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 3izj_1_E DATA FIRST_RESID 2053 DATA SEQUENCE VLPENMKRYM GRDAQRMNIL AGRIIAETVR STLGPKGMDK MLVDDLGDVV DATA SEQUENCE VTNDGVTILR EMSVEHPAAK MLIEVAKTQE KEVGDGTTTA VVVAGELLRK DATA SEQUENCE AEELLDQNVH PTIVVKGYQA AAQKAQELLK TIACEVGAQD KEILTKIAMT DATA SEQUENCE SITGKGAEKA KEKLAEIIVE AVSAVVDDEG KVDKDLIKIE KKSGASIDDT DATA SEQUENCE ELIKGVLVDK ERVSAQMPKK VTDAKIALLN CAIEIKETET DAEIRITDPA DATA SEQUENCE KLMEFIEQEE KMLKDMVAEI KASGANVLFC QKGIDDLAQH YLAKEGIVAA DATA SEQUENCE RRVKKSDMEK LAKATGANVI AAIAALSAQD LGDAGLVEER KISGDSMIFV DATA SEQUENCE EECKHPKAVT MLIRGTTEHV IEEVARAVDD AVGVVGCTIE DGRIVSGGGS DATA SEQUENCE TEVELSMKLR EYAEGISGRE QLAVRAFADA LEVIPRTLAE NAGLDAIEIL DATA SEQUENCE VKVRAAHASN GNKCAGLNVF TGAVEDMCEN GVVEPLRVKT QAIQSAAEST DATA SEQUENCE EMLLRIDDVI AAE 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 2053 V HA 0.000 nan 4.120 nan 0.000 0.244 2053 V C 0.000 176.090 176.094 -0.007 0.000 1.182 2053 V CA 0.000 62.296 62.300 -0.007 0.000 1.235 2053 V CB 0.000 31.819 31.823 -0.006 0.000 1.184 2054 L N 2.642 123.859 121.223 -0.010 0.000 2.375 2054 L HA 0.475 4.815 4.340 0.000 0.000 0.271 2054 L C -2.075 174.789 176.870 -0.011 0.000 1.107 2054 L CA -1.503 53.331 54.840 -0.010 0.000 0.806 2054 L CB 0.354 42.404 42.059 -0.015 0.000 1.146 2054 L HN 0.137 nan 8.230 nan 0.000 0.447 2055 P HA 0.028 nan 4.420 nan 0.000 0.265 2055 P C -0.944 176.349 177.300 -0.012 0.000 1.187 2055 P CA -0.198 62.897 63.100 -0.008 0.000 0.766 2055 P CB 0.369 32.066 31.700 -0.004 0.000 0.820 2056 E N 2.813 123.006 120.200 -0.011 0.000 2.417 2056 E HA 0.075 4.425 4.350 0.000 0.000 0.261 2056 E C 0.587 177.179 176.600 -0.013 0.000 1.000 2056 E CA 0.593 56.984 56.400 -0.014 0.000 0.919 2056 E CB -0.050 29.643 29.700 -0.012 0.000 0.955 2056 E HN 0.347 nan 8.360 nan 0.000 0.455 2057 N N 0.594 119.283 118.700 -0.019 0.000 2.990 2057 N HA -0.178 4.563 4.740 0.000 0.000 0.163 2057 N C -0.214 175.284 175.510 -0.020 0.000 1.452 2057 N CA 0.524 53.564 53.050 -0.017 0.000 1.624 2057 N CB -1.038 37.443 38.487 -0.009 0.000 1.088 2057 N HN 0.552 nan 8.380 nan 0.000 0.695 2058 M N 3.013 122.600 119.600 -0.020 0.000 2.248 2058 M HA 0.045 4.525 4.480 0.000 0.000 0.345 2058 M C 0.327 176.598 176.300 -0.048 0.000 1.243 2058 M CA 0.413 55.700 55.300 -0.021 0.000 1.090 2058 M CB 0.458 33.049 32.600 -0.015 0.000 1.683 2058 M HN 0.100 nan 8.290 nan 0.000 0.450 2059 K N 5.163 125.530 120.400 -0.056 0.000 2.164 2059 K HA 0.599 4.919 4.320 0.000 0.000 0.258 2059 K C -1.123 175.372 176.600 -0.174 0.000 0.951 2059 K CA -0.958 55.245 56.287 -0.140 0.000 0.844 2059 K CB 2.026 34.447 32.500 -0.132 0.000 1.099 2059 K HN 0.792 nan 8.250 nan 0.000 0.435 2060 R N 2.652 122.962 120.500 -0.316 0.000 2.673 2060 R HA 0.306 4.646 4.340 0.000 0.000 0.281 2060 R C -1.656 174.363 176.300 -0.467 0.000 0.991 2060 R CA -0.670 55.279 56.100 -0.251 0.000 0.896 2060 R CB 1.318 31.552 30.300 -0.111 0.000 1.201 2060 R HN 0.735 nan 8.270 nan 0.000 0.457 2061 Y N 4.270 124.555 120.300 -0.026 0.000 2.429 2061 Y HA 0.546 5.096 4.550 0.000 0.000 0.342 2061 Y C 0.377 176.260 175.900 -0.028 0.000 1.004 2061 Y CA -0.875 57.205 58.100 -0.033 0.000 1.075 2061 Y CB 2.127 40.558 38.460 -0.048 0.000 1.214 2061 Y HN 0.389 nan 8.280 nan 0.000 0.455 2062 M N 1.083 120.746 119.600 0.105 0.000 2.465 2062 M HA 0.772 5.252 4.480 0.000 0.000 0.284 2062 M C 0.044 176.363 176.300 0.031 0.000 1.212 2062 M CA -0.297 55.032 55.300 0.048 0.000 0.910 2062 M CB 1.275 33.884 32.600 0.015 0.000 1.725 2062 M HN 0.835 nan 8.290 nan 0.000 0.477 2063 G N 3.240 112.046 108.800 0.011 0.000 2.591 2063 G HA2 -0.333 3.627 3.960 0.000 0.000 0.298 2063 G HA3 -0.333 3.627 3.960 0.000 0.000 0.298 2063 G C 0.563 175.457 174.900 -0.010 0.000 1.195 2063 G CA 0.829 45.923 45.100 -0.009 0.000 0.989 2063 G HN 0.944 nan 8.290 nan 0.000 0.551 2064 R N 0.751 121.243 120.500 -0.013 0.000 2.237 2064 R HA 0.050 4.390 4.340 0.000 0.000 0.219 2064 R C 1.962 178.264 176.300 0.004 0.000 1.080 2064 R CA 1.258 57.350 56.100 -0.014 0.000 0.995 2064 R CB -0.197 30.092 30.300 -0.017 0.000 0.875 2064 R HN 0.500 nan 8.270 nan 0.000 0.462 2065 D N 0.590 121.009 120.400 0.030 0.000 2.162 2065 D HA -0.040 4.601 4.640 0.000 0.000 0.203 2065 D C 1.801 178.155 176.300 0.090 0.000 0.967 2065 D CA 1.208 55.255 54.000 0.078 0.000 0.840 2065 D CB -0.119 40.750 40.800 0.115 0.000 0.972 2065 D HN 0.182 nan 8.370 nan 0.000 0.482 2066 A N 0.925 123.794 122.820 0.081 0.000 1.933 2066 A HA -0.184 4.136 4.320 0.000 0.000 0.218 2066 A C 2.077 179.630 177.584 -0.051 0.000 1.175 2066 A CA 1.199 53.259 52.037 0.039 0.000 0.628 2066 A CB -0.318 18.712 19.000 0.049 0.000 0.814 2066 A HN 0.083 nan 8.150 nan 0.000 0.444 2067 Q N -0.807 118.972 119.800 -0.035 0.000 2.123 2067 Q HA -0.135 4.205 4.340 0.000 0.000 0.199 2067 Q C 2.216 178.181 176.000 -0.059 0.000 0.966 2067 Q CA 1.551 57.325 55.803 -0.047 0.000 0.845 2067 Q CB -0.384 28.332 28.738 -0.038 0.000 0.907 2067 Q HN 0.628 nan 8.270 nan 0.000 0.439 2068 R N 1.034 121.503 120.500 -0.051 0.000 2.083 2068 R HA -0.079 4.261 4.340 0.000 0.000 0.237 2068 R C 2.097 178.329 176.300 -0.113 0.000 1.137 2068 R CA 1.487 57.554 56.100 -0.055 0.000 0.951 2068 R CB -0.599 29.687 30.300 -0.023 0.000 0.851 2068 R HN 0.181 nan 8.270 nan 0.000 0.434 2069 M N 0.451 119.928 119.600 -0.206 0.000 2.132 2069 M HA -0.119 4.361 4.480 0.000 0.000 0.263 2069 M C 0.985 177.081 176.300 -0.340 0.000 1.065 2069 M CA 1.794 56.852 55.300 -0.403 0.000 1.122 2069 M CB -0.702 31.402 32.600 -0.827 0.000 1.365 2069 M HN 0.154 nan 8.290 nan 0.000 0.411 2070 N N 0.994 119.551 118.700 -0.239 0.000 2.166 2070 N HA -0.110 4.630 4.740 0.000 0.000 0.186 2070 N C 1.739 177.203 175.510 -0.078 0.000 1.019 2070 N CA 1.333 54.296 53.050 -0.145 0.000 0.856 2070 N CB -0.398 38.031 38.487 -0.096 0.000 0.993 2070 N HN 0.359 nan 8.380 nan 0.000 0.426 2071 I N 1.024 121.555 120.570 -0.065 0.000 2.252 2071 I HA -0.134 4.036 4.170 0.000 0.000 0.245 2071 I C 2.191 178.296 176.117 -0.020 0.000 1.102 2071 I CA 0.681 61.965 61.300 -0.027 0.000 1.385 2071 I CB -1.036 36.953 38.000 -0.019 0.000 1.064 2071 I HN 0.101 nan 8.210 nan 0.000 0.414 2072 L N 0.584 121.784 121.223 -0.038 0.000 2.083 2072 L HA -0.180 4.160 4.340 0.000 0.000 0.209 2072 L C 2.805 179.705 176.870 0.050 0.000 1.083 2072 L CA 1.242 56.079 54.840 -0.005 0.000 0.752 2072 L CB -0.633 41.413 42.059 -0.022 0.000 0.899 2072 L HN 0.183 nan 8.230 nan 0.000 0.433 2073 A N 0.317 123.166 122.820 0.049 0.000 1.858 2073 A HA -0.139 4.181 4.320 0.000 0.000 0.216 2073 A C 2.396 180.029 177.584 0.082 0.000 1.190 2073 A CA 1.867 54.014 52.037 0.183 0.000 0.617 2073 A CB -1.323 17.739 19.000 0.104 0.000 0.827 2073 A HN 0.424 nan 8.150 nan 0.000 0.443 2074 G N -0.912 107.909 108.800 0.035 0.000 2.408 2074 G HA2 -0.189 3.771 3.960 0.000 0.000 0.217 2074 G HA3 -0.189 3.771 3.960 0.000 0.000 0.217 2074 G C 1.700 176.608 174.900 0.013 0.000 1.150 2074 G CA 1.174 46.286 45.100 0.020 0.000 0.776 2074 G HN 0.514 nan 8.290 nan 0.000 0.542 2075 R N 0.515 121.023 120.500 0.013 0.000 2.081 2075 R HA 0.095 4.435 4.340 0.000 0.000 0.235 2075 R C 2.433 178.736 176.300 0.006 0.000 1.131 2075 R CA 1.126 57.230 56.100 0.006 0.000 0.960 2075 R CB -0.591 29.712 30.300 0.006 0.000 0.856 2075 R HN 0.427 nan 8.270 nan 0.000 0.436 2076 I N 0.070 120.649 120.570 0.016 0.000 2.202 2076 I HA -0.249 3.921 4.170 0.000 0.000 0.242 2076 I C 1.785 177.900 176.117 -0.005 0.000 1.091 2076 I CA 0.766 62.070 61.300 0.008 0.000 1.368 2076 I CB -0.266 37.744 38.000 0.016 0.000 1.058 2076 I HN 0.144 nan 8.210 nan 0.000 0.410 2077 I N 1.198 121.767 120.570 -0.002 0.000 2.163 2077 I HA -0.303 3.867 4.170 0.000 0.000 0.243 2077 I C 2.818 178.927 176.117 -0.013 0.000 1.085 2077 I CA 1.918 63.212 61.300 -0.010 0.000 1.347 2077 I CB -1.491 36.506 38.000 -0.005 0.000 1.044 2077 I HN 0.204 nan 8.210 nan 0.000 0.408 2078 A N 0.191 123.005 122.820 -0.010 0.000 1.930 2078 A HA -0.214 4.106 4.320 0.000 0.000 0.217 2078 A C 2.261 179.833 177.584 -0.019 0.000 1.175 2078 A CA 1.683 53.710 52.037 -0.016 0.000 0.627 2078 A CB -0.502 18.488 19.000 -0.017 0.000 0.815 2078 A HN 0.407 nan 8.150 nan 0.000 0.443 2079 E N 0.328 120.519 120.200 -0.015 0.000 2.110 2079 E HA -0.146 4.204 4.350 0.000 0.000 0.193 2079 E C 2.040 178.629 176.600 -0.018 0.000 0.988 2079 E CA 2.222 58.613 56.400 -0.016 0.000 0.804 2079 E CB -0.439 29.255 29.700 -0.011 0.000 0.745 2079 E HN 0.663 nan 8.360 nan 0.000 0.458 2080 T N -2.647 111.895 114.554 -0.019 0.000 2.976 2080 T HA 0.026 4.376 4.350 0.000 0.000 0.257 2080 T C 1.958 176.645 174.700 -0.022 0.000 1.051 2080 T CA 0.806 62.894 62.100 -0.021 0.000 1.141 2080 T CB -0.410 68.444 68.868 -0.023 0.000 0.881 2080 T HN 0.034 nan 8.240 nan 0.000 0.461 2081 V N 2.856 122.757 119.914 -0.021 0.000 2.788 2081 V HA 0.031 4.151 4.120 0.000 0.000 0.251 2081 V C 2.886 178.966 176.094 -0.024 0.000 1.068 2081 V CA 1.422 63.709 62.300 -0.022 0.000 1.090 2081 V CB -0.584 31.227 31.823 -0.020 0.000 0.710 2081 V HN 0.648 nan 8.190 nan 0.000 0.467 2082 R N 0.986 121.471 120.500 -0.026 0.000 2.200 2082 R HA -0.115 4.225 4.340 0.000 0.000 0.234 2082 R C 1.912 178.193 176.300 -0.031 0.000 1.127 2082 R CA 1.772 57.854 56.100 -0.030 0.000 0.989 2082 R CB -1.028 29.253 30.300 -0.031 0.000 0.869 2082 R HN 0.628 nan 8.270 nan 0.000 0.459 2083 S N 0.240 115.923 115.700 -0.029 0.000 2.595 2083 S HA -0.084 4.386 4.470 0.000 0.000 0.235 2083 S C 1.654 176.235 174.600 -0.031 0.000 0.974 2083 S CA 0.875 59.056 58.200 -0.031 0.000 0.942 2083 S CB -0.067 63.116 63.200 -0.028 0.000 0.766 2083 S HN 0.610 nan 8.310 nan 0.000 0.536 2084 T N -1.166 113.370 114.554 -0.029 0.000 3.037 2084 T HA 0.311 4.661 4.350 0.000 0.000 0.251 2084 T C 0.421 175.103 174.700 -0.030 0.000 1.079 2084 T CA -0.475 61.608 62.100 -0.027 0.000 1.067 2084 T CB -0.468 68.387 68.868 -0.022 0.000 0.948 2084 T HN 0.276 nan 8.240 nan 0.000 0.496 2085 L N 2.897 124.099 121.223 -0.034 0.000 2.462 2085 L HA 0.516 4.856 4.340 0.000 0.000 0.272 2085 L C 0.703 177.546 176.870 -0.046 0.000 1.166 2085 L CA 1.617 56.435 54.840 -0.036 0.000 0.880 2085 L CB -0.670 41.367 42.059 -0.038 0.000 1.142 2085 L HN 0.735 nan 8.230 nan 0.000 0.473 2086 G N 4.038 112.813 108.800 -0.042 0.000 2.663 2086 G HA2 -0.147 3.813 3.960 0.000 0.000 0.686 2086 G HA3 -0.147 3.813 3.960 0.000 0.000 0.686 2086 G C -2.098 172.761 174.900 -0.068 0.000 1.288 2086 G CA -0.459 44.606 45.100 -0.058 0.000 0.836 2086 G HN 0.482 nan 8.290 nan 0.000 0.584 2087 P HA -0.016 nan 4.420 nan 0.000 0.218 2087 P C 1.408 178.614 177.300 -0.157 0.000 1.148 2087 P CA 1.495 64.525 63.100 -0.118 0.000 0.822 2087 P CB 0.047 31.577 31.700 -0.283 0.000 0.784 2088 K N -0.691 119.590 120.400 -0.198 0.000 2.446 2088 K HA 0.257 4.577 4.320 0.000 0.000 0.203 2088 K C 0.951 177.497 176.600 -0.090 0.000 1.027 2088 K CA -0.189 56.006 56.287 -0.152 0.000 1.166 2088 K CB -0.374 32.016 32.500 -0.183 0.000 0.869 2088 K HN 0.035 nan 8.250 nan 0.000 0.504 2089 G N 0.377 109.134 108.800 -0.072 0.000 2.569 2089 G HA2 0.222 4.182 3.960 0.000 0.000 0.249 2089 G HA3 0.222 4.182 3.960 0.000 0.000 0.249 2089 G C -0.017 174.860 174.900 -0.038 0.000 1.216 2089 G CA -0.432 44.638 45.100 -0.050 0.000 0.845 2089 G HN -0.029 nan 8.290 nan 0.000 0.568 2090 M N -0.047 119.533 119.600 -0.033 0.000 2.705 2090 M HA 0.408 4.889 4.480 0.000 0.000 0.272 2090 M C -0.690 175.596 176.300 -0.024 0.000 1.172 2090 M CA -0.512 54.771 55.300 -0.027 0.000 0.901 2090 M CB 1.402 33.986 32.600 -0.028 0.000 1.516 2090 M HN 0.389 nan 8.290 nan 0.000 0.530 2091 D N -0.221 120.165 120.400 -0.024 0.000 2.269 2091 D HA 0.474 5.114 4.640 0.000 0.000 0.244 2091 D C -0.977 175.307 176.300 -0.026 0.000 0.992 2091 D CA -0.370 53.615 54.000 -0.024 0.000 0.894 2091 D CB 1.413 42.198 40.800 -0.025 0.000 1.248 2091 D HN 0.098 nan 8.370 nan 0.000 0.468 2092 K N 0.740 121.124 120.400 -0.025 0.000 2.123 2092 K HA 0.612 4.932 4.320 0.000 0.000 0.248 2092 K C -0.807 175.775 176.600 -0.030 0.000 0.969 2092 K CA -0.519 55.752 56.287 -0.026 0.000 0.882 2092 K CB 1.316 33.802 32.500 -0.023 0.000 1.080 2092 K HN 0.364 nan 8.250 nan 0.000 0.441 2093 M N 3.305 122.886 119.600 -0.031 0.000 2.022 2093 M HA 0.328 4.808 4.480 0.000 0.000 0.298 2093 M C -1.706 174.577 176.300 -0.028 0.000 0.909 2093 M CA -0.917 54.361 55.300 -0.036 0.000 0.914 2093 M CB 0.569 33.144 32.600 -0.042 0.000 1.486 2093 M HN 0.308 nan 8.290 nan 0.000 0.415 2094 L N 5.059 126.267 121.223 -0.023 0.000 2.275 2094 L HA 0.563 4.903 4.340 0.000 0.000 0.288 2094 L C -0.681 176.181 176.870 -0.013 0.000 1.046 2094 L CA -0.322 54.507 54.840 -0.017 0.000 0.805 2094 L CB 1.740 43.791 42.059 -0.014 0.000 1.193 2094 L HN 0.360 nan 8.230 nan 0.000 0.426 2095 V N 2.579 122.486 119.914 -0.012 0.000 2.409 2095 V HA 0.349 4.469 4.120 0.000 0.000 0.291 2095 V C -0.058 176.032 176.094 -0.005 0.000 1.020 2095 V CA -0.856 61.439 62.300 -0.008 0.000 0.848 2095 V CB 1.566 33.384 31.823 -0.009 0.000 0.990 2095 V HN 0.633 nan 8.190 nan 0.000 0.430 2096 D N 2.503 122.902 120.400 -0.001 0.000 2.384 2096 D HA 0.046 4.686 4.640 0.000 0.000 0.244 2096 D C 1.021 177.320 176.300 -0.001 0.000 1.251 2096 D CA -0.115 53.885 54.000 -0.001 0.000 0.961 2096 D CB 1.275 42.077 40.800 0.002 0.000 1.116 2096 D HN 0.704 nan 8.370 nan 0.000 0.484 2097 D N -0.479 119.921 120.400 -0.001 0.000 2.263 2097 D HA -0.116 4.524 4.640 0.000 0.000 0.208 2097 D C 1.530 177.831 176.300 0.001 0.000 0.971 2097 D CA 0.832 54.832 54.000 -0.001 0.000 0.867 2097 D CB 0.116 40.916 40.800 -0.001 0.000 0.929 2097 D HN 0.118 nan 8.370 nan 0.000 0.492 2098 L N -1.169 120.055 121.223 0.002 0.000 2.509 2098 L HA 0.344 4.684 4.340 0.000 0.000 0.222 2098 L C 2.047 178.920 176.870 0.005 0.000 1.123 2098 L CA 0.997 55.839 54.840 0.003 0.000 0.856 2098 L CB 0.134 42.196 42.059 0.004 0.000 0.985 2098 L HN 0.268 nan 8.230 nan 0.000 0.456 2099 G N -1.539 107.263 108.800 0.004 0.000 2.201 2099 G HA2 -0.248 3.712 3.960 0.000 0.000 0.212 2099 G HA3 -0.248 3.712 3.960 0.000 0.000 0.212 2099 G C 0.281 175.187 174.900 0.009 0.000 0.994 2099 G CA 0.069 45.172 45.100 0.006 0.000 0.644 2099 G HN 0.317 nan 8.290 nan 0.000 0.508 2100 D N 1.194 121.600 120.400 0.011 0.000 2.487 2100 D HA 0.355 4.995 4.640 0.000 0.000 0.243 2100 D C 0.459 176.770 176.300 0.017 0.000 1.154 2100 D CA 0.390 54.401 54.000 0.018 0.000 0.876 2100 D CB 1.057 41.867 40.800 0.017 0.000 1.161 2100 D HN 0.257 nan 8.370 nan 0.000 0.478 2101 V N 4.938 124.868 119.914 0.027 0.000 2.398 2101 V HA 0.378 4.498 4.120 0.000 0.000 0.286 2101 V C 0.114 176.223 176.094 0.026 0.000 1.026 2101 V CA -0.827 61.481 62.300 0.014 0.000 0.868 2101 V CB 1.685 33.509 31.823 0.002 0.000 0.982 2101 V HN 0.401 nan 8.190 nan 0.000 0.443 2102 V N 6.413 126.329 119.914 0.004 0.000 2.656 2102 V HA 0.675 4.795 4.120 0.000 0.000 0.307 2102 V C -0.775 175.304 176.094 -0.025 0.000 1.051 2102 V CA -0.294 62.011 62.300 0.009 0.000 0.893 2102 V CB 2.341 34.173 31.823 0.016 0.000 0.999 2102 V HN 0.622 nan 8.190 nan 0.000 0.426 2103 V N 5.812 125.703 119.914 -0.038 0.000 2.409 2103 V HA 0.781 4.901 4.120 0.000 0.000 0.291 2103 V C 0.014 176.095 176.094 -0.021 0.000 1.020 2103 V CA -0.086 62.181 62.300 -0.054 0.000 0.848 2103 V CB 1.555 33.313 31.823 -0.108 0.000 0.990 2103 V HN 1.038 nan 8.190 nan 0.000 0.430 2104 T N 2.547 117.090 114.554 -0.018 0.000 2.802 2104 T HA 0.323 4.673 4.350 0.000 0.000 0.311 2104 T C 0.080 174.773 174.700 -0.012 0.000 1.405 2104 T CA -0.378 61.717 62.100 -0.008 0.000 1.016 2104 T CB 2.029 70.896 68.868 -0.002 0.000 1.352 2104 T HN 0.661 nan 8.240 nan 0.000 0.498 2105 N N 1.182 119.877 118.700 -0.008 0.000 2.210 2105 N HA 0.074 4.814 4.740 0.000 0.000 0.203 2105 N C -0.314 175.191 175.510 -0.008 0.000 1.175 2105 N CA -0.006 53.038 53.050 -0.010 0.000 0.894 2105 N CB 0.476 38.959 38.487 -0.008 0.000 1.041 2105 N HN 0.691 nan 8.380 nan 0.000 0.506 2106 D N -0.057 120.340 120.400 -0.005 0.000 2.371 2106 D HA 0.202 4.842 4.640 0.000 0.000 0.256 2106 D C 1.485 177.781 176.300 -0.007 0.000 1.193 2106 D CA 0.206 54.204 54.000 -0.004 0.000 0.881 2106 D CB 1.038 41.838 40.800 -0.001 0.000 1.143 2106 D HN 0.263 nan 8.370 nan 0.000 0.473 2107 G N 2.653 111.448 108.800 -0.008 0.000 2.440 2107 G HA2 -0.246 3.714 3.960 0.000 0.000 0.218 2107 G HA3 -0.246 3.714 3.960 0.000 0.000 0.218 2107 G C 1.532 176.427 174.900 -0.008 0.000 1.154 2107 G CA 0.758 45.852 45.100 -0.010 0.000 0.767 2107 G HN 0.490 nan 8.290 nan 0.000 0.552 2108 V N 0.839 120.750 119.914 -0.005 0.000 2.261 2108 V HA -0.185 3.935 4.120 0.000 0.000 0.246 2108 V C 3.185 179.277 176.094 -0.004 0.000 1.047 2108 V CA 2.422 64.719 62.300 -0.004 0.000 1.015 2108 V CB -0.913 30.908 31.823 -0.002 0.000 0.642 2108 V HN 0.408 nan 8.190 nan 0.000 0.446 2109 T N 0.310 114.862 114.554 -0.003 0.000 2.684 2109 T HA -0.169 4.181 4.350 0.000 0.000 0.267 2109 T C 1.805 176.502 174.700 -0.005 0.000 1.036 2109 T CA 1.917 64.016 62.100 -0.002 0.000 1.148 2109 T CB -0.315 68.553 68.868 -0.000 0.000 0.863 2109 T HN 0.339 nan 8.240 nan 0.000 0.436 2110 I N 0.319 120.885 120.570 -0.007 0.000 2.179 2110 I HA -0.148 4.022 4.170 0.000 0.000 0.242 2110 I C 2.100 178.209 176.117 -0.012 0.000 1.088 2110 I CA 1.000 62.294 61.300 -0.011 0.000 1.357 2110 I CB -0.281 37.711 38.000 -0.013 0.000 1.051 2110 I HN 0.160 nan 8.210 nan 0.000 0.409 2111 L N 0.113 121.329 121.223 -0.010 0.000 2.109 2111 L HA -0.089 4.251 4.340 0.000 0.000 0.207 2111 L C 2.501 179.366 176.870 -0.008 0.000 1.086 2111 L CA 1.505 56.338 54.840 -0.011 0.000 0.760 2111 L CB -0.945 41.109 42.059 -0.008 0.000 0.910 2111 L HN 0.147 nan 8.230 nan 0.000 0.437 2112 R N -0.142 120.354 120.500 -0.006 0.000 2.075 2112 R HA -0.107 4.233 4.340 0.000 0.000 0.232 2112 R C 1.891 178.188 176.300 -0.005 0.000 1.126 2112 R CA 1.237 57.335 56.100 -0.004 0.000 0.963 2112 R CB 0.093 30.392 30.300 -0.002 0.000 0.858 2112 R HN 0.337 nan 8.270 nan 0.000 0.435 2113 E N 0.886 121.082 120.200 -0.006 0.000 2.086 2113 E HA -0.052 4.298 4.350 0.000 0.000 0.190 2113 E C 1.282 177.876 176.600 -0.009 0.000 0.975 2113 E CA 0.467 56.864 56.400 -0.006 0.000 0.813 2113 E CB -0.358 29.339 29.700 -0.004 0.000 0.768 2113 E HN 0.448 nan 8.360 nan 0.000 0.457 2114 M N -0.022 119.570 119.600 -0.013 0.000 2.240 2114 M HA 0.102 4.582 4.480 0.000 0.000 0.317 2114 M C 0.499 176.787 176.300 -0.020 0.000 1.087 2114 M CA 0.331 55.620 55.300 -0.018 0.000 1.176 2114 M CB 0.570 33.156 32.600 -0.024 0.000 1.439 2114 M HN -0.260 nan 8.290 nan 0.000 0.452 2115 S N 2.317 118.002 115.700 -0.025 0.000 2.473 2115 S HA 0.430 4.900 4.470 0.000 0.000 0.312 2115 S C -0.652 173.924 174.600 -0.041 0.000 1.087 2115 S CA -0.801 57.384 58.200 -0.026 0.000 1.077 2115 S CB -0.237 62.950 63.200 -0.022 0.000 1.065 2115 S HN 0.521 nan 8.310 nan 0.000 0.510 2116 V N 5.071 124.963 119.914 -0.036 0.000 2.546 2116 V HA 0.332 4.452 4.120 0.000 0.000 0.284 2116 V C 1.118 177.188 176.094 -0.041 0.000 1.050 2116 V CA -0.228 62.041 62.300 -0.051 0.000 0.981 2116 V CB 1.511 33.316 31.823 -0.031 0.000 0.990 2116 V HN 0.913 nan 8.190 nan 0.000 0.474 2117 E N 2.479 122.634 120.200 -0.076 0.000 2.256 2117 E HA 0.075 4.425 4.350 0.000 0.000 0.198 2117 E C 0.580 177.228 176.600 0.080 0.000 0.908 2117 E CA 0.435 56.824 56.400 -0.019 0.000 0.915 2117 E CB 0.121 29.793 29.700 -0.046 0.000 0.890 2117 E HN 0.821 nan 8.360 nan 0.000 0.484 2118 H N 1.020 120.076 119.070 -0.023 0.000 2.848 2118 H HA 0.065 4.621 4.556 -0.000 0.000 0.317 2118 H C -1.753 173.554 175.328 -0.035 0.000 1.046 2118 H CA -1.629 54.391 56.048 -0.046 0.000 1.470 2118 H CB 1.367 31.088 29.762 -0.069 0.000 1.483 2118 H HN 0.156 nan 8.280 nan 0.000 0.548 2119 P HA -0.200 nan 4.420 nan 0.000 0.215 2119 P C 1.266 178.581 