB 1.731 31.381 29.700 -0.083 0.000 1.213 2067 E HN 0.772 nan 8.360 nan 0.000 0.432 2068 F N 0.033 119.991 119.950 0.012 0.000 2.664 2068 F HA 0.728 5.257 4.527 0.002 0.000 0.317 2068 F C -1.519 174.262 175.800 -0.031 0.000 1.108 2068 F CA -1.542 56.443 58.000 -0.025 0.000 0.957 2068 F CB 0.922 39.881 39.000 -0.067 0.000 1.365 2068 F HN 0.310 nan 8.300 nan 0.000 0.475 2069 I N 2.483 123.155 120.570 0.169 0.000 2.378 2069 I HA 0.420 4.591 4.170 0.002 0.000 0.291 2069 I C -0.675 175.519 176.117 0.129 0.000 0.992 2069 I CA -0.489 60.847 61.300 0.061 0.000 1.154 2069 I CB 1.672 39.691 38.000 0.033 0.000 1.315 2069 I HN 0.474 nan 8.210 nan 0.000 0.448 2070 I N 5.261 125.882 120.570 0.084 0.000 2.321 2070 I HA 0.296 4.467 4.170 0.002 0.000 0.291 2070 I C -0.598 175.535 176.117 0.025 0.000 0.998 2070 I CA -0.463 60.890 61.300 0.088 0.000 1.227 2070 I CB 1.141 39.213 38.000 0.121 0.000 1.368 2070 I HN 0.442 nan 8.210 nan 0.000 0.466 2071 D N 4.229 124.631 120.400 0.003 0.000 2.414 2071 D HA 0.194 4.835 4.640 0.002 0.000 0.232 2071 D C 0.265 176.514 176.300 -0.085 0.000 1.070 2071 D CA -0.187 53.794 54.000 -0.032 0.000 0.839 2071 D CB 1.707 42.492 40.800 -0.025 0.000 1.079 2071 D HN 0.457 nan 8.370 nan 0.000 0.521 2072 T N 2.884 117.374 114.554 -0.106 0.000 3.044 2072 T HA 0.139 4.490 4.350 0.002 0.000 0.260 2072 T C 1.596 176.181 174.700 -0.190 0.000 1.019 2072 T CA 0.070 62.041 62.100 -0.215 0.000 0.921 2072 T CB 0.092 68.876 68.868 -0.141 0.000 1.053 2072 T HN 0.305 nan 8.240 nan 0.000 0.533 2073 R N 1.028 121.458 120.500 -0.116 0.000 2.127 2073 R HA -0.037 4.304 4.340 0.002 0.000 0.238 2073 R C 1.089 177.325 176.300 -0.106 0.000 1.134 2073 R CA 1.632 57.677 56.100 -0.092 0.000 0.975 2073 R CB -0.014 30.248 30.300 -0.063 0.000 0.865 2073 R HN 0.336 nan 8.270 nan 0.000 0.447 2074 D N -0.429 119.901 120.400 -0.117 0.000 2.339 2074 D HA 0.067 4.708 4.640 0.002 0.000 0.217 2074 D C 0.939 177.164 176.300 -0.125 0.000 1.050 2074 D CA 0.333 54.272 54.000 -0.102 0.000 0.856 2074 D CB 0.599 41.353 40.800 -0.076 0.000 0.922 2074 D HN 0.215 nan 8.370 nan 0.000 0.518 2075 A N 0.397 123.090 122.820 -0.211 0.000 2.218 2075 A HA 0.467 4.788 4.320 0.002 0.000 0.209 2075 A C 1.551 179.112 177.584 -0.037 0.000 1.168 2075 A CA 0.823 52.696 52.037 -0.274 0.000 0.804 2075 A CB -0.164 18.308 19.000 -0.879 0.000 0.834 2075 A HN 0.255 nan 8.150 nan 0.000 0.482 2076 G N -0.813 107.953 108.800 -0.056 0.000 2.550 2076 G HA2 -0.298 3.663 3.960 0.002 0.000 0.277 2076 G HA3 -0.298 3.663 3.960 0.002 0.000 0.277 2076 G C -0.179 174.742 174.900 0.035 0.000 1.190 2076 G CA 0.368 45.418 45.100 -0.083 0.000 0.971 2076 G HN 0.501 nan 8.290 nan 0.000 0.559 2077 Y N 1.862 122.286 120.300 0.206 0.000 2.316 2077 Y HA 0.532 5.082 4.550 0.001 0.000 0.331 2077 Y C 1.145 177.104 175.900 0.098 0.000 1.083 2077 Y CA 0.851 59.045 58.100 0.157 0.000 1.206 2077 Y CB 1.460 39.959 38.460 0.065 0.000 1.195 2077 Y HN 1.526 nan 8.280 nan 0.000 0.497 2078 G N 0.566 109.405 108.800 0.065 0.000 2.347 2078 G HA2 0.419 4.380 3.960 0.002 0.000 0.303 2078 G HA3 0.419 4.380 3.960 0.002 0.000 0.303 2078 G C -1.042 173.454 174.900 -0.674 0.000 1.481 2078 G CA -0.484 44.282 45.100 -0.558 0.000 0.914 2078 G HN 0.830 nan 8.290 nan 0.000 0.638 2079 G N -1.046 107.412 108.800 -0.570 0.000 2.437 2079 G HA2 0.658 4.619 3.960 0.002 0.000 0.319 2079 G HA3 0.658 4.619 3.960 0.002 0.000 0.319 2079 G C -0.895 173.861 174.900 -0.240 0.000 1.158 2079 G CA -0.602 44.334 45.100 -0.274 0.000 0.899 2079 G HN 0.740 nan 8.290 nan 0.000 0.502 2080 L N 1.394 122.611 121.223 -0.009 0.000 2.289 2080 L HA 0.604 4.945 4.340 0.002 0.000 0.285 2080 L C 0.623 177.513 176.870 0.034 0.000 1.049 2080 L CA -0.568 54.331 54.840 0.098 0.000 0.804 2080 L CB 1.375 43.529 42.059 0.158 0.000 1.195 2080 L HN 0.614 nan 8.230 nan 0.000 0.428 2081 S N 5.099 120.817 115.700 0.029 0.000 2.526 2081 S HA 0.859 5.330 4.470 0.002 0.000 0.293 2081 S C -0.975 173.637 174.600 0.020 0.000 1.092 2081 S CA -0.763 57.441 58.200 0.008 0.000 0.980 2081 S CB 1.732 64.917 63.200 -0.026 0.000 1.048 2081 S HN 0.617 nan 8.310 nan 0.000 0.483 2082 L N 2.428 123.667 121.223 0.027 0.000 2.493 2082 L HA 0.768 5.109 4.340 0.002 0.000 0.265 2082 L C -1.024 175.868 176.870 0.036 0.000 0.954 2082 L CA -0.026 54.844 54.840 0.050 0.000 0.844 2082 L CB 2.110 44.224 42.059 0.092 0.000 1.302 2082 L HN 1.125 nan 8.230 nan 0.000 0.405 2083 S N 4.298 120.020 115.700 0.036 0.000 2.564 2083 S HA 0.740 5.211 4.470 0.002 0.000 0.274 2083 S C -1.020 173.596 174.600 0.028 0.000 1.124 2083 S CA -0.762 57.457 58.200 0.030 0.000 0.869 2083 S CB 1.883 65.099 63.200 0.027 0.000 1.105 2083 S HN 0.499 nan 8.310 nan 0.000 0.472 2084 I N 1.810 122.390 120.570 0.017 0.000 2.439 2084 I HA 0.389 4.561 4.170 0.002 0.000 0.283 2084 I C -0.487 175.678 176.117 0.080 0.000 1.023 2084 I CA -0.373 60.933 61.300 0.010 0.000 1.100 2084 I CB 1.649 39.582 38.000 -0.110 0.000 1.238 2084 I HN 0.695 nan 8.210 nan 0.000 0.445 2085 E N 4.760 125.013 120.200 0.088 0.000 2.191 2085 E HA 0.815 5.167 4.350 0.002 0.000 0.274 2085 E C -0.017 176.584 176.600 0.000 0.000 0.948 2085 E CA -0.741 55.688 56.400 0.048 0.000 0.802 2085 E CB 2.896 32.609 29.700 0.021 0.000 1.137 2085 E HN 0.778 nan 8.360 nan 0.000 0.397 2086 G N 1.620 110.329 108.800 -0.151 0.000 2.341 2086 G HA2 0.131 4.092 3.960 0.002 0.000 0.299 2086 G HA3 0.131 4.092 3.960 0.002 0.000 0.299 2086 G C -2.308 172.333 174.900 -0.431 0.000 1.274 2086 G CA -0.751 44.008 45.100 -0.568 0.000 0.853 2086 G HN 0.308 nan 8.290 nan 0.000 0.493 2087 P HA 0.029 nan 4.420 nan 0.000 0.216 2087 P C 0.946 178.171 177.300 -0.124 0.000 1.153 2087 P CA 2.095 65.036 63.100 -0.264 0.000 0.858 2087 P CB 0.064 31.615 31.700 -0.249 0.000 0.789 2088 S N -2.901 112.764 115.700 -0.058 0.000 2.661 2088 S HA 0.449 4.920 4.470 0.002 0.000 0.285 2088 S C -0.665 173.990 174.600 0.092 0.000 1.138 2088 S CA -1.098 57.116 58.200 0.024 0.000 0.855 2088 S CB 1.731 64.952 63.200 0.035 0.000 1.136 2088 S HN -0.197 nan 8.310 nan 0.000 0.484 2089 K N 0.569 121.007 120.400 0.063 0.000 2.414 2089 K HA 0.432 4.753 4.320 0.002 0.000 0.272 2089 K C -0.996 175.654 176.600 0.083 0.000 0.993 2089 K CA -0.394 55.935 56.287 0.071 0.000 0.964 2089 K CB 0.796 33.321 32.500 0.041 0.000 0.925 2089 K HN 0.384 nan 8.250 nan 0.000 0.487 2090 V N 3.506 123.473 119.914 0.088 0.000 2.487 2090 V HA 0.063 4.184 4.120 0.002 0.000 0.298 2090 V C -0.765 175.365 176.094 0.061 0.000 1.028 2090 V CA -0.874 61.476 62.300 0.083 0.000 0.860 2090 V CB 1.731 33.629 31.823 0.124 0.000 0.991 2090 V HN 0.698 nan 8.190 nan 0.000 0.427 2091 D N 5.407 125.830 120.400 0.038 0.000 2.424 2091 D HA 0.379 5.020 4.640 0.002 0.000 0.244 2091 D C -0.277 176.056 176.300 0.056 0.000 1.134 2091 D CA 0.699 54.718 54.000 0.030 0.000 0.881 2091 D CB 1.009 41.814 40.800 0.007 0.000 1.191 2091 D HN 0.342 nan 8.370 nan 0.000 0.445 2092 I N 1.694 122.289 