177.300 0.024 0.000 1.153 2119 P CA 1.502 64.624 63.100 0.036 0.000 0.853 2119 P CB 0.215 31.925 31.700 0.018 0.000 0.788 2120 A N -0.022 122.802 122.820 0.007 0.000 1.930 2120 A HA -0.073 4.247 4.320 0.000 0.000 0.217 2120 A C 2.315 179.914 177.584 0.024 0.000 1.175 2120 A CA 1.932 53.970 52.037 0.001 0.000 0.627 2120 A CB -1.566 17.415 19.000 -0.032 0.000 0.815 2120 A HN 0.188 nan 8.150 nan 0.000 0.443 2121 A N 0.075 122.926 122.820 0.052 0.000 1.933 2121 A HA -0.163 4.157 4.320 0.000 0.000 0.218 2121 A C 2.052 179.650 177.584 0.023 0.000 1.175 2121 A CA 1.754 53.815 52.037 0.041 0.000 0.628 2121 A CB -0.424 18.604 19.000 0.047 0.000 0.814 2121 A HN 0.553 nan 8.150 nan 0.000 0.444 2122 K N -0.954 119.462 120.400 0.026 0.000 2.209 2122 K HA -0.055 4.265 4.320 0.000 0.000 0.204 2122 K C 1.820 178.429 176.600 0.015 0.000 1.048 2122 K CA 1.208 57.505 56.287 0.017 0.000 0.940 2122 K CB -0.189 32.323 32.500 0.020 0.000 0.729 2122 K HN 0.387 nan 8.250 nan 0.000 0.451 2123 M N 0.377 119.987 119.600 0.016 0.000 2.236 2123 M HA -0.041 4.439 4.480 0.000 0.000 0.266 2123 M C 2.177 178.486 176.300 0.014 0.000 1.070 2123 M CA 1.138 56.447 55.300 0.015 0.000 1.137 2123 M CB -0.663 31.946 32.600 0.015 0.000 1.378 2123 M HN 0.176 nan 8.290 nan 0.000 0.426 2124 L N 0.327 121.558 121.223 0.014 0.000 2.131 2124 L HA -0.196 4.144 4.340 0.000 0.000 0.210 2124 L C 2.249 179.124 176.870 0.008 0.000 1.092 2124 L CA 0.884 55.731 54.840 0.012 0.000 0.759 2124 L CB -0.219 41.846 42.059 0.011 0.000 0.903 2124 L HN 0.187 nan 8.230 nan 0.000 0.435 2125 I N -0.240 120.334 120.570 0.007 0.000 2.248 2125 I HA -0.350 3.820 4.170 0.000 0.000 0.248 2125 I C 2.376 178.496 176.117 0.005 0.000 1.107 2125 I CA 1.330 62.633 61.300 0.004 0.000 1.373 2125 I CB -0.212 37.790 38.000 0.003 0.000 1.055 2125 I HN 0.305 nan 8.210 nan 0.000 0.418 2126 E N 0.599 120.803 120.200 0.007 0.000 2.153 2126 E HA -0.153 4.197 4.350 0.000 0.000 0.194 2126 E C 2.135 178.740 176.600 0.008 0.000 0.988 2126 E CA 0.963 57.368 56.400 0.008 0.000 0.811 2126 E CB 0.003 29.709 29.700 0.010 0.000 0.746 2126 E HN 0.265 nan 8.360 nan 0.000 0.466 2127 V N 0.557 120.476 119.914 0.009 0.000 2.295 2127 V HA -0.287 3.833 4.120 0.000 0.000 0.246 2127 V C 2.304 178.400 176.094 0.004 0.000 1.049 2127 V CA 1.891 64.197 62.300 0.009 0.000 1.024 2127 V CB -0.894 30.935 31.823 0.010 0.000 0.648 2127 V HN 0.444 nan 8.190 nan 0.000 0.447 2128 A N -0.494 122.328 122.820 0.002 0.000 1.972 2128 A HA -0.220 4.100 4.320 0.000 0.000 0.219 2128 A C 2.280 179.864 177.584 0.000 0.000 1.169 2128 A CA 1.844 53.881 52.037 -0.001 0.000 0.635 2128 A CB -0.403 18.596 19.000 -0.002 0.000 0.810 2128 A HN 0.557 nan 8.150 nan 0.000 0.446 2129 K N -0.534 119.867 120.400 0.002 0.000 2.097 2129 K HA -0.101 4.219 4.320 0.000 0.000 0.205 2129 K C 2.188 178.789 176.600 0.002 0.000 1.050 2129 K CA 1.726 58.014 56.287 0.002 0.000 0.938 2129 K CB -0.304 32.198 32.500 0.003 0.000 0.718 2129 K HN 0.729 nan 8.250 nan 0.000 0.442 2130 T N -1.303 113.254 114.554 0.004 0.000 2.951 2130 T HA -0.138 4.213 4.350 0.000 0.000 0.268 2130 T C 1.985 176.687 174.700 0.003 0.000 1.073 2130 T CA 0.816 62.918 62.100 0.004 0.000 1.134 2130 T CB -0.001 68.870 68.868 0.006 0.000 0.884 2130 T HN 0.034 nan 8.240 nan 0.000 0.479 2131 Q N 1.210 121.011 119.800 0.002 0.000 2.079 2131 Q HA -0.068 4.272 4.340 0.000 0.000 0.200 2131 Q C 2.439 178.439 176.000 0.001 0.000 0.974 2131 Q CA 1.452 57.256 55.803 0.001 0.000 0.840 2131 Q CB -0.398 28.340 28.738 -0.000 0.000 0.898 2131 Q HN 0.523 nan 8.270 nan 0.000 0.430 2132 E N -0.085 120.115 120.200 0.000 0.000 2.085 2132 E HA -0.205 4.145 4.350 0.000 0.000 0.194 2132 E C 1.614 178.214 176.600 -0.000 0.000 0.994 2132 E CA 1.151 57.550 56.400 -0.000 0.000 0.801 2132 E CB 0.157 29.857 29.700 -0.001 0.000 0.743 2132 E HN 0.233 nan 8.360 nan 0.000 0.453 2133 K N 0.379 120.779 120.400 0.000 0.000 2.031 2133 K HA -0.133 4.187 4.320 0.000 0.000 0.205 2133 K C 2.129 178.729 176.600 0.000 0.000 1.049 2133 K CA 1.072 57.359 56.287 -0.000 0.000 0.939 2133 K CB -0.281 32.220 32.500 0.000 0.000 0.717 2133 K HN 0.051 nan 8.250 nan 0.000 0.438 2134 E N 0.838 121.039 120.200 0.001 0.000 2.076 2134 E HA -0.107 4.243 4.350 0.000 0.000 0.190 2134 E C 1.719 178.320 176.600 0.001 0.000 0.979 2134 E CA 1.299 57.700 56.400 0.001 0.000 0.807 2134 E CB 0.285 29.987 29.700 0.002 0.000 0.761 2134 E HN 0.089 nan 8.360 nan 0.000 0.454 2135 V N -4.934 114.981 119.914 0.001 0.000 3.473 2135 V HA 0.584 4.704 4.120 0.000 0.000 0.253 2135 V C 1.484 177.579 176.094 0.001 0.000 1.340 2135 V CA 0.849 63.150 62.300 0.001 0.000 1.103 2135 V CB 0.450 32.274 31.823 0.002 0.000 0.881 2135 V HN 0.340 nan 8.190 nan 0.000 0.451 2136 G N 0.687 109.487 108.800 0.000 0.000 3.586 2136 G HA2 -0.265 3.695 3.960 0.000 0.000 0.212 2136 G HA3 -0.265 3.695 3.960 0.000 0.000 0.212 2136 G C 0.166 175.067 174.900 0.001 0.000 1.411 2136 G CA 0.468 45.569 45.100 0.000 0.000 0.898 2136 G HN 0.654 nan 8.290 nan 0.000 0.575 2137 D N 1.167 121.569 120.400 0.002 0.000 2.478 2137 D HA 0.480 5.120 4.640 0.000 0.000 0.269 2137 D C 1.538 177.838 176.300 0.000 0.000 1.232 2137 D CA 1.219 55.220 54.000 0.002 0.000 1.059 2137 D CB 0.616 41.419 40.800 0.005 0.000 1.104 2137 D HN 1.611 nan 8.370 nan 0.000 0.566 2138 G N -0.344 108.456 108.800 -0.001 0.000 2.153 2138 G HA2 -0.326 3.634 3.960 0.000 0.000 0.252 2138 G HA3 -0.326 3.634 3.960 0.000 0.000 0.252 2138 G C 1.037 175.932 174.900 -0.008 0.000 0.994 2138 G CA 1.516 46.613 45.100 -0.005 0.000 0.698 2138 G HN 0.584 nan 8.290 nan 0.000 0.521 2139 T N -2.947 111.604 114.554 -0.006 0.000 2.746 2139 T HA -0.113 4.237 4.350 0.000 0.000 0.267 2139 T C 2.215 176.909 174.700 -0.010 0.000 1.039 2139 T CA 2.421 64.517 62.100 -0.007 0.000 1.142 2139 T CB -0.565 68.300 68.868 -0.005 0.000 0.866 2139 T HN 0.308 nan 8.240 nan 0.000 0.444 2140 T N 2.007 116.554 114.554 -0.013 0.000 2.737 2140 T HA -0.087 4.263 4.350 0.000 0.000 0.265 2140 T C 2.280 176.967 174.700 -0.022 0.000 1.038 2140 T CA 1.817 63.907 62.100 -0.017 0.000 1.144 2140 T CB -0.989 67.868 68.868 -0.019 0.000 0.866 2140 T HN 0.518 nan 8.240 nan 0.000 0.434 2141 T N 2.233 116.774 114.554 -0.022 0.000 2.665 2141 T HA -0.136 4.214 4.350 0.000 0.000 0.268 2141 T C 2.371 177.052 174.700 -0.032 0.000 1.035 2141 T CA 1.335 63.418 62.100 -0.029 0.000 1.151 2141 T CB -0.631 68.222 68.868 -0.025 0.000 0.862 2141 T HN 0.447 nan 8.240 nan 0.000 0.438 2142 A N 0.759 123.565 122.820 -0.023 0.000 1.940 2142 A HA -0.057 4.263 4.320 0.000 0.000 0.219 2142 A C 2.592 180.162 177.584 -0.023 0.000 1.176 2142 A CA 1.456 53.480 52.037 -0.021 0.000 0.631 2142 A CB -0.910 18.084 19.000 -0.011 0.000 0.814 2142 A HN 0.386 nan 8.150 nan 0.000 0.446 2143 V N -0.653 119.248 119.914 -0.020 0.000 2.379 2143 V HA -0.178 3.942 4.120 0.000 0.000 0.245 2143 V C 2.552 178.629 176.094 -0.028 0.000 1.044 2143 V CA 1.734 64.023 62.300 -0.019 0.000 1.036 2143 V CB -0.629 31.185 31.823 -0.015 0.000 0.664 2143 V HN 0.363 nan 8.190 nan 0.000 0.453 2144 V N -0.449 119.444 119.914 -0.034 0.000 2.295 2144 V HA -0.218 3.902 4.120 0.000 0.000 0.246 2144 V C 2.465 178.523 176.094 -0.059 0.000 1.049 2144 V CA 2.128 64.403 62.300 -0.043 0.000 1.024 2144 V CB -0.376 31.420 31.823 -0.044 0.000 0.648 2144 V HN 0.425 nan 8.190 nan 0.000 0.447 2145 V N -0.018 119.852 119.914 -0.072 0.000 2.515 2145 V HA -0.183 3.937 4.120 0.000 0.000 0.250 2145 V C 2.526 178.549 176.094 -0.118 0.000 1.058 2145 V CA 1.998 64.231 62.300 -0.112 0.000 1.064 2145 V CB -0.278 31.471 31.823 -0.124 0.000 0.675 2145 V HN 0.522 nan 8.190 nan 0.000 0.461 2146 A N -0.136 122.641 122.820 -0.071 0.000 1.898 2146 A HA 0.003 4.323 4.320 0.000 0.000 0.216 2146 A C 2.342 179.910 177.584 -0.027 0.000 1.181 2146 A CA 1.704 53.717 52.037 -0.041 0.000 0.620 2146 A CB -1.233 17.760 19.000 -0.012 0.000 0.819 2146 A HN 0.600 nan 8.150 nan 0.000 0.442 2147 G N -0.495 108.288 108.800 -0.029 0.000 2.408 2147 G HA2 -0.202 3.758 3.960 0.000 0.000 0.217 2147 G HA3 -0.202 3.758 3.960 0.000 0.000 0.217 2147 G C 1.461 176.347 174.900 -0.024 0.000 1.150 2147 G CA 1.285 46.375 45.100 -0.018 0.000 0.776 2147 G HN 0.583 nan 8.290 nan 0.000 0.542 2148 E N 0.249 120.419 120.200 -0.051 0.000 2.107 2148 E HA 0.040 4.391 4.350 0.000 0.000 0.191 2148 E C 2.454 179.013 176.600 -0.067 0.000 0.982 2148 E CA 0.433 56.795 56.400 -0.063 0.000 0.809 2148 E CB -0.350 29.294 29.700 -0.093 0.000 0.756 2148 E HN 0.416 nan 8.360 nan 0.000 0.459 2149 L N 0.031 121.194 121.223 -0.100 0.000 2.083 2149 L HA -0.159 4.181 4.340 0.000 0.000 0.209 2149 L C 2.371 179.304 176.870 0.104 0.000 1.083 2149 L CA 0.946 55.728 54.840 -0.096 0.000 0.752 2149 L CB -0.335 41.618 42.059 -0.176 0.000 0.899 2149 L HN 0.249 nan 8.230 nan 0.000 0.433 2150 L N -0.864 120.406 121.223 0.077 0.000 2.156 2150 L HA -0.166 4.174 4.340 0.000 0.000 0.208 2150 L C 2.731 179.638 176.870 0.061 0.000 1.095 2150 L CA 0.609 55.502 54.840 0.088 0.000 0.770 2150 L CB -0.386 41.703 42.059 0.049 0.000 0.914 2150 L HN 0.202 nan 8.230 nan 0.000 0.439 2151 R N 0.902 121.422 120.500 0.034 0.000 2.081 2151 R HA -0.169 4.171 4.340 0.000 0.000 0.235 2151 R C 2.116 178.440 176.300 0.040 0.000 1.131 2151 R CA 1.593 57.707 56.100 0.023 0.000 0.960 2151 R CB -0.098 30.204 30.300 0.003 0.000 0.856 2151 R HN 0.008 nan 8.270 nan 0.000 0.436 2152 K N -0.236 120.199 120.400 0.059 0.000 2.155 2152 K HA 0.144 4.464 4.320 0.000 0.000 0.203 2152 K C 1.816 178.501 176.600 0.141 0.000 1.052 2152 K CA 1.303 57.644 56.287 0.090 0.000 0.948 2152 K CB -0.282 32.270 32.500 0.088 0.000 0.728 2152 K HN 0.291 nan 8.250 nan 0.000 0.448 2153 A N 0.752 123.684 122.820 0.187 0.000 1.902 2153 A HA -0.218 4.102 4.320 0.000 0.000 0.217 2153 A C 2.123 179.732 177.584 0.042 0.000 1.181 2153 A CA 1.810 53.929 52.037 0.137 0.000 0.623 2153 A CB -0.480 18.608 19.000 0.148 