120.570 0.041 0.000 2.582 2092 I HA 0.299 4.471 4.170 0.002 0.000 0.292 2092 I C 0.001 176.122 176.117 0.006 0.000 1.066 2092 I CA -0.780 60.546 61.300 0.043 0.000 1.053 2092 I CB 2.154 40.177 38.000 0.038 0.000 1.241 2092 I HN 0.154 nan 8.210 nan 0.000 0.421 2093 N N 2.841 121.531 118.700 -0.016 0.000 2.240 2093 N HA 0.663 5.404 4.740 0.002 0.000 0.302 2093 N C -1.370 174.098 175.510 -0.070 0.000 1.106 2093 N CA -0.267 52.761 53.050 -0.037 0.000 0.778 2093 N CB 2.371 40.836 38.487 -0.038 0.000 1.431 2093 N HN 0.738 nan 8.380 nan 0.000 0.479 2094 T N -0.857 113.660 114.554 -0.062 0.000 2.906 2094 T HA 0.497 4.848 4.350 0.002 0.000 0.295 2094 T C -1.055 173.610 174.700 -0.058 0.000 1.061 2094 T CA -0.789 61.263 62.100 -0.080 0.000 1.000 2094 T CB 2.041 70.873 68.868 -0.060 0.000 1.103 2094 T HN 0.457 nan 8.240 nan 0.000 0.486 2095 E N 1.400 121.563 120.200 -0.063 0.000 2.265 2095 E HA 0.260 4.611 4.350 0.002 0.000 0.262 2095 E C -1.417 175.160 176.600 -0.037 0.000 0.889 2095 E CA -0.946 55.427 56.400 -0.044 0.000 0.789 2095 E CB 1.297 30.969 29.700 -0.047 0.000 1.221 2095 E HN 0.578 nan 8.360 nan 0.000 0.414 2096 D N 3.953 124.339 120.400 -0.024 0.000 2.368 2096 D HA 0.041 4.682 4.640 0.002 0.000 0.268 2096 D C 0.234 176.524 176.300 -0.017 0.000 1.298 2096 D CA 0.511 54.501 54.000 -0.016 0.000 0.938 2096 D CB 0.454 41.250 40.800 -0.007 0.000 1.101 2096 D HN 0.312 nan 8.370 nan 0.000 0.509 2097 L N 1.676 122.888 121.223 -0.020 0.000 2.466 2097 L HA 0.080 4.422 4.340 0.002 0.000 0.257 2097 L C 2.133 178.995 176.870 -0.013 0.000 1.189 2097 L CA -0.617 54.212 54.840 -0.018 0.000 0.813 2097 L CB 0.401 42.448 42.059 -0.021 0.000 1.118 2097 L HN 0.377 nan 8.230 nan 0.000 0.471 2098 E N 0.469 120.662 120.200 -0.012 0.000 2.097 2098 E HA -0.282 4.069 4.350 0.002 0.000 0.196 2098 E C 0.640 177.233 176.600 -0.010 0.000 1.000 2098 E CA 1.907 58.301 56.400 -0.010 0.000 0.804 2098 E CB -0.416 29.278 29.700 -0.010 0.000 0.740 2098 E HN 0.843 nan 8.360 nan 0.000 0.454 2099 D N -0.622 119.771 120.400 -0.012 0.000 2.325 2099 D HA 0.181 4.822 4.640 0.002 0.000 0.234 2099 D C 1.041 177.332 176.300 -0.015 0.000 1.122 2099 D CA 0.367 54.359 54.000 -0.013 0.000 0.850 2099 D CB 0.563 41.355 40.800 -0.013 0.000 0.921 2099 D HN 0.384 nan 8.370 nan 0.000 0.513 2100 G N -1.020 107.772 108.800 -0.013 0.000 2.132 2100 G HA2 -0.260 3.701 3.960 0.002 0.000 0.234 2100 G HA3 -0.260 3.701 3.960 0.002 0.000 0.234 2100 G C 0.358 175.250 174.900 -0.014 0.000 0.989 2100 G CA 0.283 45.375 45.100 -0.013 0.000 0.676 2100 G HN 0.445 nan 8.290 nan 0.000 0.522 2101 T N -0.390 114.156 114.554 -0.014 0.000 2.944 2101 T HA 0.574 4.925 4.350 0.002 0.000 0.284 2101 T C -0.050 174.640 174.700 -0.016 0.000 1.010 2101 T CA 0.327 62.418 62.100 -0.015 0.000 1.025 2101 T CB 2.037 70.896 68.868 -0.015 0.000 1.079 2101 T HN 0.898 nan 8.240 nan 0.000 0.516 2102 C N 3.127 122.416 119.300 -0.018 0.000 2.364 2102 C HA 0.721 5.182 4.460 0.002 0.000 0.324 2102 C C -0.092 174.856 174.990 -0.069 0.000 1.234 2102 C CA -0.908 58.090 59.018 -0.033 0.000 1.417 2102 C CB -0.032 27.698 27.740 -0.017 0.000 2.101 2102 C HN 0.991 nan 8.230 nan 0.000 0.466 2103 R N 4.616 125.062 120.500 -0.089 0.000 2.254 2103 R HA 0.684 5.026 4.340 0.002 0.000 0.318 2103 R C -1.161 175.006 176.300 -0.222 0.000 1.031 2103 R CA -0.197 55.818 56.100 -0.141 0.000 0.905 2103 R CB 0.903 31.142 30.300 -0.101 0.000 1.050 2103 R HN 0.683 nan 8.270 nan 0.000 0.456 2104 V N 4.180 123.841 119.914 -0.422 0.000 2.435 2104 V HA 0.385 4.507 4.120 0.002 0.000 0.290 2104 V C -0.358 175.476 176.094 -0.433 0.000 1.030 2104 V CA -0.510 61.461 62.300 -0.550 0.000 0.881 2104 V CB 1.949 33.109 31.823 -1.106 0.000 0.983 2104 V HN 0.862 nan 8.190 nan 0.000 0.445 2105 T N 5.347 119.777 114.554 -0.206 0.000 2.840 2105 T HA 0.639 4.990 4.350 0.002 0.000 0.287 2105 T C -0.968 173.738 174.700 0.010 0.000 0.991 2105 T CA -0.349 61.684 62.100 -0.110 0.000 0.964 2105 T CB 0.849 69.655 68.868 -0.103 0.000 0.954 2105 T HN 0.661 nan 8.240 nan 0.000 0.438 2106 Y N -0.752 119.488 120.300 -0.101 0.000 2.570 2106 Y HA 0.785 5.337 4.550 0.003 0.000 0.345 2106 Y C -0.990 174.854 175.900 -0.093 0.000 1.014 2106 Y CA -1.469 56.585 58.100 -0.077 0.000 1.063 2106 Y CB 1.032 39.467 38.460 -0.041 0.000 1.272 2106 Y HN 0.525 nan 8.280 nan 0.000 0.477 2107 C N 4.123 123.391 119.300 -0.053 0.000 2.386 2107 C HA 0.488 4.949 4.460 0.002 0.000 0.318 2107 C C -2.653 172.243 174.990 -0.156 0.000 1.128 2107 C CA -1.386 57.531 59.018 -0.168 0.000 1.438 2107 C CB 0.339 28.006 27.740 -0.122 0.000 1.987 2107 C HN 0.564 nan 8.230 nan 0.000 0.426 2108 P HA 0.288 nan 4.420 nan 0.000 0.285 2108 P C 0.607 177.705 177.300 -0.336 0.000 1.259 2108 P CA 0.144 63.112 63.100 -0.221 0.000 0.794 2108 P CB 1.188 32.672 31.700 -0.360 0.000 0.940 2109 T N -1.487 112.878 114.554 -0.315 0.000 3.040 2109 T HA 0.230 4.581 4.350 0.002 0.000 0.250 2109 T C 0.294 174.871 174.700 -0.205 0.000 1.058 2109 T CA 0.142 61.890 62.100 -0.586 0.000 0.988 2109 T CB 0.009 68.575 68.868 -0.503 0.000 0.993 2109 T HN 0.380 nan 8.240 nan 0.000 0.519 2110 E N 2.131 122.319 120.200 -0.019 0.000 2.292 2110 E HA 0.409 4.760 4.350 0.002 0.000 0.272 2110 E C -2.897 173.773 176.600 0.117 0.000 0.881 2110 E CA -2.678 53.755 56.400 0.054 0.000 0.754 2110 E CB 2.735 32.463 29.700 0.047 0.000 1.201 2110 E HN 0.139 nan 8.360 nan 0.000 0.425 2111 P HA 0.316 nan 4.420 nan 0.000 0.274 2111 P C 0.180 177.538 177.300 0.097 0.000 1.246 2111 P CA 0.198 63.336 63.100 0.064 0.000 0.795 2111 P CB 1.056 32.746 31.700 -0.015 0.000 1.006 2112 G N 0.613 109.493 108.800 0.134 0.000 2.280 2112 G HA2 -0.095 3.866 3.960 0.002 0.000 0.277 2112 G HA3 -0.095 3.866 3.960 0.002 0.000 0.277 2112 G C -1.393 173.591 174.900 0.140 0.000 1.288 2112 G CA -0.725 44.412 45.100 0.061 0.000 1.075 2112 G HN 0.569 nan 8.290 nan 0.000 0.480 2113 N N 0.732 119.437 118.700 0.008 0.000 2.414 2113 N HA 0.596 5.337 4.740 0.002 0.000 0.256 2113 N C -1.149 174.335 175.510 -0.042 0.000 1.029 2113 N CA 0.108 53.189 53.050 0.051 0.000 0.948 2113 N CB 0.975 39.471 38.487 0.015 0.000 1.102 2113 N HN 0.401 nan 8.380 nan 0.000 0.496 2114 Y N 0.918 121.231 120.300 0.022 0.000 2.567 2114 Y HA 0.603 5.154 4.550 0.001 0.000 0.333 2114 Y C 0.714 176.623 175.900 0.014 0.000 1.106 2114 Y CA -1.159 56.949 58.100 0.013 0.000 1.157 2114 Y CB 1.420 39.889 38.460 0.016 0.000 1.277 2114 Y HN 0.334 nan 8.280 nan 0.000 0.490 2115 I N -0.119 120.552 120.570 0.169 0.000 2.582 2115 I HA 0.636 4.807 4.170 0.002 0.000 0.292 2115 I C -1.460 174.709 176.117 0.086 0.000 1.066 2115 I CA -0.945 60.422 61.300 0.111 0.000 1.053 2115 I CB 2.164 40.205 38.000 0.068 0.000 1.241 2115 I HN 0.386 nan 8.210 nan 0.000 0.421 2116 I N 5.170 125.787 120.570 0.078 0.000 2.330 2116 I HA 0.296 4.467 4.170 0.002 0.000 0.289 2116 I C -0.317 175.890 176.117 0.150 0.000 1.001 2116 I CA -0.346 60.979 61.300 0.041 0.000 