0.000 0.818 2153 A HN 0.442 nan 8.150 nan 0.000 0.443 2154 E N -0.322 119.901 120.200 0.039 0.000 2.110 2154 E HA -0.215 4.135 4.350 0.000 0.000 0.193 2154 E C 1.723 178.330 176.600 0.012 0.000 0.988 2154 E CA 1.240 57.647 56.400 0.013 0.000 0.804 2154 E CB -0.056 29.650 29.700 0.010 0.000 0.745 2154 E HN 0.563 nan 8.360 nan 0.000 0.458 2155 E N 0.224 120.440 120.200 0.026 0.000 2.106 2155 E HA -0.160 4.190 4.350 0.000 0.000 0.192 2155 E C 2.088 178.701 176.600 0.022 0.000 0.984 2155 E CA 0.556 56.970 56.400 0.024 0.000 0.806 2155 E CB -0.072 29.646 29.700 0.031 0.000 0.750 2155 E HN 0.274 nan 8.360 nan 0.000 0.458 2156 L N 0.436 121.676 121.223 0.029 0.000 2.156 2156 L HA -0.086 4.254 4.340 0.000 0.000 0.208 2156 L C 2.383 179.249 176.870 -0.006 0.000 1.095 2156 L CA 1.049 55.901 54.840 0.020 0.000 0.770 2156 L CB -0.673 41.403 42.059 0.028 0.000 0.914 2156 L HN 0.084 nan 8.230 nan 0.000 0.439 2157 L N -0.962 120.249 121.223 -0.019 0.000 2.093 2157 L HA -0.187 4.153 4.340 0.000 0.000 0.208 2157 L C 1.980 178.836 176.870 -0.024 0.000 1.085 2157 L CA 0.910 55.729 54.840 -0.035 0.000 0.755 2157 L CB -0.525 41.509 42.059 -0.042 0.000 0.904 2157 L HN 0.232 nan 8.230 nan 0.000 0.435 2158 D N -0.569 119.824 120.400 -0.011 0.000 2.224 2158 D HA -0.133 4.507 4.640 0.000 0.000 0.205 2158 D C 2.017 178.316 176.300 -0.002 0.000 0.965 2158 D CA 0.803 54.800 54.000 -0.006 0.000 0.852 2158 D CB -0.029 40.771 40.800 -0.000 0.000 0.947 2158 D HN 0.262 nan 8.370 nan 0.000 0.494 2159 Q N 0.469 120.270 119.800 0.002 0.000 2.415 2159 Q HA -0.007 4.333 4.340 0.000 0.000 0.206 2159 Q C 0.047 176.050 176.000 0.005 0.000 0.946 2159 Q CA 0.010 55.818 55.803 0.007 0.000 0.951 2159 Q CB -0.158 28.589 28.738 0.015 0.000 1.026 2159 Q HN 0.176 nan 8.270 nan 0.000 0.510 2160 N N -0.339 118.360 118.700 -0.002 0.000 2.754 2160 N HA -0.155 4.585 4.740 0.000 0.000 0.248 2160 N C -1.366 174.148 175.510 0.007 0.000 1.093 2160 N CA 0.301 53.349 53.050 -0.002 0.000 0.699 2160 N CB -1.298 37.192 38.487 0.005 0.000 1.016 2160 N HN -0.029 nan 8.380 nan 0.000 0.552 2161 V N 2.113 122.027 119.914 0.001 0.000 2.385 2161 V HA 0.129 4.249 4.120 0.000 0.000 0.269 2161 V C 1.001 177.097 176.094 0.004 0.000 1.043 2161 V CA -0.799 61.509 62.300 0.014 0.000 0.906 2161 V CB 1.032 32.858 31.823 0.005 0.000 0.995 2161 V HN 0.347 nan 8.190 nan 0.000 0.467 2162 H N 8.246 127.299 119.070 -0.028 0.000 3.094 2162 H HA 0.017 4.573 4.556 0.000 0.000 0.320 2162 H C -1.667 173.633 175.328 -0.046 0.000 1.000 2162 H CA -1.055 54.975 56.048 -0.030 0.000 1.413 2162 H CB 1.575 31.322 29.762 -0.025 0.000 1.405 2162 H HN 0.385 nan 8.280 nan 0.000 0.586 2163 P HA -0.187 nan 4.420 nan 0.000 0.217 2163 P C 1.428 178.749 177.300 0.035 0.000 1.148 2163 P CA 2.565 65.597 63.100 -0.113 0.000 0.834 2163 P CB 0.025 31.619 31.700 -0.178 0.000 0.783 2164 T N -4.241 110.475 114.554 0.269 0.000 2.995 2164 T HA -0.034 4.316 4.350 0.000 0.000 0.269 2164 T C 1.702 176.436 174.700 0.056 0.000 1.091 2164 T CA 0.652 62.839 62.100 0.146 0.000 1.128 2164 T CB -0.753 68.188 68.868 0.122 0.000 0.891 2164 T HN -0.082 nan 8.240 nan 0.000 0.492 2165 I N 1.195 121.808 120.570 0.072 0.000 2.333 2165 I HA 0.010 4.180 4.170 0.000 0.000 0.246 2165 I C 2.657 178.747 176.117 -0.044 0.000 1.106 2165 I CA 0.502 61.810 61.300 0.014 0.000 1.411 2165 I CB -1.104 36.916 38.000 0.033 0.000 1.082 2165 I HN 0.175 nan 8.210 nan 0.000 0.420 2166 V N 1.547 121.400 119.914 -0.102 0.000 2.295 2166 V HA -0.219 3.901 4.120 0.000 0.000 0.246 2166 V C 2.731 178.569 176.094 -0.426 0.000 1.049 2166 V CA 1.992 64.115 62.300 -0.295 0.000 1.024 2166 V CB -0.801 30.827 31.823 -0.326 0.000 0.648 2166 V HN 0.414 nan 8.190 nan 0.000 0.447 2167 V N -0.890 118.888 119.914 -0.226 0.000 2.667 2167 V HA -0.105 4.015 4.120 0.000 0.000 0.252 2167 V C 2.360 178.436 176.094 -0.030 0.000 1.065 2167 V CA 2.114 64.341 62.300 -0.123 0.000 1.083 2167 V CB -0.684 31.108 31.823 -0.053 0.000 0.692 2167 V HN 0.493 nan 8.190 nan 0.000 0.468 2168 K N 2.233 122.617 120.400 -0.027 0.000 2.025 2168 K HA 0.098 4.418 4.320 0.000 0.000 0.207 2168 K C 2.136 178.754 176.600 0.029 0.000 1.049 2168 K CA 2.080 58.370 56.287 0.004 0.000 0.933 2168 K CB -1.325 31.174 32.500 -0.001 0.000 0.714 2168 K HN 0.435 nan 8.250 nan 0.000 0.438 2169 G N -0.746 108.078 108.800 0.041 0.000 2.422 2169 G HA2 -0.216 3.744 3.960 0.000 0.000 0.218 2169 G HA3 -0.216 3.744 3.960 0.000 0.000 0.218 2169 G C 1.170 176.173 174.900 0.172 0.000 1.146 2169 G CA 0.829 45.999 45.100 0.117 0.000 0.769 2169 G HN 0.290 nan 8.290 nan 0.000 0.547 2170 Y N 0.313 120.564 120.300 -0.083 0.000 2.314 2170 Y HA -0.015 4.535 4.550 0.000 0.000 0.293 2170 Y C 2.861 178.582 175.900 -0.298 0.000 1.129 2170 Y CA 0.899 58.877 58.100 -0.202 0.000 1.201 2170 Y CB -0.788 37.714 38.460 0.070 0.000 0.999 2170 Y HN 0.260 nan 8.280 nan 0.000 0.541 2171 Q N 0.383 120.204 119.800 0.035 0.000 2.079 2171 Q HA -0.056 4.284 4.340 0.000 0.000 0.200 2171 Q C 2.357 178.310 176.000 -0.077 0.000 0.974 2171 Q CA 1.754 57.548 55.803 -0.015 0.000 0.840 2171 Q CB -0.474 28.273 28.738 0.015 0.000 0.898 2171 Q HN 0.325 nan 8.270 nan 0.000 0.430 2172 A N 0.251 123.046 122.820 -0.041 0.000 1.873 2172 A HA -0.003 4.317 4.320 0.000 0.000 0.215 2172 A C 2.271 179.788 177.584 -0.111 0.000 1.186 2172 A CA 1.869 53.912 52.037 0.010 0.000 0.616 2172 A CB -1.142 17.942 19.000 0.141 0.000 0.823 2172 A HN 0.498 nan 8.150 nan 0.000 0.442 2173 A N -0.342 122.316 122.820 -0.270 0.000 1.930 2173 A HA 0.249 4.569 4.320 0.000 0.000 0.217 2173 A C 2.443 179.621 177.584 -0.676 0.000 1.175 2173 A CA 1.818 53.539 52.037 -0.526 0.000 0.627 2173 A CB -0.842 17.681 19.000 -0.796 0.000 0.815 2173 A HN 0.990 nan 8.150 nan 0.000 0.443 2174 A N -1.151 121.224 122.820 -0.741 0.000 1.930 2174 A HA -0.123 4.197 4.320 0.000 0.000 0.217 2174 A C 2.092 179.580 177.584 -0.160 0.000 1.175 2174 A CA 1.444 53.296 52.037 -0.309 0.000 0.627 2174 A CB -0.377 18.532 19.000 -0.152 0.000 0.815 2174 A HN 0.461 nan 8.150 nan 0.000 0.443 2175 Q N -0.295 119.399 119.800 -0.175 0.000 2.124 2175 Q HA -0.167 4.173 4.340 0.000 0.000 0.202 2175 Q C 2.003 177.901 176.000 -0.170 0.000 0.977 2175 Q CA 1.816 57.543 55.803 -0.126 0.000 0.850 2175 Q CB -0.301 28.383 28.738 -0.091 0.000 0.901 2175 Q HN 0.619 nan 8.270 nan 0.000 0.429 2176 K N 0.888 121.109 120.400 -0.298 0.000 2.103 2176 K HA 0.029 4.349 4.320 0.000 0.000 0.204 2176 K C 1.843 178.316 176.600 -0.211 0.000 1.052 2176 K CA 1.174 57.236 56.287 -0.376 0.000 0.945 2176 K CB -0.413 31.593 32.500 -0.824 0.000 0.722 2176 K HN 0.111 nan 8.250 nan 0.000 0.443 2177 A N 0.355 123.085 122.820 -0.150 0.000 1.933 2177 A HA -0.207 4.114 4.320 0.000 0.000 0.218 2177 A C 2.150 179.718 177.584 -0.025 0.000 1.175 2177 A CA 1.844 53.861 52.037 -0.033 0.000 0.628 2177 A CB -0.652 18.399 19.000 0.086 0.000 0.814 2177 A HN 0.456 nan 8.150 nan 0.000 0.444 2178 Q N 0.096 119.872 119.800 -0.040 0.000 2.084 2178 Q HA -0.183 4.157 4.340 0.000 0.000 0.202 2178 Q C 1.951 177.932 176.000 -0.032 0.000 0.978 2178 Q CA 2.251 58.038 55.803 -0.027 0.000 0.844 2178 Q CB -0.352 28.369 28.738 -0.028 0.000 0.898 2178 Q HN 0.763 nan 8.270 nan 0.000 0.426 2179 E N -0.590 119.578 120.200 -0.053 0.000 2.077 2179 E HA -0.170 4.180 4.350 0.000 0.000 0.193 2179 E C 1.903 178.482 176.600 -0.034 0.000 0.989 2179 E CA 1.115 57.487 56.400 -0.045 0.000 0.800 2179 E CB -0.151 29.510 29.700 -0.064 0.000 0.746 2179 E HN 0.452 nan 8.360 nan 0.000 0.452 2180 L N 0.584 121.783 121.223 -0.041 0.000 2.083 2180 L HA -0.189 4.151 4.340 0.000 0.000 0.209 2180 L C 2.548 179.416 176.870 -0.003 0.000 1.083 2180 L CA 0.710 55.538 54.840 -0.020 0.000 0.752 2180 L CB -0.300 41.747 42.059 -0.021 0.000 0.899 2180 L HN 0.258 nan 8.230 nan 0.000 0.433 2181 L N -0.390 120.830 121.223 -0.005 0.000 2.056 2181 L HA -0.202 4.138 4.340 0.000 0.000 0.207 2181 L C 2.528 179.399 176.870 0.002 0.000 1.078 2181 L CA 1.357 56.199 54.840 0.003 0.000 0.749 2181 L CB -0.389 41.672 42.059 0.002 0.000 0.901 2181 L HN 0.198 nan 8.230 nan 0.000 0.433 2182 K N -0.885 119.513 120.400 -0.003 0.000 2.362 2182 K HA -0.073 4.247 4.320 0.000 0.000 0.200 2182 K C 1.856 178.455 176.600 -0.001 0.000 1.046 2182 K CA 1.253 57.539 56.287 -0.002 0.000 0.952 2182 K CB -0.059 32.437 32.500 -0.006 0.000 0.753 2182 K HN 0.284 nan 8.250 nan 0.000 0.466 2183 T N 1.274 115.828 114.554 -0.000 0.000 3.035 2183 T HA 0.046 4.396 4.350 0.000 0.000 0.259 2183 T C 1.736 176.440 174.700 0.007 0.000 1.078 2183 T CA 0.569 62.670 62.100 0.002 0.000 1.132 2183 T CB 0.070 68.938 68.868 0.001 0.000 0.900 2183 T HN 0.347 nan 8.240 nan 0.000 0.480 2184 I N -0.861 119.716 120.570 0.012 0.000 3.968 2184 I HA 0.536 4.706 4.170 0.000 0.000 0.328 2184 I C 0.941 177.067 176.117 0.015 0.000 1.290 2184 I CA -0.673 60.638 61.300 0.018 0.000 1.163 2184 I CB -0.254 37.766 38.000 0.033 0.000 1.024 2184 I HN -0.095 nan 8.210 nan 0.000 0.413 2185 A N 1.597 124.424 122.820 0.011 0.000 2.546 2185 A HA 0.129 4.449 4.320 0.000 0.000 0.243 2185 A C 0.083 177.671 177.584 0.007 0.000 1.063 2185 A CA 0.032 52.074 52.037 0.009 0.000 0.757 2185 A CB -0.244 18.759 19.000 0.006 0.000 0.991 2185 A HN 0.640 nan 8.150 nan 0.000 0.503 2186 C N 3.666 122.970 119.300 0.008 0.000 2.255 2186 C HA 0.539 4.999 4.460 0.000 0.000 0.326 2186 C C 0.356 175.349 174.990 0.005 0.000 1.258 2186 C CA -0.641 58.381 59.018 0.006 0.000 1.676 2186 C CB -0.349 27.396 27.740 0.008 0.000 2.314 2186 C HN 0.941 nan 8.230 nan 0.000 0.509 2187 E N 3.681 123.883 120.200 0.004 0.000 2.351 2187 E HA 0.405 4.755 4.350 0.000 0.000 0.266 2187 E C -0.092 176.509 176.600 0.003 0.000 1.031 2187 E CA 0.229 56.631 56.400 0.003 0.000 0.911 2187 E CB 0.643 30.344 29.700 0.002 0.000 0.986 2187 E HN 0.712 nan 8.360 nan 0.000 0.446 2188 V N 1.474 121.390 119.914 0.003 0.000 3.102 2188 V HA 0.840 4.960 4.120 0.000 0.000 0.312 2188 V C 0.515 176.610 176.094 0.003 0.000 1.135 2188 V CA -0.793 61.508 62.300 0.003 0.000 1.022 2188 V CB 1.645 33.470 31.823 0.003 0.000 1.056 2188 V HN 0.672 nan 8.190 nan 0.000 0.436 2189 G N 0.419 109.221 108.800 0.002 0.000 2.343 2189 G HA2 0.463 4.424 3.960 0.000 0.000 0.254 2189 G HA3 0.463 4.424 3.960 0.000 0.000 0.254 2189 G C 0.995 175.896 174.900 0.003 0.000 1.277 2189 G CA 0.193 45.294 45.100 0.003 0.000 0.909 2189 G HN 1.670 nan 8.290 nan 0.000 0.502 2190 A N 2.140 124.962 122.820 0.003 0.000 1.940 2190 A HA -0.124 4.197 4.320 0.000 0.000 0.219 2190 A C 1.930 179.516 177.584 0.004 0.000 1.176 2190 A CA 1.856 53.895 52.037 0.004 0.000 0.631 2190 A CB -0.069 18.934 19.000 0.004 0.000 0.814 2190 A HN 0.641 nan 8.150 nan 0.000 0.446 2191 Q N -0.484 119.318 119.800 0.004 0.000 2.155 2191 Q HA 0.120 4.460 4.340 0.000 0.000 0.220 2191 Q C -0.829 175.173 176.000 0.003 0.000 0.819 2191 Q CA -0.267 55.539 55.803 0.004 0.000 1.032 2191 Q CB 0.183 28.924 28.738 0.006 0.000 1.151 2191 Q HN 0.579 nan 8.270 nan 0.000 0.487 2192 D N 1.012 121.414 120.400 0.003 0.000 2.412 2192 D HA -0.073 4.567 4.640 0.000 0.000 0.257 2192 D C 1.262 177.563 176.300 0.001 0.000 1.217 2192 D CA 0.223 54.224 54.000 0.002 0.000 0.897 2192 D CB 0.907 41.708 40.800 0.002 0.000 1.132 2192 D HN -0.030 nan 8.370 nan 0.000 0.493 2193 K N 3.485 123.886 120.400 0.001 0.000 2.032 2193 K HA -0.265 4.055 4.320 0.000 0.000 0.218 2193 K C 1.238 177.837 176.600 -0.001 0.000 1.054 2193 K CA 1.546 57.833 56.287 -0.000 0.000 0.941 2193 K CB -0.019 32.481 32.500 -0.000 0.000 0.720 2193 K HN 0.584 nan 8.250 nan 0.000 0.449 2194 E N 0.570 120.769 120.200 -0.002 0.000 2.023 2194 E HA -0.203 4.147 4.350 0.000 0.000 0.196 2194 E C 2.134 178.733 176.600 -0.003 0.000 1.003 2194 E CA 1.183 57.581 56.400 -0.003 0.000 0.809 2194 E CB -0.458 29.240 29.700 -0.003 0.000 0.755 2194 E HN 0.324 nan 8.360 nan 0.000 0.449 2195 I N 0.726 121.296 120.570 -0.001 0.000 2.493 2195 I HA -0.211 3.959 4.170 0.000 0.000 0.254 2195 I C 2.087 178.204 176.117 0.000 0.000 1.160 2195 I CA 0.637 61.937 61.300 -0.000 0.000 1.445 2195 I CB -0.094 37.907 38.000 0.001 0.000 1.086 2195 I HN 0.014 nan 8.210 nan 0.000 0.433 2196 L N -0.154 121.069 121.223 0.000 0.000 2.093 2196 L HA -0.161 4.179 4.340 0.000 0.000 0.208 2196 L C 2.469 179.338 176.870 -0.001 0.000 1.085 2196 L CA 1.925 56.765 54.840 0.000 0.000 0.755 2196 L CB -1.360 40.700 42.059 0.000 0.000 0.904 2196 L HN 0.201 nan 8.230 nan 0.000 0.435 2197 T N -1.434 113.119 114.554 -0.002 0.000 2.867 2197 T HA -0.154 4.196 4.350 0.000 0.000 0.268 2197 T C 1.957 176.654 174.700 -0.005 0.000 1.057 2197 T CA 1.028 63.126 62.100 -0.004 0.000 1.136 2197 T CB 0.035 68.900 68.868 -0.006 0.000 0.874 2197 T HN 0.059 nan 8.240 nan 0.000 0.466 2198 K N 0.774 121.172 120.400 -0.004 0.000 2.103 2198 K HA 0.157 4.477 4.320 0.000 0.000 0.204 2198 K C 2.032 178.633 176.600 0.001 0.000 1.052 2198 K CA 0.532 56.817 56.287 -0.004 0.000 0.945 2198 K CB -0.335 32.164 32.500 -0.003 0.000 0.722 2198 K HN 0.201 nan 8.250 nan 0.000 0.443 2199 I N 0.741 121.313 120.570 0.003 0.000 2.142 2199 I HA -0.206 3.964 4.170 0.000 0.000 0.240 2199 I C 2.161 178.282 176.117 0.006 0.000 1.078 2199 I CA 1.502 62.805 61.300 0.006 0.000 1.343 2199 I CB -1.359 36.644 38.000 0.005 0.000 1.046 2199 I HN 0.082 nan 8.210 nan 0.000 0.405 2200 A N 0.640 123.463 122.820 0.004 0.000 1.883 2200 A HA -0.282 4.038 4.320 0.000 0.000 0.217 2200 A C 2.471 180.058 177.584 0.005 0.000 1.186 2200 A CA 2.206 54.245 52.037 0.004 0.000 0.624 2200 A CB -0.732 18.268 19.000 0.001 0.000 0.822 2200 A HN 0.480 nan 8.150 nan 0.000 0.444 2201 M N 0.307 119.907 119.600 0.002 0.000 2.086 2201 M HA -0.169 4.311 4.480 0.000 0.000 0.261 2201 M C 2.268 178.574 176.300 0.010 0.000 1.067 2201 M CA 2.556 57.855 55.300 -0.001 0.000 1.116 2201 M CB -0.505 32.088 32.600 -0.013 0.000 1.348 2201 M HN 0.600 nan 8.290 nan 0.000 0.407 2202 T N -2.458 112.105 114.554 0.015 0.000 2.867 2202 T HA -0.093 4.257 4.350 0.000 0.000 0.268 2202 T C 1.979 176.701 174.700 0.038 0.000 1.057 2202 T CA 1.588 63.708 62.100 0.033 0.000 1.136 2202 T CB -0.687 68.200 68.868 0.032 0.000 0.874 2202 T HN 0.486 nan 8.240 nan 0.000 0.466 2203 S N 1.164 116.879 115.700 0.025 0.000 2.355 2203 S HA -0.005 4.465 4.470 0.000 0.000 0.222 2203 S C 2.031 176.647 174.600 0.026 0.000 1.031 2203 S CA 0.935 59.148 58.200 0.022 0.000 0.993 2203 S CB -0.669 62.539 63.200 0.014 0.000 0.859 2203 S HN 0.585 nan 8.310 nan 0.000 0.453 2204 I N 1.714 122.299 120.570 0.024 0.000 2.264 2204 I HA -0.116 4.054 4.170 0.000 0.000 0.248 2204 I C 1.355 177.496 176.117 0.041 0.000 1.111 2204 I CA 1.015 62.331 61.300 0.026 0.000 1.382 2204 I CB -0.961 37.050 38.000 0.018 0.000 1.060 2204 I HN 0.452 nan 8.210 nan 0.000 0.418 2205 T N -0.770 113.819 114.554 0.059 0.000 2.900 2205 T HA 0.367 4.717 4.350 0.000 0.000 0.307 2205 T C 1.144 175.905 174.700 0.102 0.000 1.065 2205 T CA 0.056 62.219 62.100 0.106 0.000 1.105 2205 T CB 1.379 70.348 68.868 0.168 0.000 0.979 2205 T HN 0.598 nan 8.240 nan 0.000 0.544 2206 G N 1.398 110.269 108.800 0.117 0.000 2.176 2206 G HA2 -0.205 3.755 3.960 0.000 0.000 0.253 2206 G HA3 -0.205 3.755 3.960 0.000 0.000 0.253 2206 G C -0.039 174.883 174.900 0.036 0.000 0.979 2206 G CA 0.409 45.544 45.100 0.059 0.000 0.641 2206 G HN 0.935 nan 8.290 nan 0.000 0.530 2207 K N -0.906 119.520 120.400 0.044 0.000 2.352 2207 K HA 0.609 4.929 4.320 0.000 0.000 0.240 2207 K C 1.542 178.162 176.600 0.034 0.000 1.017 2207 K CA -0.539 55.767 56.287 0.030 0.000 0.851 2207 K CB 1.280 33.796 32.500 0.026 0.000 1.261 2207 K HN 0.169 nan 8.250 nan 0.000 0.451 2208 G N 0.391 109.207 108.800 0.027 0.000 2.448 2208 G HA2 -0.252 3.709 3.960 0.000 0.000 0.219 2208 G HA3 -0.252 3.709 3.960 0.000 0.000 0.219 2208 G C 1.265 176.182 174.900 0.028 0.000 1.127 2208 G CA 1.110 46.227 45.100 0.027 0.000 0.766 2208 G HN 0.613 nan 8.290 nan 0.000 0.552 2209 A N 1.532 124.368 122.820 0.026 0.000 2.121 2209 A HA 0.004 4.325 4.320 0.000 0.000 0.218 2209 A C 2.135 179.733 177.584 0.023 0.000 1.154 2209 A CA 1.669 53.720 52.037 0.023 0.000 0.679 2209 A CB -0.385 18.627 19.000 0.021 0.000 0.795 2209 A HN 0.655 nan 8.150 nan 0.000 0.458 2210 E N 0.528 120.747 120.200 0.031 0.000 2.401 2210 E HA -0.216 4.134 4.350 0.000 0.000 0.199 2210 E C 1.457 178.068 176.600 0.020 0.000 1.023 2210 E CA 1.229 57.648 56.400 0.031 0.000 0.859 2210 E CB -0.318 29.418 29.700 0.059 0.000 0.780 2210 E HN 0.612 nan 8.360 nan 0.000 0.523 2211 K N 0.492 120.904 120.400 0.021 0.000 2.147 2211 K HA -0.063 4.257 4.320 0.000 0.000 0.205 2211 K C 1.388 177.992 176.600 0.006 0.000 1.049 2211 K CA 1.290 57.586 56.287 0.014 0.000 0.936 2211 K CB 0.055 32.565 32.500 0.017 0.000 0.722 2211 K HN 0.229 nan 8.250 nan 0.000 0.446 2212 A N 1.268 124.092 122.820 0.006 0.000 2.631 2212 A HA 0.079 4.399 4.320 0.000 0.000 0.294 2212 A C 1.173 178.757 177.584 -0.000 0.000 1.156 2212 A CA -0.489 51.550 52.037 0.002 0.000 0.963 2212 A CB -0.097 18.907 19.000 0.006 0.000 1.202 2212 A HN 0.253 nan 8.150 nan 0.000 0.523 2213 K N 0.117 120.516 120.400 -0.002 0.000 2.286 2213 K HA -0.223 4.097 4.320 0.000 0.000 0.203 2213 K C 0.841 177.435 176.600 -0.009 0.000 1.045 2213 K CA 1.969 58.254 56.287 -0.004 0.000 0.935 2213 K CB -0.110 32.384 32.500 -0.009 0.000 0.737 2213 K HN 0.348 nan 8.250 nan 0.000 0.460 2214 E N 1.437 121.629 120.200 -0.013 0.000 2.046 2214 E HA -0.137 4.213 4.350 0.000 0.000 0.190 2214 E C 1.930 178.525 176.600 -0.007 0.000 0.982 2214 E CA 1.346 57.738 56.400 -0.013 0.000 0.800 2214 E CB -0.049 29.642 29.700 -0.016 0.000 0.756 2214 E HN 0.305 nan 8.360 nan 0.000 0.449 2215 K N 0.278 120.676 120.400 -0.004 0.000 2.057 2215 K HA -0.072 4.248 4.320 0.000 0.000 0.206 2215 K C 1.667 178.268 176.600 0.001 0.000 1.050 2215 K CA 0.794 57.081 56.287 -0.001 0.000 0.935 2215 K CB -0.229 32.272 32.500 0.002 0.000 0.715 2215 K HN -0.014 nan 8.250 nan 0.000 0.439 2216 L N 0.680 121.904 121.223 0.002 0.000 2.083 2216 L HA -0.001 4.339 4.340 0.000 0.000 0.209 2216 L C 2.301 179.172 176.870 0.002 0.000 1.083 2216 L CA 1.934 56.776 54.840 0.004 0.000 0.752 2216 L CB -1.150 40.912 42.059 0.006 0.000 0.899 2216 L HN 0.293 nan 8.230 nan 0.000 0.433 2217 A N -0.820 122.000 122.820 -0.000 0.000 1.902 2217 A HA -0.252 4.068 4.320 0.000 0.000 0.217 2217 A C 2.360 179.943 177.584 -0.002 0.000 1.181 2217 A CA 1.715 53.751 52.037 -0.002 0.000 0.623 2217 A CB -0.563 18.434 19.000 -0.004 0.000 0.818 2217 A HN 0.493 nan 8.150 nan 0.000 0.443 2218 E N -0.131 120.068 120.200 -0.002 0.000 2.077 2218 E HA -0.183 4.167 4.350 0.000 0.000 0.193 2218 E C 1.865 178.465 176.600 -0.000 0.000 0.989 2218 E CA 1.349 57.748 56.400 -0.001 0.000 0.800 2218 E CB -0.245 29.454 29.700 -0.001 0.000 0.746 2218 E HN 0.665 nan 8.360 nan 0.000 0.452 2219 I N 0.953 121.523 120.570 0.001 0.000 2.226 2219 I HA -0.272 3.899 4.170 0.000 0.000 0.245 2219 I C 2.224 178.341 176.117 -0.000 0.000 1.100 2219 I CA 0.642 61.943 61.300 0.002 0.000 1.374 2219 I CB -0.173 37.830 38.000 0.005 0.000 1.057 2219 I HN 0.259 nan 8.210 nan 0.000 0.413 2220 I N 0.526 121.095 120.570 -0.001 0.000 2.353 2220 I HA -0.142 4.029 4.170 0.000 0.000 0.248 2220 I C 2.681 178.795 176.117 -0.004 0.000 1.119 2220 I CA 1.420 62.719 61.300 -0.003 0.000 1.417 2220 I CB -1.018 36.982 38.000 -0.001 0.000 1.078 2220 I HN 0.199 nan 8.210 nan 0.000 0.421 2221 V N -1.107 118.806 119.914 -0.003 0.000 2.809 2221 V HA -0.120 4.000 4.120 0.000 0.000 0.256 2221 V C 2.179 178.271 176.094 -0.004 0.000 1.080 2221 V CA 1.582 63.880 62.300 -0.003 0.000 1.102 2221 V CB -0.821 31.001 31.823 -0.002 0.000 0.705 2221 V HN 0.434 nan 8.190 nan 0.000 0.475 2222 E N 1.079 121.277 120.200 -0.004 0.000 2.076 2222 E HA -0.038 4.312 4.350 0.000 0.000 0.190 2222 E C 2.206 178.799 176.600 -0.011 0.000 0.979 2222 E CA 1.120 57.517 56.400 -0.005 0.000 0.807 2222 E CB -0.241 29.457 29.700 -0.003 0.000 0.761 2222 E HN 0.642 nan 8.360 nan 0.000 0.454 2223 A N 0.741 123.554 122.820 -0.012 0.000 1.858 2223 A HA -0.139 4.181 4.320 0.000 0.000 0.216 2223 A C 2.387 179.958 177.584 -0.022 0.000 1.190 2223 A CA 1.607 53.633 52.037 -0.018 0.000 0.617 2223 A CB -0.780 18.211 19.000 -0.015 0.000 0.827 2223 A HN 0.226 nan 8.150 nan 0.000 0.443 2224 V N -0.280 119.625 119.914 -0.015 0.000 2.515 2224 V HA -0.169 3.951 4.120 0.000 0.000 0.250 2224 V C 2.762 178.848 176.094 -0.014 0.000 1.058 2224 V CA 2.154 64.445 62.300 -0.014 0.000 1.064 2224 V CB -0.590 31.228 31.823 -0.009 0.000 0.675 2224 V HN 0.671 nan 8.190 nan 0.000 0.461 2225 S N -0.010 115.683 115.700 -0.011 0.000 2.383 2225 S HA -0.118 4.352 4.470 0.000 0.000 0.227 2225 S C 2.108 176.699 174.600 -0.015 0.000 1.026 2225 S CA 1.456 59.652 58.200 -0.008 0.000 0.981 2225 S CB -0.186 63.012 63.200 -0.003 0.000 0.818 2225 S HN 0.596 nan 8.310 nan 0.000 0.472 2226 A N 1.066 123.867 122.820 -0.031 0.000 1.873 2226 A HA 0.026 4.346 4.320 0.000 0.000 0.215 2226 A C 2.373 179.902 177.584 -0.091 0.000 1.186 2226 A CA 1.755 53.754 52.037 -0.063 0.000 0.616 2226 A CB -0.981 17.978 19.000 -0.068 0.000 0.823 2226 A HN 0.941 nan 8.150 nan 0.000 0.442 2227 V N -3.066 116.809 119.914 -0.065 0.000 2.788 2227 V HA -0.007 4.113 4.120 0.000 0.000 0.251 2227 V C 2.093 178.166 176.094 -0.035 0.000 1.068 2227 V CA 1.483 63.745 62.300 -0.063 0.000 1.090 2227 V CB -0.547 31.247 31.823 -0.048 0.000 0.710 2227 V HN 0.205 nan 8.190 nan 0.000 0.467 2228 V N 0.499 120.401 119.914 -0.019 0.000 2.515 2228 V HA -0.093 4.027 4.120 0.000 0.000 0.250 2228 V C 1.610 177.713 176.094 0.015 0.000 1.058 2228 V CA 2.403 64.702 62.300 -0.002 0.000 1.064 2228 V CB -0.533 31.291 31.823 0.001 0.000 0.675 2228 V HN 0.869 nan 8.190 nan 0.000 0.461 2229 D N -0.758 119.656 120.400 0.024 0.000 4.344 2229 D HA -0.223 4.417 4.640 0.000 0.000 0.144 2229 D C 0.552 176.885 176.300 0.056 0.000 0.730 2229 D CA 1.934 55.978 54.000 0.073 0.000 1.156 2229 D CB -1.242 39.623 40.800 0.109 0.000 0.570 2229 D HN 0.565 nan 8.370 nan 0.000 0.533 2230 D N 1.636 122.064 120.400 0.047 0.000 2.398 2230 D HA 0.236 4.876 4.640 0.000 0.000 0.247 2230 D C -0.238 176.075 176.300 0.020 0.000 1.227 2230 D CA 0.168 54.186 54.000 0.030 0.000 0.980 2230 D CB 0.611 41.425 40.800 0.024 0.000 1.106 2230 D HN 0.261 nan 8.370 nan 0.000 0.493 2231 E N 0.030 120.239 120.200 0.015 0.000 2.079 2231 E HA 0.518 4.868 4.350 0.000 0.000 0.252 2231 E C -0.702 175.903 176.600 0.009 0.000 0.992 2231 E CA -0.509 55.898 56.400 0.011 0.000 0.829 2231 E CB -0.343 29.362 29.700 0.009 0.000 1.158 2231 E HN 0.515 nan 8.360 nan 0.000 0.435 2232 G N 2.746 111.551 108.800 0.008 0.000 2.358 2232 G HA2 0.173 4.133 3.960 0.000 0.000 0.303 2232 G HA3 0.173 4.133 3.960 0.000 0.000 0.303 2232 G C -1.867 173.037 174.900 0.007 0.000 1.537 2232 G CA -0.844 44.261 45.100 0.009 0.000 0.928 2232 G HN 0.194 nan 8.290 nan 0.000 0.656 2233 K N 0.434 120.838 120.400 0.006 0.000 2.561 2233 K HA 0.578 4.898 4.320 0.000 0.000 0.254 2233 K C -1.425 175.176 176.600 0.002 0.000 0.942 2233 K CA -0.539 55.751 56.287 0.004 0.000 0.818 2233 K CB 2.307 34.810 32.500 0.004 0.000 1.306 2233 K HN 0.601 nan 8.250 nan 0.000 0.435 2234 V N 2.930 122.844 119.914 -0.000 0.000 2.459 2234 V HA 0.346 4.466 4.120 0.000 0.000 0.295 2234 V C -0.539 175.552 176.094 -0.005 0.000 1.029 2234 V CA -0.725 61.573 62.300 -0.003 0.000 0.874 2234 V CB 1.677 33.498 31.823 -0.004 0.000 0.985 2234 V HN 0.673 nan 8.190 nan 0.000 0.438 2235 D N 3.311 123.706 120.400 -0.008 0.000 2.471 2235 D HA 0.240 4.880 4.640 0.000 0.000 0.245 2235 D C 0.777 177.070 176.300 -0.013 0.000 1.116 2235 D CA -0.553 53.441 54.000 -0.009 0.000 0.853 2235 D CB 1.815 42.610 40.800 -0.009 0.000 1.123 2235 D HN 0.523 nan 8.370 nan 0.000 0.540 2236 K N 2.732 123.125 120.400 -0.012 0.000 2.218 2236 K HA -0.236 4.084 4.320 0.000 0.000 0.205 2236 K C 0.921 177.510 176.600 -0.018 0.000 1.046 2236 K CA 1.400 57.679 56.287 -0.014 0.000 0.933 2236 K CB 0.162 32.656 32.500 -0.011 0.000 0.728 2236 K HN 0.349 nan 8.250 nan 0.000 0.454 2237 D N 0.260 120.649 120.400 -0.018 0.000 2.309 2237 D HA -0.126 4.514 4.640 0.000 0.000 0.212 2237 D C 1.483 177.766 176.300 -0.029 0.000 0.968 2237 D CA 0.777 54.763 54.000 -0.023 0.000 0.882 2237 D CB 0.115 40.903 40.800 -0.020 0.000 0.918 2237 D HN 0.282 nan 8.370 nan 0.000 0.503 2238 L N -0.355 120.851 121.223 -0.028 0.000 2.492 2238 L HA 0.171 4.511 4.340 0.000 0.000 0.223 2238 L C 0.410 177.257 176.870 -0.039 0.000 1.132 2238 L CA 0.205 55.024 54.840 -0.035 0.000 0.850 2238 L CB 0.152 42.191 42.059 -0.032 0.000 0.966 2238 L HN 0.015 nan 8.230 nan 0.000 0.454 2239 I N 0.629 121.178 120.570 -0.034 0.000 2.420 2239 I HA 0.180 4.350 4.170 0.000 0.000 0.282 2239 I C 0.022 176.118 176.117 -0.035 0.000 1.019 2239 I CA -0.394 60.886 61.300 -0.034 0.000 1.130 2239 I CB 1.629 39.614 38.000 -0.026 0.000 1.262 2239 I HN -0.040 nan 8.210 nan 0.000 0.454 2240 K N 6.766 127.139 120.400 -0.044 0.000 2.249 2240 K HA 0.406 4.726 4.320 0.000 0.000 0.280 2240 K C -0.635 175.941 176.600 -0.041 0.000 1.033 2240 K CA -0.479 55.779 56.287 -0.047 0.000 0.946 2240 K CB 0.905 33.366 32.500 -0.065 0.000 1.005 2240 K HN 0.459 nan 8.250 nan 0.000 0.469 2241 I N 4.256 124.805 120.570 -0.035 0.000 2.347 2241 I HA 0.184 4.354 4.170 0.000 0.000 0.283 2241 I C -0.217 175.881 176.117 -0.032 0.000 1.058 2241 I CA -0.550 60.733 61.300 -0.027 0.000 1.202 2241 I CB 0.425 38.414 38.000 -0.018 0.000 1.386 2241 I HN 0.668 nan 8.210 nan 0.000 0.475 2242 E N 6.777 126.954 120.200 -0.037 0.000 2.204 2242 E HA 0.590 4.940 4.350 0.000 0.000 0.276 2242 E C -0.783 175.801 176.600 -0.025 0.000 0.974 2242 E CA -0.633 55.741 56.400 -0.043 0.000 0.815 2242 E CB 1.396 31.052 29.700 -0.073 0.000 1.119 2242 E HN 0.544 nan 8.360 nan 0.000 0.393 2243 K N 1.923 122.310 120.400 -0.022 0.000 2.468 2243 K HA 0.697 5.017 4.320 0.000 0.000 0.252 2243 K C -1.251 175.344 176.600 -0.008 0.000 0.932 2243 K CA -1.183 55.098 56.287 -0.010 0.000 0.794 2243 K CB 1.842 34.337 32.500 -0.009 0.000 1.241 2243 K HN 0.189 nan 8.250 nan 0.000 0.428 2244 K N 1.600 122.002 120.400 0.004 0.000 2.588 2244 K HA 0.191 4.511 4.320 0.000 0.000 0.250 2244 K C -1.000 175.608 176.600 0.012 0.000 0.972 2244 K CA -0.341 55.951 56.287 0.009 0.000 0.821 2244 K CB 1.910 34.426 32.500 0.025 0.000 1.249 2244 K HN 0.852 nan 8.250 nan 0.000 0.442 2245 S N 2.002 117.703 115.700 0.001 0.000 2.576 2245 S HA 0.685 5.155 4.470 0.000 0.000 0.272 2245 S C 0.531 175.137 174.600 0.011 0.000 1.352 2245 S CA 0.501 58.701 58.200 0.001 0.000 1.021 2245 S CB 0.513 63.707 63.200 -0.011 0.000 0.887 2245 S HN 1.384 nan 8.310 nan 0.000 0.542 2246 G N -0.064 108.743 108.800 0.011 0.000 2.484 2246 G HA2 0.483 4.443 3.960 0.000 0.000 0.685 2246 G HA3 0.483 4.443 3.960 0.000 0.000 0.685 2246 G C -0.061 174.849 174.900 0.015 0.000 1.294 2246 G CA -0.008 45.100 45.100 0.013 0.000 0.879 2246 G HN 2.454 nan 8.290 nan 0.000 0.646 2247 A N -0.710 122.118 122.820 0.013 0.000 5.953 2247 A HA 0.384 4.704 4.320 0.000 0.000 0.267 2247 A C 1.163 178.754 177.584 0.012 0.000 2.116 2247 A CA 1.981 54.025 52.037 0.012 0.000 0.711 2247 A CB -1.624 17.385 19.000 0.015 0.000 1.100 2247 A HN 2.726 nan 8.150 nan 0.000 0.364 2248 S N -2.590 113.118 115.700 0.013 0.000 2.810 2248 S HA 0.750 5.220 4.470 0.000 0.000 0.315 2248 S C 1.302 175.911 174.600 0.014 0.000 1.138 2248 S CA 0.011 58.218 58.200 0.013 0.000 0.889 2248 S CB 0.921 64.127 63.200 0.011 0.000 1.236 2248 S HN 0.967 nan 8.310 nan 0.000 0.548 2249 I N 1.195 121.773 120.570 0.015 0.000 2.315 2249 I HA -0.092 4.078 4.170 0.000 0.000 0.248 2249 I C 1.931 178.056 176.117 0.013 0.000 1.117 2249 I CA 1.392 62.701 61.300 0.015 0.000 1.404 2249 I CB -0.302 37.708 38.000 0.015 0.000 1.071 2249 I HN 0.694 nan 8.210 nan 0.000 0.419 2250 D N 1.016 121.422 120.400 0.011 0.000 2.218 2250 D HA -0.210 4.430 4.640 0.000 0.000 0.204 2250 D C 1.593 177.898 176.300 0.010 0.000 0.976 2250 D CA 1.140 55.145 54.000 0.008 0.000 0.853 2250 D CB -0.016 40.788 40.800 0.005 0.000 0.939 2250 D HN 0.248 nan 8.370 nan 0.000 0.481 2251 D N -0.434 119.973 120.400 0.012 0.000 2.347 2251 D HA -0.037 4.603 4.640 0.000 0.000 0.215 2251 D C 0.239 176.552 176.300 0.022 0.000 0.976 2251 D CA 0.391 54.400 54.000 0.014 0.000 0.884 2251 D CB -0.189 40.620 40.800 0.014 0.000 0.915 2251 D HN 0.162 nan 8.370 nan 0.000 0.526 2252 T N 1.513 116.080 114.554 0.022 0.000 2.933 2252 T HA 0.085 4.435 4.350 0.000 0.000 0.306 2252 T C 0.303 175.019 174.700 0.027 0.000 1.045 2252 T CA 0.689 62.804 62.100 0.026 0.000 1.143 2252 T CB 0.966 69.845 68.868 0.019 0.000 1.003 2252 T HN 0.033 nan 8.240 nan 0.000 0.540 2253 E N 1.626 121.848 120.200 0.037 0.000 2.372 2253 E HA 0.527 4.877 4.350 0.000 0.000 0.279 2253 E C -1.890 174.737 176.600 0.045 0.000 0.946 2253 E CA -0.830 55.593 56.400 0.039 0.000 0.769 2253 E CB 1.087 30.814 29.700 0.046 0.000 1.230 2253 E HN 0.367 nan 8.360 nan 0.000 0.442 2254 L N 3.900 125.144 121.223 0.035 0.000 2.289 2254 L HA 0.622 4.962 4.340 0.000 0.000 0.285 2254 L C -1.247 175.649 176.870 0.043 0.000 1.049 2254 L CA -0.247 54.610 54.840 0.028 0.000 0.804 2254 L CB 0.842 42.908 42.059 0.012 0.000 1.195 2254 L HN 0.596 nan 8.230 nan 0.000 0.428 2255 I N 4.751 125.348 120.570 0.045 0.000 2.354 2255 I HA 0.300 4.470 4.170 0.000 0.000 0.286 2255 I C -0.106 176.027 176.117 0.026 0.000 1.007 2255 I CA -0.442 60.897 61.300 0.065 0.000 1.167 2255 I CB 1.196 39.264 38.000 0.114 0.000 1.320 2255 I HN 0.425 nan 8.210 nan 0.000 0.458 2256 K N 5.266 125.680 120.400 0.023 0.000 2.199 2256 K HA 0.551 4.871 4.320 0.000 0.000 0.226 2256 K C 0.513 177.112 176.600 -0.001 0.000 1.237 2256 K CA -0.077 56.209 56.287 -0.001 0.000 1.170 2256 K CB -0.285 32.214 32.500 -0.003 0.000 1.418 2256 