1.193 2116 I CB 0.876 38.805 38.000 -0.118 0.000 1.345 2116 I HN 0.538 nan 8.210 nan 0.000 0.461 2117 N N 8.238 127.011 118.700 0.122 0.000 2.422 2117 N HA 0.437 5.179 4.740 0.002 0.000 0.264 2117 N C -0.658 174.899 175.510 0.078 0.000 1.063 2117 N CA -0.047 53.084 53.050 0.136 0.000 0.959 2117 N CB 1.819 40.359 38.487 0.090 0.000 1.087 2117 N HN 0.461 nan 8.380 nan 0.000 0.483 2118 I N 2.412 123.043 120.570 0.102 0.000 2.439 2118 I HA 0.254 4.425 4.170 0.002 0.000 0.283 2118 I C -0.179 175.940 176.117 0.003 0.000 1.023 2118 I CA -0.519 60.839 61.300 0.096 0.000 1.100 2118 I CB 1.215 39.341 38.000 0.210 0.000 1.238 2118 I HN 0.111 nan 8.210 nan 0.000 0.445 2119 K N 5.727 126.099 120.400 -0.046 0.000 2.259 2119 K HA 0.586 4.907 4.320 0.002 0.000 0.252 2119 K C -1.319 175.352 176.600 0.118 0.000 0.936 2119 K CA -0.738 55.522 56.287 -0.046 0.000 0.810 2119 K CB 2.684 35.082 32.500 -0.171 0.000 1.143 2119 K HN 0.292 nan 8.250 nan 0.000 0.427 2120 F N 1.298 121.243 119.950 -0.009 0.000 2.493 2120 F HA 0.413 4.941 4.527 0.000 0.000 0.329 2120 F C 0.048 175.858 175.800 0.015 0.000 1.126 2120 F CA -0.381 57.627 58.000 0.014 0.000 0.937 2120 F CB 1.521 40.539 39.000 0.030 0.000 1.146 2120 F HN 0.809 nan 8.300 nan 0.000 0.442 2121 A N 4.345 126.865 122.820 -0.500 0.000 2.745 2121 A HA -0.240 4.081 4.320 0.002 0.000 0.296 2121 A C 0.869 178.389 177.584 -0.107 0.000 1.500 2121 A CA 1.331 53.187 52.037 -0.302 0.000 0.766 2121 A CB -2.413 16.431 19.000 -0.261 0.000 1.030 2121 A HN 1.237 nan 8.150 nan 0.000 0.489 2122 D N -2.926 117.423 120.400 -0.086 0.000 2.945 2122 D HA -0.191 4.450 4.640 0.002 0.000 0.225 2122 D C -0.136 176.161 176.300 -0.004 0.000 1.158 2122 D CA 2.360 56.334 54.000 -0.044 0.000 0.805 2122 D CB -0.659 40.120 40.800 -0.035 0.000 1.098 2122 D HN 1.328 nan 8.370 nan 0.000 0.426 2123 Q N -0.080 119.733 119.800 0.022 0.000 2.292 2123 Q HA 0.413 4.754 4.340 0.002 0.000 0.270 2123 Q C -1.205 174.852 176.000 0.095 0.000 1.024 2123 Q CA -0.690 55.161 55.803 0.080 0.000 0.768 2123 Q CB 0.851 29.649 28.738 0.100 0.000 1.250 2123 Q HN 0.294 nan 8.270 nan 0.000 0.447 2124 H N 1.085 120.188 119.070 0.055 0.000 3.094 2124 H HA 0.181 4.737 4.556 -0.000 0.000 0.320 2124 H C 0.314 175.678 175.328 0.060 0.000 1.000 2124 H CA 0.963 57.040 56.048 0.049 0.000 1.413 2124 H CB 0.450 30.214 29.762 0.003 0.000 1.405 2124 H HN 0.544 nan 8.280 nan 0.000 0.586 2125 V N 2.699 122.722 119.914 0.181 0.000 3.133 2125 V HA 0.309 4.430 4.120 0.002 0.000 0.305 2125 V C -2.243 173.908 176.094 0.095 0.000 1.084 2125 V CA -2.317 60.069 62.300 0.143 0.000 1.089 2125 V CB 0.715 32.633 31.823 0.157 0.000 1.073 2125 V HN 0.600 nan 8.190 nan 0.000 0.477 2126 P HA 0.236 nan 4.420 nan 0.000 0.261 2126 P C 0.985 178.264 177.300 -0.036 0.000 1.173 2126 P CA 1.958 65.066 63.100 0.013 0.000 0.760 2126 P CB 0.442 32.162 31.700 0.034 0.000 0.783 2127 G N 1.725 110.392 108.800 -0.221 0.000 2.253 2127 G HA2 -0.256 3.706 3.960 0.002 0.000 0.251 2127 G HA3 -0.256 3.706 3.960 0.002 0.000 0.251 2127 G C 0.481 174.598 174.900 -1.303 0.000 0.998 2127 G CA 0.266 44.994 45.100 -0.621 0.000 0.621 2127 G HN 0.788 nan 8.290 nan 0.000 0.524 2128 S N 2.604 117.873 115.700 -0.718 0.000 2.537 2128 S HA 0.667 5.139 4.470 0.002 0.000 0.275 2128 S C -1.989 172.458 174.600 -0.255 0.000 1.272 2128 S CA -0.690 57.226 58.200 -0.473 0.000 1.050 2128 S CB 1.531 64.809 63.200 0.131 0.000 0.961 2128 S HN 0.348 nan 8.310 nan 0.000 0.496 2129 P HA 0.346 nan 4.420 nan 0.000 0.282 2129 P C -1.156 175.981 177.300 -0.272 0.000 1.249 2129 P CA -0.517 62.519 63.100 -0.106 0.000 0.806 2129 P CB 0.342 32.048 31.700 0.010 0.000 0.984 2130 F N 0.032 119.963 119.950 -0.031 0.000 2.410 2130 F HA 0.223 4.753 4.527 0.005 0.000 0.348 2130 F C 1.278 177.068 175.800 -0.017 0.000 1.106 2130 F CA 0.012 57.984 58.000 -0.046 0.000 1.163 2130 F CB 0.739 39.671 39.000 -0.114 0.000 1.129 2130 F HN 0.131 nan 8.300 nan 0.000 0.516 2131 S N 2.420 118.216 115.700 0.160 0.000 2.499 2131 S HA 0.503 4.974 4.470 0.002 0.000 0.275 2131 S C -0.374 174.324 174.600 0.165 0.000 1.257 2131 S CA -0.623 57.655 58.200 0.130 0.000 1.050 2131 S CB 0.885 64.139 63.200 0.090 0.000 0.937 2131 S HN 0.336 nan 8.310 nan 0.000 0.490 2132 V N 5.007 125.022 119.914 0.167 0.000 2.487 2132 V HA 0.367 4.488 4.120 0.002 0.000 0.298 2132 V C -0.153 176.051 176.094 0.183 0.000 1.028 2132 V CA -0.839 61.560 62.300 0.164 0.000 0.860 2132 V CB 1.820 33.734 31.823 0.152 0.000 0.991 2132 V HN 0.704 nan 8.190 nan 0.000 0.427 2133 K N 3.599 124.079 120.400 0.134 0.000 2.253 2133 K HA 0.598 4.919 4.320 0.002 0.000 0.277 2133 K C -1.009 175.648 176.600 0.096 0.000 1.053 2133 K CA -0.423 55.938 56.287 0.124 0.000 0.892 2133 K CB 1.845 34.401 32.500 0.094 0.000 1.102 2133 K HN 0.447 nan 8.250 nan 0.000 0.469 2134 V N 3.336 123.329 119.914 0.132 0.000 2.398 2134 V HA 0.174 4.295 4.120 0.002 0.000 0.286 2134 V C 0.543 176.646 176.094 0.015 0.000 1.026 2134 V CA -0.766 61.563 62.300 0.048 0.000 0.868 2134 V CB 1.383 33.207 31.823 0.001 0.000 0.982 2134 V HN 0.881 nan 8.190 nan 0.000 0.443 2135 T N 1.654 116.186 114.554 -0.037 0.000 2.881 2135 T HA 0.902 5.253 4.350 0.002 0.000 0.278 2135 T C 0.240 174.711 174.700 -0.381 0.000 0.982 2135 T CA 0.121 62.169 62.100 -0.087 0.000 0.989 2135 T CB 1.793 70.698 68.868 0.063 0.000 1.058 2135 T HN 1.603 nan 8.240 nan 0.000 0.529 2136 G N 0.191 108.806 108.800 -0.308 0.000 2.369 2136 G HA2 0.221 4.182 3.960 0.002 0.000 0.295 2136 G HA3 0.221 4.182 3.960 0.002 0.000 0.295 2136 G C -1.608 173.243 174.900 -0.082 0.000 1.298 2136 G CA -1.109 43.780 45.100 -0.351 0.000 0.940 2136 G HN 0.856 nan 8.290 nan 0.000 0.536 2137 E N 0.181 120.376 120.200 -0.010 0.000 2.324 2137 E HA 0.440 4.791 4.350 0.002 0.000 0.271 2137 E C 1.122 177.739 176.600 0.029 0.000 1.028 2137 E CA 0.212 56.628 56.400 0.026 0.000 0.890 2137 E CB 1.045 30.771 29.700 0.043 0.000 1.004 2137 E HN 0.887 nan 8.360 nan 0.000 0.431 2138 G N 2.042 110.848 108.800 0.009 0.000 2.562 2138 G HA2 -0.182 3.779 3.960 0.002 0.000 0.233 2138 G HA3 -0.182 3.779 3.960 0.002 0.000 0.233 2138 G C 0.882 175.794 174.900 0.020 0.000 1.266 2138 G CA -0.203 44.890 45.100 -0.010 0.000 0.852 2138 G HN 0.742 nan 8.290 nan 0.000 0.581 2139 R N -0.438 120.071 120.500 0.016 0.000 2.189 2139 R HA 0.069 4.411 4.340 0.002 0.000 0.218 2139 R C 0.091 176.417 176.300 0.043 0.000 1.074 2139 R CA 0.588 56.716 56.100 0.047 0.000 0.991 2139 R CB -0.074 30.255 30.300 0.050 0.000 0.883 2139 R HN 0.220 nan 8.270 nan 0.000 0.457 2140 V N 1.102 121.038 119.914 0.037 0.000 2.531 2140 V HA 0.328 4.449 4.120 0.002 0.000 0.301 2140 V C -0.833 175.295 176.094 0.056 0.000 1.034 2140 V CA -0.948 61.382 62.300 0.051 0.000 0.865 2140 V CB 1.844 33.708 31.823 0.069 0.000 0.995 2140 V HN 0.148 nan 8.190 nan 0.000 0.424 2141 K N 3.478 123.907 120.400 0.048 0.000 2.450 2141 K HA 0.498 4.820 4.320 0.002 0.000 0.257 2141 K C -0.900 175.725 176.600 0.043 0.000 0.953 2141 K CA -0.508 55.807 56.287 0.047 0.000 0.844 2141 K CB 1.239 33.761 32.500 0.038 0.000 1.103 2141 K HN 0.679 nan 8.250 nan 0.000 0.429 2142 E N 2.307 122.535 120.200 0.046 0.000 2.165 2142 E HA 0.230 4.581 4.350 0.002 0.000 0.266 2142 E C -1.089 175.532 176.600 0.036 0.000 0.889 2142 E CA -0.500 55.924 56.400 0.040 0.000 0.756 2142 E CB 1.966 31.693 29.700 0.045 0.000 1.131 2142 E HN 0.723 nan 8.360 nan 0.000 0.411 2143 S N 2.337 118.054 115.700 0.029 0.000 2.569 2143 S HA 0.734 5.205 4.470 0.002 0.000 0.280 2143 S C -0.525 174.081 174.600 0.009 0.000 1.111 2143 S CA -0.897 57.319 58.200 0.027 0.000 0.887 2143 S CB 1.747 64.957 63.200 0.018 0.000 1.095 2143 S HN 0.478 nan 8.310 nan 0.000 0.476 2144 I N 1.887 122.459 120.570 0.004 0.000 2.498 2144 I HA 0.677 4.848 4.170 0.002 0.000 0.290 2144 I C -0.905 175.152 176.117 -0.101 0.000 1.032 2144 I CA -0.003 61.263 61.300 -0.058 0.000 1.073 2144 I CB 2.196 40.162 38.000 -0.056 0.000 1.251 2144 I HN 0.976 nan 8.210 nan 0.000 0.426 2145 T N 5.529 119.994 114.554 -0.149 0.000 2.881 2145 T HA 0.557 4.908 4.350 0.002 0.000 0.291 2145 T C -0.891 173.683 174.700 -0.211 0.000 0.990 2145 T CA -0.706 61.308 62.100 -0.144 0.000 0.976 2145 T CB 0.998 69.822 68.868 -0.074 0.000 0.970 2145 T HN 0.638 nan 8.240 nan 0.000 0.438 2146 R N 3.244 123.596 120.500 -0.247 0.000 2.294 2146 R HA 0.675 5.016 4.340 0.002 0.000 0.319 2146 R C -0.570 175.672 176.300 -0.097 0.000 0.984 2146 R CA -0.495 55.448 56.100 -0.261 0.000 0.861 2146 R CB 0.638 30.693 30.300 -0.410 0.000 1.104 2146 R HN 0.708 nan 8.270 nan 0.000 0.451 2147 R N 2.842 123.294 120.500 -0.081 0.000 2.621 2147 R HA 0.440 4.782 4.340 0.002 0.000 0.292 2147 R C -0.912 175.372 176.300 -0.027 0.000 0.969 2147 R CA -1.052 55.017 56.100 -0.052 0.000 0.887 2147 R CB 2.140 32.401 30.300 -0.065 0.000 1.180 2147 R HN 0.514 nan 8.270 nan 0.000 0.450 2148 R N 2.634 123.127 120.500 -0.012 0.000 2.393 2148 R HA 0.384 4.725 4.340 0.002 0.000 0.315 2148 R C -0.918 175.364 176.300 -0.030 0.000 0.952 2148 R CA -0.568 55.528 56.100 -0.006 0.000 0.842 2148 R CB 1.056 31.372 30.300 0.026 0.000 1.163 2148 R HN 0.499 nan 8.270 nan 0.000 0.450 2149 R N 2.417 122.896 120.500 -0.035 0.000 2.514 2149 R HA 0.587 4.929 4.340 0.002 0.000 0.301 2149 R C -1.181 175.093 176.300 -0.042 0.000 0.962 2149 R CA -0.635 55.438 56.100 -0.044 0.000 0.882 2149 R CB 2.292 32.567 30.300 -0.041 0.000 1.143 2149 R HN 0.638 nan 8.270 nan 0.000 0.452 2150 A N 4.158 126.947 122.820 -0.052 0.000 2.646 2150 A HA 0.347 4.669 4.320 0.002 0.000 0.312 2150 A C -2.013 175.549 177.584 -0.037 0.000 1.245 2150 A CA -1.267 50.743 52.037 -0.045 0.000 0.755 2150 A CB 0.754 19.721 19.000 -0.056 0.000 1.132 2150 A HN 0.576 nan 8.150 nan 0.000 0.458 2151 P HA -0.019 nan 4.420 nan 0.000 0.229 2151 P C 0.550 177.842 177.300 -0.013 0.000 1.160 2151 P CA 1.130 64.217 63.100 -0.022 0.000 0.777 2151 P CB 0.285 31.973 31.700 -0.019 0.000 0.814 2152 S N -1.270 114.424 115.700 -0.009 0.000 2.740 2152 S HA 0.619 5.090 4.470 0.002 0.000 0.300 2152 S C -0.786 173.817 174.600 0.006 0.000 1.147 2152 S CA -0.782 57.418 58.200 -0.000 0.000 0.871 2152 S CB 2.008 65.209 63.200 0.002 0.000 1.173 2152 S HN -0.196 nan 8.310 nan 0.000 0.510 2153 V N 0.916 120.837 119.914 0.012 0.000 2.462 2153 V HA 0.762 4.884 4.120 0.002 0.000 0.288 2153 V C -0.017 176.085 176.094 0.013 0.000 1.020 2153 V CA -0.437 61.873 62.300 0.018 0.000 0.857 2153 V CB 0.617 32.455 31.823 0.024 0.000 1.013 2153 V HN 1.218 nan 8.190 nan 0.000 0.431 2154 A N 3.430 126.260 122.820 0.017 0.000 2.324 2154 A HA 0.654 4.975 4.320 0.002 0.000 0.330 2154 A C 0.533 178.116 177.584 -0.001 0.000 1.165 2154 A CA -0.722 51.322 52.037 0.012 0.000 0.813 2154 A CB 0.589 19.603 19.000 0.023 0.000 1.197 2154 A HN 0.733 nan 8.150 nan 0.000 0.484 2155 N N 1.144 119.837 118.700 -0.012 0.000 2.509 2155 N HA 0.167 4.908 4.740 0.002 0.000 0.239 2155 N C -0.026 175.465 175.510 -0.033 0.000 1.215 2155 N CA 0.649 53.680 53.050 -0.031 0.000 0.882 2155 N CB -0.191 38.279 38.487 -0.029 0.000 1.189 2155 N HN 0.681 nan 8.380 nan 0.000 0.490 2156 V N -4.493 115.409 119.914 -0.020 0.000 3.182 2156 V HA 1.024 5.145 4.120 0.002 0.000 0.308 2156 V C 0.212 176.295 176.094 -0.018 0.000 1.240 2156 V CA -0.488 61.797 62.300 -0.026 0.000 1.063 2156 V CB 1.786 33.597 31.823 -0.019 0.000 1.076 2156 V HN 0.318 nan 8.190 nan 0.000 0.446 2160 C N 3.687 123.080 119.300 0.154 0.000 2.379 2160 C HA 0.228 4.689 4.460 0.002 0.000 0.476 2160 C C 0.508 175.540 174.990 0.070 0.000 1.068 2160 C CA -0.679 58.388 59.018 0.081 0.000 1.406 2160 C CB -1.697 26.078 27.740 0.059 0.000 1.496 2160 C HN 0.451 nan 8.230 nan 0.000 0.551 2201 R N 4.855 125.366 120.500 0.020 0.000 2.360 2201 R HA 0.693 5.034 4.340 0.002 0.000 0.318 2201 R C -1.819 174.553 176.300 0.121 0.000 0.950 2201 R CA -0.735 55.389 56.100 0.039 0.000 0.837 2201 R CB 2.267 32.581 30.300 0.023 0.000 1.165 2201 R HN 0.553 nan 8.270 nan 0.000 0.458 2202 F N 3.306 123.207 119.950 -0.082 0.000 2.630 2202 F HA 0.229 4.758 4.527 0.002 0.000 0.325 2202 F C -0.715 175.053 175.800 -0.054 0.000 1.184 2202 F CA -0.962 56.993 58.000 -0.075 0.000 1.011 2202 F CB 1.385 40.322 39.000 -0.106 0.000 1.268 2202 F HN 0.189 nan 8.300 nan 0.000 0.480 2203 V N 4.798 124.253 119.914 -0.764 0.000 2.432 2203 V HA 0.616 4.737 4.120 0.002 0.000 0.271 2203 V C -2.375 173.227 176.094 -0.820 0.000 1.046 2203 V CA -1.417 60.535 62.300 -0.579 0.000 0.945 2203 V CB 0.368 31.993 31.823 -0.330 0.000 0.992 2203 V HN 0.607 nan 8.190 nan 0.000 0.471 2204 P HA 0.558 nan 4.420 nan 0.000 0.286 2204 P C 0.038 177.283 177.300 -0.091 0.000 1.261 2204 P CA -0.529 62.464 63.100 -0.179 0.000 0.821 2204 P CB 2.236 33.937 31.700 0.000 0.000 1.013 2205 A N 1.903 124.713 122.820 -0.018 0.000 2.390 2205 A HA 0.180 4.501 4.320 0.002 0.000 0.225 2205 A C 0.533 178.160 177.584 0.071 0.000 1.232 2205 A CA 0.135 52.182 52.037 0.018 0.000 0.964 2205 A CB 0.074 19.079 19.000 0.008 0.000 1.064 2205 A HN 0.585 nan 8.150 nan 0.000 0.525 2206 E N 0.901 121.185 120.200 0.141 0.000 2.158 2206 E HA 0.395 4.746 4.350 0.002 0.000 0.271 2206 E C -0.809 175.911 176.600 0.201 0.000 0.911 2206 E CA -0.672 55.831 56.400 0.171 0.000 0.767 2206 E CB 1.320 31.149 29.700 0.216 0.000 1.120 2206 E HN 0.262 nan 8.360 nan 0.000 0.405 2207 M N 2.556 122.224 119.600 0.114 0.000 2.227 2207 M HA 0.302 4.783 4.480 0.002 0.000 0.349 2207 M C 0.573 176.913 176.300 0.067 0.000 1.443 2207 M CA 0.592 55.943 55.300 0.085 0.000 1.110 2207 M CB 0.046 32.669 32.600 0.038 0.000 1.773 2207 M HN 0.889 nan 8.290 nan 0.000 0.463 2208 G N 2.838 111.682 108.800 0.073 0.000 2.356 2208 G HA2 0.051 4.013 3.960 0.002 0.000 0.266 2208 G HA3 0.051 4.013 3.960 0.002 0.000 0.266 2208 G C -1.437 173.436 174.900 -0.045 0.000 1.312 2208 G CA -0.801 44.283 45.100 -0.026 0.000 0.922 2208 G HN 0.516 nan 8.290 nan 0.000 0.480 2209 T