K HN 0.869 nan 8.250 nan 0.000 0.255 2257 G N -1.374 107.418 108.800 -0.012 0.000 2.512 2257 G HA2 0.166 4.127 3.960 0.000 0.000 0.181 2257 G HA3 0.166 4.127 3.960 0.000 0.000 0.181 2257 G C -1.623 173.248 174.900 -0.048 0.000 1.173 2257 G CA -0.739 44.349 45.100 -0.021 0.000 0.988 2257 G HN 0.043 nan 8.290 nan 0.000 0.485 2258 V N 0.834 120.709 119.914 -0.064 0.000 2.531 2258 V HA 0.694 4.814 4.120 0.000 0.000 0.301 2258 V C -0.904 175.101 176.094 -0.148 0.000 1.034 2258 V CA -0.592 61.637 62.300 -0.119 0.000 0.865 2258 V CB 1.451 33.172 31.823 -0.171 0.000 0.995 2258 V HN 0.889 nan 8.190 nan 0.000 0.424 2259 L N 7.606 128.705 121.223 -0.207 0.000 2.305 2259 L HA 0.843 5.183 4.340 0.000 0.000 0.284 2259 L C -0.384 176.328 176.870 -0.263 0.000 1.013 2259 L CA -0.178 54.450 54.840 -0.354 0.000 0.819 2259 L CB 1.649 43.391 42.059 -0.528 0.000 1.227 2259 L HN 0.582 nan 8.230 nan 0.000 0.417 2260 V N 1.584 121.365 119.914 -0.222 0.000 2.769 2260 V HA 0.634 4.754 4.120 0.000 0.000 0.312 2260 V C -0.369 175.667 176.094 -0.096 0.000 1.061 2260 V CA -0.523 61.701 62.300 -0.128 0.000 0.931 2260 V CB 1.820 33.602 31.823 -0.068 0.000 1.010 2260 V HN 0.812 nan 8.190 nan 0.000 0.433 2261 D N 1.001 121.365 120.400 -0.060 0.000 3.134 2261 D HA 0.327 4.967 4.640 0.000 0.000 0.248 2261 D C -0.115 176.188 176.300 0.005 0.000 1.273 2261 D CA -0.218 53.763 54.000 -0.032 0.000 0.904 2261 D CB 0.216 40.998 40.800 -0.030 0.000 1.089 2261 D HN 0.547 nan 8.370 nan 0.000 0.478 2262 K N 0.237 120.655 120.400 0.029 0.000 2.352 2262 K HA 0.558 4.878 4.320 0.000 0.000 0.240 2262 K C 0.002 176.635 176.600 0.055 0.000 1.017 2262 K CA -0.865 55.455 56.287 0.055 0.000 0.851 2262 K CB 1.942 34.503 32.500 0.102 0.000 1.261 2262 K HN 0.294 nan 8.250 nan 0.000 0.451 2263 E N -0.156 120.069 120.200 0.042 0.000 2.416 2263 E HA 0.455 4.805 4.350 0.000 0.000 0.273 2263 E C -0.965 175.637 176.600 0.005 0.000 0.935 2263 E CA -1.091 55.326 56.400 0.029 0.000 0.784 2263 E CB 1.447 31.162 29.700 0.024 0.000 1.301 2263 E HN 0.281 nan 8.360 nan 0.000 0.454 2264 R N 0.922 121.418 120.500 -0.006 0.000 2.401 2264 R HA 0.075 4.415 4.340 0.000 0.000 0.299 2264 R C 1.338 177.625 176.300 -0.023 0.000 1.064 2264 R CA 0.252 56.332 56.100 -0.032 0.000 1.000 2264 R CB 0.878 31.159 30.300 -0.031 0.000 0.973 2264 R HN 0.577 nan 8.270 nan 0.000 0.438 2265 V N -0.139 119.757 119.914 -0.030 0.000 2.867 2265 V HA -0.115 4.005 4.120 0.000 0.000 0.260 2265 V C 0.772 176.859 176.094 -0.012 0.000 1.099 2265 V CA 1.226 63.516 62.300 -0.017 0.000 1.122 2265 V CB -0.153 31.660 31.823 -0.018 0.000 0.708 2265 V HN 0.561 nan 8.190 nan 0.000 0.490 2266 S N -1.011 114.678 115.700 -0.018 0.000 2.521 2266 S HA 0.774 5.244 4.470 0.000 0.000 0.295 2266 S C 0.873 175.465 174.600 -0.014 0.000 1.098 2266 S CA -0.127 58.065 58.200 -0.013 0.000 0.999 2266 S CB 1.858 65.047 63.200 -0.017 0.000 1.034 2266 S HN 0.723 nan 8.310 nan 0.000 0.483 2267 A N 3.021 125.837 122.820 -0.007 0.000 2.070 2267 A HA -0.076 4.244 4.320 0.000 0.000 0.220 2267 A C 1.873 179.450 177.584 -0.011 0.000 1.159 2267 A CA 1.883 53.917 52.037 -0.006 0.000 0.656 2267 A CB -0.673 18.326 19.000 -0.001 0.000 0.800 2267 A HN 0.809 nan 8.150 nan 0.000 0.453 2268 Q N -0.529 119.260 119.800 -0.017 0.000 2.378 2268 Q HA 0.132 4.472 4.340 0.000 0.000 0.205 2268 Q C 0.711 176.689 176.000 -0.037 0.000 0.954 2268 Q CA 0.414 56.200 55.803 -0.028 0.000 0.901 2268 Q CB -0.456 28.255 28.738 -0.045 0.000 0.981 2268 Q HN 0.679 nan 8.270 nan 0.000 0.483 2269 M N 2.249 121.827 119.600 -0.037 0.000 2.245 2269 M HA 0.194 4.674 4.480 0.000 0.000 0.344 2269 M C -1.920 174.363 176.300 -0.029 0.000 1.170 2269 M CA -1.738 53.538 55.300 -0.040 0.000 1.135 2269 M CB 0.389 32.963 32.600 -0.044 0.000 1.574 2269 M HN -0.054 nan 8.290 nan 0.000 0.452 2270 P HA -0.021 nan 4.420 nan 0.000 0.265 2270 P C -0.237 177.055 177.300 -0.013 0.000 1.187 2270 P CA 0.245 63.334 63.100 -0.018 0.000 0.766 2270 P CB 0.467 32.156 31.700 -0.017 0.000 0.820 2271 K N 2.256 122.652 120.400 -0.006 0.000 2.426 2271 K HA 0.008 4.328 4.320 0.000 0.000 0.193 2271 K C 0.148 176.754 176.600 0.010 0.000 1.028 2271 K CA 0.479 56.767 56.287 0.002 0.000 1.047 2271 K CB 0.094 32.595 32.500 0.002 0.000 0.821 2271 K HN 0.448 nan 8.250 nan 0.000 0.513 2272 K N -0.717 119.687 120.400 0.006 0.000 2.561 2272 K HA 0.263 4.584 4.320 0.000 0.000 0.254 2272 K C -1.541 175.065 176.600 0.009 0.000 0.942 2272 K CA -0.942 55.352 56.287 0.012 0.000 0.818 2272 K CB 2.047 34.551 32.500 0.007 0.000 1.306 2272 K HN -0.218 nan 8.250 nan 0.000 0.435 2273 V N 2.206 122.130 119.914 0.017 0.000 2.531 2273 V HA 0.438 4.558 4.120 0.000 0.000 0.301 2273 V C -0.158 175.950 176.094 0.023 0.000 1.034 2273 V CA -0.527 61.781 62.300 0.014 0.000 0.865 2273 V CB 1.814 33.642 31.823 0.009 0.000 0.995 2273 V HN 0.997 nan 8.190 nan 0.000 0.424 2274 T N 0.015 114.580 114.554 0.017 0.000 2.929 2274 T HA 0.534 4.884 4.350 0.000 0.000 0.284 2274 T C 0.178 174.890 174.700 0.021 0.000 1.014 2274 T CA -0.218 61.894 62.100 0.020 0.000 1.051 2274 T CB 1.277 70.154 68.868 0.014 0.000 1.028 2274 T HN 0.777 nan 8.240 nan 0.000 0.485 2275 D N 0.148 120.563 120.400 0.024 0.000 2.689 2275 D HA -0.156 4.484 4.640 0.000 0.000 0.237 2275 D C 0.303 176.619 176.300 0.028 0.000 1.148 2275 D CA 0.825 54.839 54.000 0.024 0.000 0.656 2275 D CB -1.279 39.532 40.800 0.018 0.000 1.050 2275 D HN 1.099 nan 8.370 nan 0.000 0.426 2276 A N 1.350 124.192 122.820 0.036 0.000 2.511 2276 A HA 0.355 4.675 4.320 0.000 0.000 0.242 2276 A C 0.509 178.121 177.584 0.046 0.000 1.069 2276 A CA 0.198 52.260 52.037 0.042 0.000 0.763 2276 A CB 0.546 19.581 19.000 0.060 0.000 1.001 2276 A HN 0.158 nan 8.150 nan 0.000 0.498 2277 K N 3.027 123.451 120.400 0.040 0.000 2.404 2277 K HA 0.383 4.703 4.320 0.000 0.000 0.257 2277 K C -1.214 175.419 176.600 0.055 0.000 1.026 2277 K CA -0.247 56.065 56.287 0.041 0.000 0.951 2277 K CB 0.934 33.451 32.500 0.027 0.000 1.203 2277 K HN 0.523 nan 8.250 nan 0.000 0.446 2278 I N 2.141 122.760 120.570 0.082 0.000 2.371 2278 I HA 0.201 4.371 4.170 0.000 0.000 0.290 2278 I C 0.370 176.555 176.117 0.112 0.000 1.028 2278 I CA -0.146 61.234 61.300 0.133 0.000 1.345 2278 I CB 1.361 39.477 38.000 0.193 0.000 1.407 2278 I HN 0.517 nan 8.210 nan 0.000 0.501 2279 A N 7.501 130.391 122.820 0.117 0.000 2.337 2279 A HA 0.856 5.176 4.320 0.000 0.000 0.329 2279 A C -0.793 176.876 177.584 0.142 0.000 1.146 2279 A CA -0.569 51.525 52.037 0.094 0.000 0.800 2279 A CB 0.705 19.738 19.000 0.054 0.000 1.220 2279 A HN 0.653 nan 8.150 nan 0.000 0.472 2280 L N 3.411 124.697 121.223 0.105 0.000 2.318 2280 L HA 0.420 4.760 4.340 0.000 0.000 0.277 2280 L C -0.919 175.993 176.870 0.070 0.000 1.008 2280 L CA -0.081 54.822 54.840 0.105 0.000 0.846 2280 L CB 0.961 43.061 42.059 0.068 0.000 1.220 2280 L HN 0.572 nan 8.230 nan 0.000 0.423 2281 L N 2.758 124.026 121.223 0.075 0.000 2.325 2281 L HA 0.432 4.772 4.340 0.000 0.000 0.278 2281 L C 0.785 177.685 176.870 0.049 0.000 1.023 2281 L CA -0.340 54.531 54.840 0.052 0.000 0.811 2281 L CB 1.901 43.987 42.059 0.046 0.000 1.249 2281 L HN 0.518 nan 8.230 nan 0.000 0.431 2282 N N 0.822 119.543 118.700 0.036 0.000 2.454 2282 N HA -0.016 4.724 4.740 0.000 0.000 0.177 2282 N C 0.500 176.026 175.510 0.027 0.000 1.049 2282 N CA -0.026 53.042 53.050 0.030 0.000 0.887 2282 N CB 0.331 38.832 38.487 0.022 0.000 1.095 2282 N HN 0.743 nan 8.380 nan 0.000 0.446 2283 C N 1.348 120.663 119.300 0.025 0.000 2.700 2283 C HA 0.779 5.239 4.460 0.000 0.000 0.397 2283 C C 0.984 175.989 174.990 0.025 0.000 1.301 2283 C CA -1.339 57.692 59.018 0.023 0.000 2.219 2283 C CB -0.448 27.305 27.740 0.021 0.000 2.699 2283 C HN 0.426 nan 8.230 nan 0.000 0.669 2284 A N 2.775 125.609 122.820 0.023 0.000 2.388 2284 A HA 0.580 4.900 4.320 0.000 0.000 0.257 2284 A C 0.183 177.782 177.584 0.026 0.000 1.095 2284 A CA -0.598 51.453 52.037 0.024 0.000 0.791 2284 A CB -0.059 18.954 19.000 0.022 0.000 1.029 2284 A HN 0.901 nan 8.150 nan 0.000 0.489 2285 I N 2.759 123.346 120.570 0.027 0.000 2.206 2285 I HA 0.182 4.352 4.170 0.000 0.000 0.292 2285 I C 0.442 176.580 176.117 0.035 0.000 1.156 2285 I CA 0.247 61.565 61.300 0.031 0.000 1.356 2285 I CB -0.695 37.324 38.000 0.032 0.000 1.494 2285 I HN 0.870 nan 8.210 nan 0.000 0.601 2286 E N 3.922 124.141 120.200 0.033 0.000 2.456 2286 E HA 0.469 4.819 4.350 0.000 0.000 0.276 2286 E C -0.753 175.867 176.600 0.034 0.000 0.981 2286 E CA -1.179 55.242 56.400 0.034 0.000 0.814 2286 E CB 1.512 31.229 29.700 0.028 0.000 1.382 2286 E HN 0.020 nan 8.360 nan 0.000 0.459 2287 I N 2.248 122.840 120.570 0.036 0.000 2.705 2287 I HA -0.028 4.142 4.170 0.000 0.000 0.291 2287 I C 0.653 176.788 176.117 0.031 0.000 1.146 2287 I CA 0.460 61.782 61.300 0.037 0.000 1.383 2287 I CB -0.375 37.650 38.000 0.042 0.000 1.454 2287 I HN 0.328 nan 8.210 nan 0.000 0.581 2288 K N 5.194 125.611 120.400 0.028 0.000 2.511 2288 K HA -0.058 4.262 4.320 0.000 0.000 0.280 2288 K C 0.038 176.652 176.600 0.024 0.000 1.008 2288 K CA 0.219 56.521 56.287 0.024 0.000 1.050 2288 K CB 0.390 32.903 32.500 0.022 0.000 0.889 2288 K HN 0.466 nan 8.250 nan 0.000 0.484 2289 E N 2.239 122.451 120.200 0.020 0.000 2.179 2289 E HA 0.151 4.502 4.350 0.000 0.000 0.275 2289 E C -0.836 175.773 176.600 0.015 0.000 0.945 2289 E CA -0.553 55.858 56.400 0.018 0.000 0.792 2289 E CB 0.988 30.696 29.700 0.014 0.000 1.125 2289 E HN 0.578 nan 8.360 nan 0.000 0.397 2290 T N 1.932 116.496 114.554 0.015 0.000 2.903 2290 T HA 0.095 4.445 4.350 0.000 0.000 0.314 2290 T C 0.886 175.592 174.700 0.010 0.000 1.078 2290 T CA -0.490 61.618 62.100 0.014 0.000 1.114 2290 T CB 0.753 69.629 68.868 0.015 0.000 0.987 2290 T HN 0.448 nan 8.240 nan 0.000 0.548 2291 E N 0.724 120.930 120.200 0.010 0.000 2.046 2291 E HA -0.027 4.324 4.350 0.000 0.000 0.190 2291 E C 1.302 177.906 176.600 0.006 0.000 0.982 2291 