N 0.622 115.067 114.554 -0.183 0.000 2.856 2209 T HA 0.778 5.129 4.350 0.002 0.000 0.283 2209 T C -0.833 173.716 174.700 -0.251 0.000 1.008 2209 T CA -0.166 61.887 62.100 -0.078 0.000 0.997 2209 T CB 1.311 70.176 68.868 -0.005 0.000 0.992 2209 T HN 0.617 nan 8.240 nan 0.000 0.454 2210 H N -0.178 118.974 119.070 0.137 0.000 2.907 2210 H HA 0.712 5.269 4.556 0.002 0.000 0.361 2210 H C -0.114 175.315 175.328 0.169 0.000 1.194 2210 H CA -0.662 55.487 56.048 0.167 0.000 1.152 2210 H CB 1.470 31.384 29.762 0.254 0.000 1.867 2210 H HN 0.562 nan 8.280 nan 0.000 0.561 2211 T N -0.124 114.579 114.554 0.249 0.000 2.926 2211 T HA 0.731 5.083 4.350 0.002 0.000 0.289 2211 T C -0.490 174.265 174.700 0.091 0.000 1.054 2211 T CA -0.781 61.413 62.100 0.157 0.000 1.015 2211 T CB 1.589 70.515 68.868 0.098 0.000 1.167 2211 T HN 0.317 nan 8.240 nan 0.000 0.526 2229 T N 5.331 119.569 114.554 -0.527 0.000 2.971 2229 T HA 0.706 5.057 4.350 0.002 0.000 0.304 2229 T C -1.288 173.182 174.700 -0.384 0.000 1.038 2229 T CA -0.744 61.215 62.100 -0.236 0.000 1.007 2229 T CB 1.776 70.590 68.868 -0.090 0.000 1.055 2229 T HN 0.637 nan 8.240 nan 0.000 0.451 2230 V N -0.038 119.787 119.914 -0.147 0.000 2.735 2230 V HA 1.079 5.200 4.120 0.002 0.000 0.310 2230 V C 0.467 176.542 176.094 -0.031 0.000 1.061 2230 V CA -0.266 61.969 62.300 -0.107 0.000 0.913 2230 V CB 0.908 32.696 31.823 -0.058 0.000 1.005 2230 V HN 1.446 nan 8.190 nan 0.000 0.428 2231 G N 3.164 111.939 108.800 -0.041 0.000 2.298 2231 G HA2 0.206 4.167 3.960 0.002 0.000 0.309 2231 G HA3 0.206 4.167 3.960 0.002 0.000 0.309 2231 G C -2.924 171.957 174.900 -0.032 0.000 1.279 2231 G CA -0.182 44.904 45.100 -0.023 0.000 1.042 2231 G HN 0.906 nan 8.290 nan 0.000 0.480 2237 G N -0.472 108.561 108.800 0.389 0.000 2.296 2237 G HA2 0.195 4.157 3.960 0.002 0.000 0.188 2237 G HA3 0.195 4.157 3.960 0.002 0.000 0.188 2237 G C 1.585 176.768 174.900 0.470 0.000 1.000 2237 G CA 1.402 46.809 45.100 0.512 0.000 0.672 2237 G HN 2.077 nan 8.290 nan 0.000 0.483 2238 A N 1.273 124.421 122.820 0.547 0.000 1.917 2238 A HA -0.135 4.186 4.320 0.002 0.000 0.219 2238 A C 2.070 179.793 177.584 0.232 0.000 1.182 2238 A CA 2.591 54.866 52.037 0.397 0.000 0.633 2238 A CB -0.998 18.203 19.000 0.336 0.000 0.819 2238 A HN 1.383 nan 8.150 nan 0.000 0.448 2239 H N 0.577 119.715 119.070 0.113 0.000 2.457 2239 H HA -0.111 4.446 4.556 0.002 0.000 0.297 2239 H C 1.395 176.751 175.328 0.048 0.000 1.092 2239 H CA 1.670 57.763 56.048 0.074 0.000 1.309 2239 H CB -0.350 29.450 29.762 0.064 0.000 1.382 2239 H HN 0.648 nan 8.280 nan 0.000 0.535 2240 K N 1.248 121.346 120.400 -0.504 0.000 2.387 2240 K HA 0.203 4.524 4.320 0.002 0.000 0.198 2240 K C -0.364 176.110 176.600 -0.210 0.000 1.022 2240 K CA -0.110 55.904 56.287 -0.455 0.000 1.128 2240 K CB 0.376 32.591 32.500 -0.475 0.000 0.853 2240 K HN 0.043 nan 8.250 nan 0.000 0.523 2241 V N 3.082 122.910 119.914 -0.143 0.000 2.465 2241 V HA 0.293 4.414 4.120 0.002 0.000 0.279 2241 V C 0.062 176.194 176.094 0.064 0.000 1.045 2241 V CA -0.742 61.502 62.300 -0.093 0.000 0.938 2241 V CB 1.156 32.890 31.823 -0.149 0.000 0.986 2241 V HN 0.270 nan 8.190 nan 0.000 0.467 2242 R N 3.057 123.659 120.500 0.169 0.000 2.732 2242 R HA 0.911 5.252 4.340 0.002 0.000 0.278 2242 R C -0.577 176.023 176.300 0.500 0.000 0.976 2242 R CA -0.612 55.660 56.100 0.288 0.000 0.963 2242 R CB 2.127 32.541 30.300 0.190 0.000 1.150 2242 R HN 0.789 nan 8.270 nan 0.000 0.478 2243 A N 0.097 123.193 122.820 0.461 0.000 2.547 2243 A HA 0.805 5.126 4.320 0.002 0.000 0.297 2243 A C -0.959 176.831 177.584 0.342 0.000 1.056 2243 A CA -0.364 51.910 52.037 0.395 0.000 0.688 2243 A CB 2.429 21.593 19.000 0.273 0.000 1.282 2243 A HN 0.761 nan 8.150 nan 0.000 0.400 2244 G N -0.549 108.432 108.800 0.301 0.000 2.733 2244 G HA2 0.876 4.837 3.960 0.002 0.000 0.297 2244 G HA3 0.876 4.837 3.960 0.002 0.000 0.297 2244 G C -0.375 174.622 174.900 0.163 0.000 1.452 2244 G CA 0.329 45.561 45.100 0.219 0.000 0.940 2244 G HN 2.486 nan 8.290 nan 0.000 0.547 2245 G N 0.959 109.809 108.800 0.083 0.000 2.321 2245 G HA2 0.446 4.407 3.960 0.002 0.000 0.339 2245 G HA3 0.446 4.407 3.960 0.002 0.000 0.339 2245 G C -2.376 172.532 174.900 0.014 0.000 1.518 2245 G CA 0.042 45.186 45.100 0.073 0.000 0.994 2245 G HN 0.503 nan 8.290 nan 0.000 0.668 2246 P HA 0.042 nan 4.420 nan 0.000 0.220 2246 P C 1.942 179.225 177.300 -0.028 0.000 1.148 2246 P CA 1.590 64.681 63.100 -0.015 0.000 0.803 2246 P CB 0.149 31.836 31.700 -0.022 0.000 0.782 2247 G N -0.760 108.034 108.800 -0.010 0.000 2.708 2247 G HA2 -0.129 3.832 3.960 0.002 0.000 0.210 2247 G HA3 -0.129 3.832 3.960 0.002 0.000 0.210 2247 G C 1.143 176.045 174.900 0.004 0.000 1.141 2247 G CA 0.207 45.311 45.100 0.006 0.000 0.788 2247 G HN 0.271 nan 8.290 nan 0.000 0.531 2248 L N -0.368 120.736 121.223 -0.197 0.000 2.616 2248 L HA 0.211 4.552 4.340 0.002 0.000 0.229 2248 L C 2.312 179.083 176.870 -0.165 0.000 1.110 2248 L CA 0.858 55.431 54.840 -0.445 0.000 0.884 2248 L CB 0.413 41.933 42.059 -0.899 0.000 1.115 2248 L HN 0.427 nan 8.230 nan 0.000 0.481 2249 E N 0.433 120.606 120.200 -0.044 0.000 2.474 2249 E HA 0.103 4.454 4.350 0.002 0.000 0.215 2249 E C 0.689 177.320 176.600 0.052 0.000 0.867 2249 E CA -0.455 55.964 56.400 0.031 0.000 1.135 2249 E CB 0.633 30.353 29.700 0.033 0.000 1.147 2249 E HN 0.218 nan 8.360 nan 0.000 0.534 2250 R N -0.037 120.489 120.500 0.044 0.000 2.728 2250 R HA 0.792 5.133 4.340 0.002 0.000 0.274 2250 R C -1.856 174.467 176.300 0.039 0.000 1.032 2250 R CA -0.465 55.667 56.100 0.054 0.000 0.866 2250 R CB 0.835 31.157 30.300 0.037 0.000 1.263 2250 R HN 0.181 nan 8.270 nan 0.000 0.475 2251 A N 0.911 123.754 122.820 0.039 0.000 2.610 2251 A HA 0.575 4.897 4.320 0.002 0.000 0.291 2251 A C -1.703 175.880 177.584 -0.001 0.000 1.086 2251 A CA -0.705 51.331 52.037 -0.002 0.000 0.677 2251 A CB 2.159 21.180 19.000 0.034 0.000 1.278 2251 A HN 0.804 nan 8.150 nan 0.000 0.414 2252 E N 0.629 120.813 120.200 -0.027 0.000 2.199 2252 E HA 0.631 4.982 4.350 0.002 0.000 0.269 2252 E C -0.017 176.571 176.600 -0.020 0.000 0.899 2252 E CA -0.667 55.724 56.400 -0.014 0.000 0.772 2252 E CB 1.765 31.454 29.700 -0.018 0.000 1.155 2252 E HN 1.206 nan 8.360 nan 0.000 0.408 2253 A N 2.841 125.660 122.820 -0.001 0.000 2.567 2253 A HA 0.380 4.701 4.320 0.002 0.000 0.240 2253 A C 1.245 178.827 177.584 -0.003 0.000 1.053 2253 A CA 0.931 52.970 52.037 0.002 0.000 0.755 2253 A CB -0.643 18.374 19.000 0.029 0.000 0.978 2253 A HN 1.148 nan 8.150 nan 0.000 0.507 2254 G N 0.914 109.711 108.800 -0.006 0.000 2.184 2254 G HA2 -0.169 3.792 3.960 0.002 0.000 0.264 2254 G HA3 -0.169 3.792 3.960 0.002 0.000 0.264 2254 G C 0.168 175.055 174.900 -0.021 0.000 0.975 2254 G CA 0.356 45.452 45.100 -0.006 0.000 0.642 2254 G HN 1.575 nan 8.290 nan 0.000 0.536 2255 V N 1.768 121.659 119.914 -0.038 0.000 2.448 2255 V HA 0.493 4.614 4.120 0.002 0.000 0.295 2255 V C -1.821 174.213 176.094 -0.099 0.000 1.025 2255 V CA -1.824 60.442 62.300 -0.056 0.000 0.859 2255 V CB 1.869 33.663 31.823 -0.049 0.000 0.988 2255 V HN 0.069 nan 8.190 nan 0.000 0.431 2256 P HA 0.191 nan 4.420 nan 0.000 0.264 2256 P C -0.691 176.465 177.300 -0.240 0.000 1.183 2256 P CA 0.368 63.372 63.100 -0.160 0.000 0.763 2256 P CB 0.495 32.125 31.700 -0.116 0.000 0.807 2257 A N 2.984 125.547 122.820 -0.429 0.000 2.335 2257 A HA 0.429 4.751 4.320 0.002 0.000 0.304 2257 A C -0.348 176.989 177.584 -0.411 0.000 1.118 2257 A CA -0.585 51.163 52.037 -0.481 0.000 0.757 2257 A CB 0.931 19.482 19.000 -0.748 0.000 1.188 2257 A HN 0.501 nan 8.150 nan 0.000 0.460 2258 E N 1.070 121.158 120.200 -0.186 0.000 2.227 2258 E HA 0.765 5.116 4.350 0.002 0.000 0.268 2258 E C -0.941 175.697 176.600 0.063 0.000 0.990 2258 E CA -0.474 55.850 56.400 -0.126 0.000 0.856 2258 E CB 1.968 31.585 29.700 -0.137 0.000 1.159 2258 E HN 0.682 nan 8.360 nan 0.000 0.401 2259 F N -2.172 117.691 119.950 -0.145 0.000 2.817 2259 F HA 0.656 5.185 4.527 0.002 0.000 0.317 2259 F C -1.129 174.538 175.800 -0.221 0.000 1.168 2259 F CA -0.972 56.936 58.000 -0.153 0.000 0.911 2259 F CB 1.261 40.177 39.000 -0.141 0.000 1.337 2259 F HN 0.216 nan 8.300 nan 0.000 0.464 2260 S N 0.794 116.404 115.700 -0.149 0.000 2.599 2260 S HA 0.847 5.319 4.470 0.002 0.000 0.294 2260 S C -1.139 173.150 174.600 -0.519 0.000 1.094 2260 S CA -0.724 57.148 58.200 -0.546 0.000 0.931 2260 S CB 1.940 64.645 63.200 -0.825 0.000 1.093 2260 S HN 0.576 nan 8.310 nan 0.000 0.488 2261 I N 1.496 121.680 120.570 -0.643 0.000 2.533 2261 I HA 0.402 4.573 4.170 0.002 0.000 0.290 2261 I C -1.249 174.619 176.117 -0.415 0.000 1.056 2261 I CA -0.416 60.698 61.300 -0.309 0.000 1.057 2261 I CB 1.630 39.620 38.000 -0.017 0.000 1.240 2261 I HN 0.472 nan 8.210 nan 0.000 0.423 2262 W N 4.958 126.261 121.300 0.005 0.000 2.318 2262 W HA 0.280 4.941 4.660 0.002 0.000 0.315 2262 W C 0.721 177.191 176.519 -0.081 0.000 1.033 2262 W CA -0.678 56.649 57.345 -0.029 0.000 1.275 2262 W CB 1.824 31.267 29.460 -0.029 0.000 1.250 2262 W HN 0.615 nan 8.180 nan 0.000 0.421 2263 T N -0.878 113.709 114.554 0.055 0.000 3.037 2263 T HA 0.042 4.393 4.350 0.002 0.000 0.251 2263 T C 1.081 175.693 174.700 -0.147 0.000 1.079 2263 T CA 0.038 62.023 62.100 -0.191 0.000 1.067 2263 T CB 0.140 68.872 68.868 -0.227 0.000 0.948 2263 T HN 0.479 nan 8.240 nan 0.000 0.496 2264 R N 0.559 121.072 120.500 0.022 0.000 3.627 2264 R HA -0.141 4.201 4.340 0.002 0.000 0.281 2264 R C -0.659 175.689 176.300 0.081 0.000 1.140 2264 R CA 0.900 57.031 56.100 0.052 0.000 0.761 2264 R CB -1.794 28.520 30.300 0.023 0.000 1.181 2264 R HN 0.519 nan 8.270 nan 0.000 0.472 2265 E N -0.072 120.196 120.200 0.113 0.000 2.114 2265 E HA 0.520 4.871 4.350 0.002 0.000 0.266 2265 E C 0.439 177.170 176.600 0.217 0.000 0.896 2265 E CA 0.248 56.773 56.400 0.208 0.000 0.750 2265 E CB 1.237 31.136 29.700 0.332 0.000 1.121 2265 E HN 0.231 nan 8.360 nan 0.000 0.413 2266 A N 3.518 126.498 122.820 0.266 0.000 2.195 2266 A HA 0.376 4.697 4.320 0.002 0.000 0.210 2266 A C 1.108 178.901 177.584 0.348 0.000 1.165 2266 A CA 0.802 53.005 52.037 0.277 0.000 0.806 2266 A CB 0.062 19.212 19.000 0.250 0.000 0.847 2266 A HN 0.607 nan 8.150 nan 0.000 0.482 2267 G N -1.053 107.940 108.800 0.321 0.000 2.940 2267 G HA2 0.508 4.469 3.960 0.002 0.000 0.164 2267 G HA3 0.508 4.469 3.960 0.002 0.000 0.164 2267 G C 0.255 175.134 174.900 -0.034 0.000 1.326 2267 G CA -0.028 45.078 45.100 0.011 0.000 1.020 2267 G HN 0.675 nan 8.290 nan 0.000 0.586 2268 A N -1.168 121.556 122.820 -0.161 0.000 2.511 2268 A HA 0.612 4.933 4.320 0.002 0.000 0.242 2268 A C 0.608 178.168 177.584 -0.041 0.000 1.069 2268 A CA 0.864 52.848 52.037 -0.089 0.000 0.763 2268 A CB -0.307 18.619 19.000 -0.122 0.000 1.001 2268 A HN 2.028 nan 8.150 nan 0.000 0.498 2269 G N -0.200 108.577 108.800 -0.037 0.000 2.489 2269 G HA2 0.631 4.592 3.960 0.002 0.000 0.291 2269 G HA3 0.631 4.592 3.960 0.002 0.000 0.291 2269 G C -0.612 174.218 174.900 -0.117 0.000 1.487 2269 G CA 0.087 45.126 45.100 -0.101 0.000 0.795 2269 G HN 1.506 nan 8.290 nan 0.000 0.513 2270 G N -0.859 107.779 108.800 -0.270 0.000 2.687 2270 G HA2 0.695 4.656 3.960 0.002 0.000 0.301 2270 G HA3 0.695 4.656 3.960 0.002 0.000 0.301 2270 G C -1.709 173.123 174.900 -0.113 0.000 1.416 2270 G CA -0.566 44.440 45.100 -0.158 0.000 1.005 2270 G HN 1.214 nan 8.290 nan 0.000 0.509 2271 L N 2.473 123.726 121.223 0.051 0.000 2.376 2271 L HA 0.864 5.205 4.340 0.002 0.000 0.275 2271 L C -0.175 176.751 176.870 0.092 0.000 0.987 2271 L CA -0.769 54.182 54.840 0.184 0.000 0.828 2271 L CB 1.732 43.982 42.059 0.318 0.000 1.249 2271 L HN 0.732 nan 8.230 nan 0.000 0.409 2272 A N 5.981 128.856 122.820 0.092 0.000 2.291 2272 A HA 0.795 5.116 4.320 0.002 0.000 0.311 2272 A C -0.976 176.675 177.584 0.112 0.000 1.224 2272 A CA -0.357 51.712 52.037 0.053 0.000 0.821 2272 A CB 0.378 19.382 19.000 0.007 0.000 1.172 2272 A HN 0.602 nan 8.150 nan 0.000 0.494 2273 I N 2.039 122.687 120.570 0.131 0.000 2.359 2273 I HA 0.617 4.788 4.170 0.002 0.000 0.294 2273 I C 0.511 176.709 176.117 0.135 0.000 0.987 2273 I CA 0.147 61.566 61.300 0.200 0.000 1.225 2273 I CB 1.926 40.096 38.000 0.283 0.000 1.366 2273 I HN 0.687 nan 8.210 nan 0.000 0.466 2274 A N 5.616 128.515 122.820 0.131 0.000 2.414 2274 A HA 0.882 5.204 4.320 0.002 0.000 0.306 2274 A C -1.220 176.394 177.584 0.050 0.000 1.054 2274 A CA -0.606 51.479 52.037 0.079 0.000 0.724 2274 A CB 1.611 20.652 19.000 0.069 0.000 1.267 2274 A HN 0.392 nan 8.150 nan 0.000 0.418 2275 V N 1.963 121.881 119.914 0.006 0.000 2.407 2275 V HA 0.478 4.599 4.120 0.002 0.000 0.291 2275 V C -0.159 175.969 176.094 0.057 0.000 1.018 2275 V CA -0.377 61.896 62.300 -0.046 0.000 0.842 2275 V CB 1.303 32.988 31.823 -0.231 0.000 0.996 2275 V HN 0.946 nan 8.190 nan 0.000 0.426 2276 E N 2.862 123.120 120.200 0.097 0.000 2.176 2276 E HA 0.748 5.099 4.350 0.002 0.000 0.267 2276 E C -0.010 176.638 176.600 0.079 0.000 0.893 2276 E CA -0.138 56.315 56.400 0.088 0.000 0.761 2276 E CB 2.042 31.778 29.700 0.061 0.000 1.133 2276 E HN 0.934 nan 8.360 nan 0.000 0.409 2277 G N 3.226 112.019 108.800 -0.011 0.000 2.321 2277 G HA2 0.094 4.056 3.960 0.002 0.000 0.296 2277 G HA3 0.094 4.056 3.960 0.002 0.000 0.296 2277 G C -2.531 172.188 174.900 -0.302 0.000 1.287 2277 G CA -0.736 44.132 45.100 -0.387 0.000 0.846 2277 G HN 0.346 nan 8.290 nan 0.000 0.508 2278 P HA 0.067 nan 4.420 nan 0.000 0.230 2278 P C 0.738 178.033 177.300 -0.009 0.000 1.158 2278 P CA 1.691 64.678 63.100 -0.188 0.000 0.769 2278 P CB 0.235 31.807 31.700 -0.214 0.000 0.807 2279 S N -2.455 113.323 115.700 0.130 0.000 2.705 2279 S HA 0.511 4.982 4.470 0.002 0.000 0.280 2279 S C -0.536 174.178 174.600 0.190 0.000 1.174 2279 S CA -0.981 57.319 58.200 0.167 0.000 0.823 2279 S CB 1.523 64.826 63.200 0.170 0.000 1.162 2279 S HN -0.256 nan 8.310 nan 0.000 0.487 2280 K N 0.282 120.757 120.400 0.124 0.000 2.336 2280 K HA 0.599 4.920 4.320 0.002 0.000 0.262 2280 K C -0.140 176.519 176.600 0.098 0.000 0.992 2280 K CA 0.446 56.791 56.287 0.098 0.000 0.927 2280 K CB 0.395 32.936 32.500 0.069 0.000 0.956 2280 K HN 0.833 nan 8.250 nan 0.000 0.495 2281 A N 2.031 124.899 122.820 0.079 0.000 2.414 2281 A HA 0.352 4.673 4.320 0.002 0.000 0.306 2281 A C -1.194 176.432 177.584 0.070 0.000 1.054 2281 A CA -0.774 51.306 52.037 0.071 0.000 0.724 2281 A CB 1.011 20.044 19.000 0.054 0.000 1.267 2281 A HN 0.717 nan 8.150 nan 0.000 0.418 2282 E N 1.269 121.516 120.200 0.077 0.000 2.197 2282 E HA 0.568 4.919 4.350 0.002 0.000 0.281 2282 E C -0.551 176.106 176.600 0.096 0.000 0.995 2282 E CA -0.342 56.098 56.400 0.067 0.000 0.808 2282 E CB 1.900 31.628 29.700 0.048 0.000 1.093 2282 E HN 0.644 nan 8.360 nan 0.000 0.394 2283 I N -0.909 119.713 120.570 0.087 0.000 2.865 2283 I HA 0.640 4.811 4.170 0.002 0.000 0.302 2283 I C -0.826 175.338 176.117 0.079 0.000 1.140 2283 I CA -0.747 60.619 61.300 0.109 0.000 1.021 2283 I CB 2.324 40.413 38.000 0.148 0.000 1.233 2283 I HN 0.481 nan 8.210 nan 0.000 0.427 2284 S N 3.969 119.709 115.700 0.067 0.000 2.568 2284 S HA 0.812 5.284 4.470 0.002 0.000 0.293 2284 S C -1.120 173.530 174.600 0.084 0.000 1.089 2284 S CA -0.622 57.615 58.200 0.062 0.000 0.945 2284 S CB 2.303 65.511 63.200 0.014 0.000 1.077 2284 S HN 0.745 nan 8.310 nan 0.000 0.485 2285 F N 1.374 121.279 119.950 -0.075 0.000 2.574 2285 F HA 0.582 5.110 4.527 0.002 0.000 0.313 2285 F C -1.268 174.479 175.800 -0.089 0.000 1.130 2285 F CA -0.564 57.377 58.000 -0.099 0.000 0.936 2285 F CB 1.690 40.649 39.000 -0.069 0.000 1.219 2285 F HN 0.902 nan 8.300 nan 0.000 0.445 2286 E N 4.137 123.969 120.200 -0.614 0.000 2.246 2286 E HA 0.306 4.657 4.350 0.002 0.000 0.266 2286 E C -1.778 174.474 176.600 -0.580 0.000 0.880 2286 E CA -1.027 55.133 56.400 -0.401 0.000 0.762 2286 E CB 1.763 31.337 29.700 -0.210 0.000 1.180 2286 E HN 0.344 nan 8.360 nan 0.000 0.416 2287 D N 2.997 123.246 120.400 -0.253 0.000 2.383 2287 D HA 0.145 4.786 4.640 0.002 0.000 0.252 2287 D C -0.344 175.885 176.300 -0.118 0.000 1.166 2287 D CA 0.169 54.092 54.000 -0.129 0.000 0.879 2287 D CB 0.781 41.623 40.800 0.070 0.000 1.164 2287 D HN 0.346 nan 8.370 nan 0.000 0.462 2288 R N 2.067 122.487 120.500 -0.133 0.000 2.720 2288 R HA 0.258 4.599 4.340 0.002 0.000 0.272 2288 R C 1.525 177.801 176.300 -0.040 0.000 0.991 2288 R CA -0.924 55.119 56.100 -0.095 0.000 1.010 2288 R CB 1.574 31.798 30.300 -0.127 0.000 1.141 2288 R HN 0.149 nan 8.270 nan 0.000 0.494 2289 K N 1.327 121.714 120.400 -0.022 0.000 2.089 2289 K HA -0.212 4.109 4.320 0.002 0.000 0.210 2289 K C 1.129 177.739 176.600 0.018 0.000 1.048 2289 K CA 2.235 58.524 56.287 0.002 0.000 0.926 2289 K CB -0.145 32.356 32.500 0.003 0.000 0.714 2289 K HN 0.691 nan 8.250 nan 0.000 0.448 2290 D N -1.136 119.278 120.400 0.022 0.000 2.363 2290 D HA -0.025 4.616 4.640 0.002 0.000 0.226 2290 D C 1.130 177.473 176.300 0.073 0.000 1.020 2290 D CA 1.040 55.072 54.000 0.054 0.000 0.892 2290 D CB -0.022 40.826 40.800 0.080 0.000 0.900 2290 D HN 0.347 nan 8.370 nan 0.000 0.531 2291 G N -0.130 108.696 108.800 0.044 0.000 2.175 2291 G HA2 -0.276 3.686 3.960 0.002 0.000 0.244 2291 G HA3 -0.276 3.686 3.960 0.002 0.000 0.244 2291 G C 0.444 175.359 174.900 0.025 0.000 0.982 2291 G CA 0.423 45.557 45.100 0.056 0.000 0.641 2291 G HN 0.824 nan 8.290 nan 0.000 0.527 2292 S N -1.160 114.513 115.700 -0.046 0.000 2.634 2292 S HA 0.651 5.122 4.470 0.002 0.000 0.261 2292 S C 0.297 174.699 174.600 -0.330 0.000 1.271 2292 S CA 0.041 58.071 58.200 -0.283 0.000 0.985 2292 S CB 1.948 64.802 63.200 -0.577 0.000 0.968 2292 S HN 0.915 nan 8.310 nan 0.000 0.568 2293 C N 0.927 119.939 119.300 -0.480 0.000 2.408 2293 C HA 0.821 5.283 4.460 0.002 0.000 0.321 2293 C C 0.777 175.374 174.990 -0.655 0.000 1.245 2293 C CA -0.630 58.046 59.018 -0.570 0.000 1.523 2293 C CB 0.488 27.968 27.740 -0.434 0.000 2.178 2293 C HN 1.061 nan 8.230 nan 0.000 0.488 2294 G N 2.361 110.745 108.800 -0.694 0.000 2.322 2294 G HA2 0.598 4.559 3.960 0.002 0.000 0.309 2294 G HA3 0.598 4.559 3.960 0.002 0.000 0.309 2294 G C -0.876 173.628 174.900 -0.660 0.000 1.121 2294 G CA -0.062 44.683 45.100 -0.593 0.000 0.886 2294 G HN 0.649 nan 8.290 nan 0.000 0.447 2295 V N 1.142 120.631 119.914 -0.709 0.000 2.604 2295 V HA 0.841 4.962 4.120 0.002 0.000 0.305 2295 V C 0.205 175.999 176.094 -0.500 0.000 1.043 2295 V CA -0.716 61.204 62.300 -0.633 0.000 0.888 2295 V CB 1.528 32.805 31.823 -0.911 0.000 0.995 2295 V HN 1.128 nan 8.190 nan 0.000 0.429 2296 A N 4.119 126.804 122.820 -0.224 0.000 2.414 2296 A HA 0.977 5.298 4.320 0.002 0.000 0.306 2296 A C -1.460 176.134 177.584 0.017 0.000 1.054 2296 A CA -0.568 51.376 52.037 -0.155 0.000 0.724 2296 A CB 1.738 20.650 19.000 -0.147 0.000 1.267 2296 A HN 1.295 nan 8.150 nan 0.000 0.418 2297 Y N -0.728 119.567 120.300 -0.008 0.000 2.504 2297 Y HA 0.743 5.294 4.550 0.002 0.000 0.344 2297 Y C -1.306 174.581 175.900 -0.022 0.000 1.023 2297 Y CA -1.547 56.555 58.100 0.003 0.000 1.020 2297 Y CB 1.176 39.661 38.460 0.041 0.000 1.282 2297 Y HN 0.398 nan 8.280 nan 0.000 0.454 2298 V N 4.314 124.309 119.914 0.135 0.000 2.448 2298 V HA 0.570 4.691 4.120 0.002 0.000 0.295 2298 V C -0.619 175.536 176.094 0.102 0.000 1.025 2298 V CA -0.850 61.486 62.300 0.059 0.000 0.859 2298 V CB 1.471 33.302 31.823 0.014 0.000 0.988 2298 V HN 0.797 nan 8.190 nan 0.000 0.431 2299 V N 4.103 124.049 119.914 0.053 0.000 2.581 2299 V HA 0.277 4.398 4.120 0.002 0.000 0.303 2299 V C 0.908 177.000 176.094 -0.002 0.000 1.041 2299 V CA 0.027 62.308 62.300 -0.030 0.000 0.907 2299 V CB 1.923 33.563 31.823 -0.305 0.000 0.994 2299 V HN 1.019 nan 8.190 nan 0.000 0.442 2300 Q N 2.393 122.221 119.800 0.046 0.000 2.096 2300 Q HA 0.044 4.385 4.340 0.002 0.000 0.197 2300 Q C 0.304 176.349 176.000 0.075 0.000 0.964 2300 Q CA 1.268 57.108 55.803 0.061 0.000 0.838 2300 Q CB 0.364 29.145 28.738 0.072 0.000 0.906 2300 Q HN 0.777 nan 8.270 nan 0.000 0.444 2301 E N 0.147 120.427 120.200 0.134 0.000 2.277 2301 E HA 0.358 4.709 4.350 0.002 0.000 0.266 2301 E C -2.583 174.144 176.600 0.211 0.000 0.901 2301 E CA -2.596 53.893 56.400 0.149 0.000 0.782 2301 E CB 2.018 31.806 29.700 0.147 0.000 1.228 2301 E HN 0.071 nan 8.360 nan 0.000 0.424 2302 P HA 0.281 nan 4.420 nan 0.000 0.272 2302 P C -0.369 177.063 177.300 0.221 0.000 1.230 2302 P CA 0.003 63.205 63.100 0.169 0.000 0.788 2302 P CB 0.713 32.466 31.700 0.088 0.000 0.949 2303 G N 0.133 109.075 108.800 0.237 0.000 2.369 2303 G HA2 0.069 4.030 3.960 0.002 0.000 0.293 2303 G HA3 0.069 4.030 3.960 0.002 0.000 0.293 2303 G C -2.067 172.914 174.900 0.134 0.000 1.301 2303 G CA -0.749 44.414 45.100 0.104 0.000 0.913 2303 G HN 0.414 nan 8.290 nan 0.000 0.540 2304 D N 0.626 120.990 120.400 -0.060 0.000 2.313 2304 D HA 0.553 5.194 4.640 0.002 0.000 0.239 2304 D C -0.725 175.486 176.300 -0.148 0.000 1.142 2304 D CA 0.476 54.471 54.000 -0.010 0.000 0.847 2304 D CB 1.219 42.005 40.800 -0.025 0.000 1.082 2304 D HN 0.252 nan 8.370 nan 0.000 0.480 2305 Y N 0.337 120.652 120.300 0.024 0.000 2.587 2305 Y HA 0.331 4.882 4.550 0.002 0.000 0.337 2305 Y C 0.712 176.621 175.900 0.015 0.000 1.065 2305 Y CA -0.897 57.209 58.100 0.011 0.000 1.126 2305 Y CB 1.733 40.190 38.460 -0.005 0.000 1.279 2305 Y HN 0.120 nan 8.280 nan 0.000 0.489 2306 E N 0.926 121.225 120.200 0.166 0.000 2.224 2306 E HA 0.504 4.855 4.350 0.002 0.000 0.265 2306 E C -1.606 175.053 176.600 0.097 0.000 0.878 2306 E CA -0.762 55.709 56.400 0.119 0.000 0.759 2306 E CB 2.592 32.343 29.700 0.085 0.000 1.164 2306 E HN 0.248 nan 8.360 nan 0.000 0.414 2307 V N 2.688 122.665 119.914 0.105 0.000 2.370 2307 V HA 0.278 4.400 4.120 0.002 0.000 0.283 2307 V C -0.019 176.216 176.094 0.234 0.000 1.023 2307 V CA -0.515 61.831 62.300 0.075 0.000 0.857 2307 V CB 1.188 32.975 31.823 -0.060 0.000 0.985 2307 V HN 0.711 nan 8.190 nan 0.000 0.443 2308 S N 4.298 120.128 115.700 0.217 0.000 2.503 2308 S HA 0.837 5.308 4.470 0.002 0.000 0.301 2308 S C -0.928 173.836 174.600 0.273 0.000 1.087 2308 S CA -0.743 57.630 58.200 0.289 0.000 1.042 2308 S CB 1.986 65.360 63.200 0.289 0.000 1.043 2308 S HN 0.378 nan 8.310 nan 0.000 0.489 2309 V N 2.867 122.974 119.914 0.321 0.000 2.407 2309 V HA 0.508 4.629 4.120 0.002 0.000 0.291 2309 V C -0.430 175.777 176.094 0.187 0.000 1.018 2309 V CA -0.612 61.861 62.300 0.289 0.000 0.842 2309 V CB 1.307 33.360 31.823 0.384 0.000 0.996 2309 V HN 0.917 nan 8.190 nan 0.000 0.426 2310 K N 4.273 124.735 120.400 0.103 0.000 2.292 2310 K HA 0.598 4.919 4.320 0.002 0.000 0.257 2310 K C -1.380 175.322 176.600 0.170 0.000 0.940 2310 K CA -0.562 55.743 56.287 0.031 0.000 0.811 2310 K CB 2.476 34.898 32.500 -0.131 0.000 1.120 2310 K HN 0.534 nan 8.250 nan 0.000 0.428 2311 F N 3.646 123.616 119.950 0.035 0.000 2.444 2311 F HA 0.273 4.801 4.527 0.002 0.000 0.342 2311 F C -0.079 175.741 175.800 0.034 0.000 1.121 2311 F CA -0.736 57.296 58.000 0.054 0.000 0.997 2311 F CB 0.830 39.883 39.000 0.088 0.000 1.130 2311 F HN 0.582 nan 8.300 nan 0.000 0.454 2312 N N 5.688 124.061 118.700 -0.546 0.000 2.699 2312 N HA -0.249 4.492 4.740 0.002 0.000 0.256 2312 N C 0.039 175.451 175.510 -0.163 0.000 0.993 2312 N CA 1.507 54.320 53.050 -0.396 0.000 0.759 2312 N CB -0.696 37.496 38.487 -0.491 0.000 0.906 2312 N HN 0.817 nan 8.380 nan 0.000 0.541 2313 E N -3.493 116.639 120.200 -0.113 0.000 4.028 2313 E HA -0.238 4.114 4.350 0.002 0.000 0.343 2313 E C -0.354 176.212 176.600 -0.057 0.000 0.700 2313 E CA 1.339 57.693 56.400 -0.078 0.000 1.288 2313 E CB -1.169 28.491 29.700 -0.066 0.000 1.677 2313 E HN 0.775 nan 8.360 nan 0.000 0.424 2314 E N 0.623 120.814 120.200 -0.014 0.000 2.207 2314 E HA 0.346 4.697 4.350 0.002 0.000 0.270 2314 E C -0.055 176.568 176.600 0.038 0.000 0.927 2314 E CA -0.737 55.682 56.400 0.032 0.000 0.799 2314 E CB 1.150 30.907 29.700 0.096 0.000 1.172 2314 E HN 0.092 nan 8.360 nan 0.000 0.404 2315 H N 2.303 121.422 119.070 0.081 0.000 2.964 2315 H HA 0.039 4.597 4.556 0.002 0.000 0.328 2315 H C 0.661 176.048 175.328 0.098 0.000 1.030 2315 H CA 0.194 56.287 56.048 0.074 0.000 1.445 2315 H CB 0.282 30.054 29.762 0.017 0.000 1.449 2315 H HN 0.490 nan 8.280 nan 0.000 0.581 2316 I N 2.007 122.719 120.570 0.237 0.000 3.194 2316 I HA 0.084 4.255 4.170 0.002 0.000 0.283 2316 I C -1.534 174.658 176.117 0.125 0.000 1.199 2316 I CA -1.778 59.641 61.300 0.197 0.000 1.328 2316 I CB 0.146 38.280 38.000 0.223 0.000 1.404 2316 I HN 0.244 nan 8.210 nan 0.000 0.618 2317 P HA -0.134 nan 4.420 nan 0.000 0.218 2317 P C 0.339 177.602 177.300 -0.062 0.000 1.146 2317 P CA 1.453 64.581 63.100 0.046 0.000 0.813 2317 P CB 0.014 31.755 31.700 0.069 0.000 0.778 2318 D N -2.367 117.922 120.400 -0.184 0.000 2.469 2318 D HA 0.081 4.722 4.640 0.002 0.000 0.215 2318 D C 0.229 175.892 176.300 -1.061 0.000 1.154 2318 D CA 0.203 53.903 54.000 -0.501 0.000 0.832 2318 D CB 0.295 40.895 40.800 -0.334 0.000 1.008 2318 D HN 0.036 nan 8.370 nan 0.000 0.506 2319 S N 2.112 117.388 115.700 -0.707 0.000 2.565 2319 S HA 0.332 4.803 4.470 0.002 0.000 0.274 2319 S C -2.474 171.830 174.600 -0.492 0.000 1.309 2319 S CA -1.079 56.830 58.200 -0.484 0.000 1.043 2319 S CB 1.081 64.398 63.200 0.195 0.000 0.939 2319 S HN -0.109 nan 8.310 nan 0.000 0.504 2320 P HA 0.350 nan 4.420 nan 0.000 0.281 2320 P C -1.193 175.972 177.300 -0.225 0.000 1.249 2320 P CA -0.498 62.509 63.100 -0.154 0.000 0.810 2320 P CB 0.317 32.010 31.700 -0.013 0.000 1.008 2321 F N 0.095 120.036 119.950 -0.014 0.000 2.408 2321 F HA 0.235 4.763 4.527 0.002 0.000 0.344 2321 F C 0.633 176.430 175.800 -0.005 0.000 1.112 2321 F CA -0.881 57.104 58.000 -0.025 0.000 1.096 2321 F CB 0.912 39.875 39.000 -0.062 0.000 1.129 2321 F HN -0.048 nan 8.300 nan 0.000 0.486 2322 V N 4.762 124.774 119.914 0.162 0.000 2.439 2322 V HA 0.189 4.310 4.120 0.002 0.000 0.271 2322 V C -0.147 176.032 176.094 0.140 0.000 1.040 2322 V CA -0.330 62.042 62.300 0.120 0.000 1.002 2322 V CB 0.761 32.630 31.823 0.077 0.000 1.000 2322 V HN 0.507 nan 8.190 nan 0.000 0.477 2323 V N 8.427 128.431 119.914 0.151 0.000 2.325 2323 V HA 0.338 4.459 4.120 0.002 0.000 0.280 2323 V C -2.176 174.027 176.094 0.182 0.000 1.016 2323 V CA -1.732 60.662 62.300 0.157 0.000 0.818 2323 V CB 1.689 33.613 31.823 0.169 0.000 1.019 2323 V HN 0.714 nan 8.190 nan 0.000 0.434 2324 P HA 0.232 nan 4.420 nan 0.000 0.276 2324 P C -0.706 176.682 177.300 0.147 0.000 1.230 2324 P CA 0.022 63.206 63.100 0.140 0.000 0.776 2324 P CB 1.694 33.448 31.700 0.089 0.000 0.888 2325 V N 3.020 123.047 119.914 0.188 0.000 2.409 2325 V HA 0.539 4.661 4.120 0.002 0.000 0.291 2325 V C 0.575 176.733 176.094 0.107 0.000 1.020 2325 V CA -0.803 61.576 62.300 0.132 0.000 0.848 2325 V CB 1.269 33.155 31.823 0.104 0.000 0.990 2325 V HN 0.722 nan 8.190 nan 0.000 0.430 2326 A N 3.943 126.801 122.820 0.063 0.000 2.293 2326 A HA 0.776 5.097 4.320 0.002 0.000 0.302 2326 A C 0.601 178.209 177.584 0.040 0.000 1.119 2326 A CA -0.369 51.696 52.037 0.048 0.000 0.823 2326 A CB 0.667 19.686 19.000 0.031 0.000 1.097 2326 A HN 0.980 nan 8.150 nan 0.000 0.491 2327 S N 1.453 117.174 115.700 0.035 0.000 2.593 2327 S HA 0.394 4.865 4.470 0.002 0.000 0.269 2327 S C -2.483 172.127 174.600 0.018 0.000 1.334 2327 S CA -1.035 57.182 58.200 0.029 0.000 1.015 2327 S CB -0.400 62.816 63.200 0.026 0.000 0.912 2327 S HN 0.574 nan 8.310 nan 0.000 0.541 2328 P HA 0.235 nan 4.420 nan 0.000 0.242 2328 P C -0.024 177.280 177.300 0.006 0.000 1.116 2328 P CA 1.100 64.205 63.100 0.008 0.000 0.954 2328 P CB -1.105 30.600 31.700 0.008 0.000 0.908 2329 S N 0.000 115.703 115.700 0.005 0.000 2.498 2329 S HA 0.000 4.471 4.470 0.002 0.000 0.327 2329 S CA 0.000 nan 58.200 nan 0.000 1.107 2329 S CB 0.000 nan 63.200 nan 0.000 0.593 2329 S HN 0.000 nan 8.310 nan 0.000 0.517