E CA 0.902 57.307 56.400 0.008 0.000 0.800 2291 E CB -0.581 29.124 29.700 0.008 0.000 0.756 2291 E HN 0.795 nan 8.360 nan 0.000 0.449 2292 T N 1.853 116.411 114.554 0.006 0.000 2.930 2292 T HA -0.005 4.345 4.350 0.000 0.000 0.306 2292 T C -0.328 174.375 174.700 0.004 0.000 1.045 2292 T CA -0.610 61.493 62.100 0.005 0.000 1.134 2292 T CB 0.355 69.227 68.868 0.006 0.000 0.961 2292 T HN -0.178 nan 8.240 nan 0.000 0.545 2293 D N 2.738 123.139 120.400 0.002 0.000 2.450 2293 D HA 0.470 5.110 4.640 0.000 0.000 0.247 2293 D C -0.247 176.052 176.300 -0.002 0.000 1.162 2293 D CA 0.517 54.516 54.000 -0.001 0.000 0.879 2293 D CB 0.702 41.501 40.800 -0.002 0.000 1.163 2293 D HN 0.743 nan 8.370 nan 0.000 0.472 2294 A N 2.805 125.623 122.820 -0.004 0.000 2.547 2294 A HA 0.601 4.921 4.320 0.000 0.000 0.297 2294 A C -0.784 176.789 177.584 -0.017 0.000 1.056 2294 A CA -0.774 51.259 52.037 -0.006 0.000 0.688 2294 A CB 1.656 20.657 19.000 0.002 0.000 1.282 2294 A HN 0.459 nan 8.150 nan 0.000 0.400 2295 E N 0.858 121.041 120.200 -0.029 0.000 2.356 2295 E HA 0.503 4.853 4.350 0.000 0.000 0.275 2295 E C -1.465 175.085 176.600 -0.083 0.000 0.904 2295 E CA -0.836 55.533 56.400 -0.053 0.000 0.757 2295 E CB 2.300 31.971 29.700 -0.049 0.000 1.232 2295 E HN 0.494 nan 8.360 nan 0.000 0.442 2296 I N 2.053 122.535 120.570 -0.147 0.000 2.472 2296 I HA 0.183 4.353 4.170 0.000 0.000 0.290 2296 I C -0.011 175.958 176.117 -0.246 0.000 1.016 2296 I CA -0.254 60.884 61.300 -0.271 0.000 1.348 2296 I CB 0.483 38.153 38.000 -0.552 0.000 1.417 2296 I HN 0.195 nan 8.210 nan 0.000 0.521 2297 R N 6.974 127.344 120.500 -0.216 0.000 2.363 2297 R HA 0.478 4.818 4.340 0.000 0.000 0.297 2297 R C -0.927 175.300 176.300 -0.123 0.000 1.208 2297 R CA -0.527 55.491 56.100 -0.136 0.000 1.121 2297 R CB 0.680 30.939 30.300 -0.068 0.000 1.124 2297 R HN 0.547 nan 8.270 nan 0.000 0.561 2298 I N 0.968 121.450 120.570 -0.147 0.000 2.395 2298 I HA 0.113 4.283 4.170 0.000 0.000 0.289 2298 I C 1.318 177.430 176.117 -0.009 0.000 1.023 2298 I CA 0.263 61.526 61.300 -0.062 0.000 1.350 2298 I CB 1.549 39.510 38.000 -0.066 0.000 1.409 2298 I HN 0.357 nan 8.210 nan 0.000 0.507 2299 T N 3.110 117.682 114.554 0.030 0.000 3.262 2299 T HA 0.113 4.463 4.350 0.000 0.000 0.300 2299 T C -0.503 174.218 174.700 0.035 0.000 0.959 2299 T CA -0.154 61.961 62.100 0.024 0.000 0.936 2299 T CB -0.212 68.667 68.868 0.019 0.000 1.169 2299 T HN 0.620 nan 8.240 nan 0.000 0.532 2300 D N 0.640 121.071 120.400 0.052 0.000 2.896 2300 D HA 0.355 4.995 4.640 0.000 0.000 0.241 2300 D C -2.188 174.144 176.300 0.052 0.000 1.188 2300 D CA -1.809 52.219 54.000 0.048 0.000 0.879 2300 D CB 2.851 43.681 40.800 0.051 0.000 1.553 2300 D HN -0.154 nan 8.370 nan 0.000 0.515 2301 P HA -0.135 nan 4.420 nan 0.000 0.217 2301 P C 0.962 178.285 177.300 0.039 0.000 1.148 2301 P CA 1.349 64.469 63.100 0.034 0.000 0.834 2301 P CB 0.335 32.049 31.700 0.023 0.000 0.783 2302 A N -0.301 122.540 122.820 0.036 0.000 1.898 2302 A HA -0.193 4.127 4.320 0.000 0.000 0.216 2302 A C 2.083 179.694 177.584 0.044 0.000 1.181 2302 A CA 1.578 53.633 52.037 0.030 0.000 0.620 2302 A CB -0.880 18.131 19.000 0.017 0.000 0.819 2302 A HN 0.151 nan 8.150 nan 0.000 0.442 2303 K N -0.811 119.638 120.400 0.081 0.000 2.148 2303 K HA -0.046 4.274 4.320 0.000 0.000 0.204 2303 K C 1.820 178.574 176.600 0.256 0.000 1.050 2303 K CA 1.041 57.428 56.287 0.166 0.000 0.942 2303 K CB -0.307 32.344 32.500 0.252 0.000 0.724 2303 K HN 0.376 nan 8.250 nan 0.000 0.446 2304 L N 0.999 122.317 121.223 0.158 0.000 2.042 2304 L HA -0.199 4.141 4.340 0.000 0.000 0.210 2304 L C 1.995 178.938 176.870 0.122 0.000 1.076 2304 L CA 1.770 56.688 54.840 0.129 0.000 0.749 2304 L CB -0.223 41.877 42.059 0.069 0.000 0.893 2304 L HN 0.177 nan 8.230 nan 0.000 0.432 2305 M N -1.269 118.382 119.600 0.084 0.000 2.193 2305 M HA -0.067 4.413 4.480 0.000 0.000 0.265 2305 M C 2.150 178.475 176.300 0.042 0.000 1.071 2305 M CA 1.134 56.467 55.300 0.054 0.000 1.140 2305 M CB -1.106 31.512 32.600 0.030 0.000 1.369 2305 M HN 0.246 nan 8.290 nan 0.000 0.423 2306 E N 0.014 120.226 120.200 0.019 0.000 2.051 2306 E HA -0.136 4.214 4.350 0.000 0.000 0.192 2306 E C 2.071 178.609 176.600 -0.103 0.000 0.991 2306 E CA 1.403 57.754 56.400 -0.082 0.000 0.799 2306 E CB -0.416 29.175 29.700 -0.182 0.000 0.748 2306 E HN 0.455 nan 8.360 nan 0.000 0.449 2307 F N 0.658 120.611 119.950 0.005 0.000 2.206 2307 F HA -0.051 4.476 4.527 0.000 0.000 0.298 2307 F C 2.400 178.205 175.800 0.008 0.000 1.090 2307 F CA 0.551 58.555 58.000 0.006 0.000 1.323 2307 F CB -0.165 38.838 39.000 0.005 0.000 1.028 2307 F HN -0.053 nan 8.300 nan 0.000 0.492 2308 I N -0.125 120.558 120.570 0.189 0.000 2.286 2308 I HA -0.263 3.907 4.170 0.000 0.000 0.248 2308 I C 2.014 178.176 176.117 0.074 0.000 1.115 2308 I CA 1.513 62.879 61.300 0.110 0.000 1.392 2308 I CB -0.397 37.650 38.000 0.078 0.000 1.065 2308 I HN 0.175 nan 8.210 nan 0.000 0.418 2309 E N -0.010 120.221 120.200 0.052 0.000 2.216 2309 E HA -0.233 4.118 4.350 0.000 0.000 0.192 2309 E C 2.030 178.640 176.600 0.017 0.000 0.988 2309 E CA 0.520 56.938 56.400 0.029 0.000 0.834 2309 E CB 0.035 29.741 29.700 0.009 0.000 0.772 2309 E HN 0.330 nan 8.360 nan 0.000 0.479 2310 Q N 1.021 120.824 119.800 0.005 0.000 2.172 2310 Q HA -0.148 4.192 4.340 0.000 0.000 0.200 2310 Q C 1.768 177.789 176.000 0.034 0.000 0.964 2310 Q CA 1.137 56.931 55.803 -0.014 0.000 0.855 2310 Q CB 0.213 28.901 28.738 -0.085 0.000 0.918 2310 Q HN 0.147 nan 8.270 nan 0.000 0.444 2311 E N 0.286 120.528 120.200 0.071 0.000 2.051 2311 E HA -0.198 4.152 4.350 0.000 0.000 0.192 2311 E C 1.717 178.355 176.600 0.063 0.000 0.991 2311 E CA 1.124 57.568 56.400 0.073 0.000 0.799 2311 E CB -0.154 29.595 29.700 0.082 0.000 0.748 2311 E HN 0.481 nan 8.360 nan 0.000 0.449 2312 E N 1.388 121.627 120.200 0.066 0.000 2.150 2312 E HA -0.197 4.153 4.350 0.000 0.000 0.193 2312 E C 1.926 178.564 176.600 0.064 0.000 0.985 2312 E CA 1.030 57.483 56.400 0.089 0.000 0.814 2312 E CB 0.132 29.890 29.700 0.097 0.000 0.752 2312 E HN -0.055 nan 8.360 nan 0.000 0.466 2313 K N 0.843 121.258 120.400 0.024 0.000 2.057 2313 K HA -0.071 4.249 4.320 0.000 0.000 0.206 2313 K C 2.294 178.881 176.600 -0.022 0.000 1.050 2313 K CA 1.467 57.744 56.287 -0.016 0.000 0.935 2313 K CB -0.534 31.951 32.500 -0.025 0.000 0.715 2313 K HN 0.148 nan 8.250 nan 0.000 0.439 2314 M N -0.199 119.402 119.600 0.002 0.000 2.065 2314 M HA -0.180 4.300 4.480 0.000 0.000 0.259 2314 M C 1.858 178.163 176.300 0.009 0.000 1.069 2314 M CA 1.743 57.047 55.300 0.006 0.000 1.110 2314 M CB -0.268 32.346 32.600 0.024 0.000 1.328 2314 M HN 0.264 nan 8.290 nan 0.000 0.405 2315 L N 0.766 122.009 121.223 0.033 0.000 2.083 2315 L HA -0.196 4.144 4.340 0.000 0.000 0.209 2315 L C 2.366 179.261 176.870 0.043 0.000 1.083 2315 L CA 1.954 56.828 54.840 0.057 0.000 0.752 2315 L CB -0.779 41.339 42.059 0.098 0.000 0.899 2315 L HN 0.350 nan 8.230 nan 0.000 0.433 2316 K N -0.845 119.542 120.400 -0.021 0.000 2.057 2316 K HA -0.197 4.123 4.320 0.000 0.000 0.207 2316 K C 1.601 178.099 176.600 -0.169 0.000 1.049 2316 K CA 1.769 57.913 56.287 -0.238 0.000 0.931 2316 K CB -0.091 32.154 32.500 -0.425 0.000 0.714 2316 K HN 0.344 nan 8.250 nan 0.000 0.440 2317 D N 0.400 120.743 120.400 -0.095 0.000 2.183 2317 D HA -0.112 4.528 4.640 0.000 0.000 0.203 2317 D C 1.880 178.156 176.300 -0.040 0.000 0.969 2317 D CA 1.067 55.027 54.000 -0.068 0.000 0.842 2317 D CB -0.017 40.755 40.800 -0.046 0.000 0.957 2317 D HN 0.305 nan 8.370 nan 0.000 0.484 2318 M N -0.041 119.547 119.600 -0.021 0.000 2.117 2318 M HA -0.131 4.349 4.480 0.000 0.000 0.262 2318 M C 2.223 178.524 176.300 0.000 0.000 1.065 2318 M CA 0.903 56.202 55.300 -0.001 0.000 1.114 2318 M CB -0.069 32.541 32.600 0.016 0.000 1.361 2318 M HN -0.108 nan 8.290 nan 0.000 0.408 2319 V N 0.247 120.161 119.914 -0.000 0.000 2.358 2319 V HA -0.213 3.907 4.120 0.000 0.000 0.246 2319 V C 2.607 178.692 176.094 -0.016 0.000 1.047 2319 V CA 1.887 64.192 62.300 0.008 0.000 1.035 2319 V CB -1.148 30.701 31.823 0.043 0.000 0.658 2319 V HN 0.513 nan 8.190 nan 0.000 0.452 2320 A N -0.358 122.435 122.820 -0.045 0.000 1.933 2320 A HA -0.245 4.075 4.320 0.000 0.000 0.218 2320 A C 2.166 179.735 177.584 -0.026 0.000 1.175 2320 A CA 1.899 53.908 52.037 -0.046 0.000 0.628 2320 A CB -0.405 18.555 19.000 -0.066 0.000 0.814 2320 A HN 0.638 nan 8.150 nan 0.000 0.444 2321 E N -0.426 119.762 120.200 -0.020 0.000 2.107 2321 E HA -0.086 4.265 4.350 0.000 0.000 0.191 2321 E C 1.838 178.435 176.600 -0.004 0.000 0.982 2321 E CA 0.969 57.362 56.400 -0.010 0.000 0.809 2321 E CB -0.241 29.455 29.700 -0.007 0.000 0.756 2321 E HN 0.700 nan 8.360 nan 0.000 0.459 2322 I N 1.209 121.778 120.570 -0.002 0.000 2.226 2322 I HA -0.273 3.897 4.170 0.000 0.000 0.245 2322 I C 2.444 178.560 176.117 -0.001 0.000 1.100 2322 I CA 0.997 62.298 61.300 0.002 0.000 1.374 2322 I CB -0.117 37.886 38.000 0.005 0.000 1.057 2322 I HN -0.018 nan 8.210 nan 0.000 0.413 2323 K N 1.673 122.070 120.400 -0.005 0.000 2.097 2323 K HA -0.073 4.247 4.320 0.000 0.000 0.205 2323 K C 2.025 178.621 176.600 -0.006 0.000 1.050 2323 K CA 1.618 57.901 56.287 -0.007 0.000 0.938 2323 K CB -0.407 32.086 32.500 -0.011 0.000 0.718 2323 K HN 0.254 nan 8.250 nan 0.000 0.442 2324 A N 0.355 123.171 122.820 -0.007 0.000 1.978 2324 A HA -0.166 4.154 4.320 0.000 0.000 0.220 2324 A C 2.130 179.713 177.584 -0.002 0.000 1.170 2324 A CA 2.163 54.196 52.037 -0.006 0.000 0.636 2324 A CB -1.035 17.960 19.000 -0.008 0.000 0.810 2324 A HN 0.555 nan 8.150 nan 0.000 0.448 2325 S N -1.689 114.011 115.700 0.001 0.000 2.442 2325 S HA 0.232 4.702 4.470 0.000 0.000 0.236 2325 S C 1.642 176.246 174.600 0.007 0.000 1.007 2325 S CA 1.482 59.685 58.200 0.005 0.000 0.965 2325 S CB -0.539 62.666 63.200 0.009 0.000 0.773 2325 S HN 1.988 nan 8.310 nan 0.000 0.504 2326 G N 0.570 109.373 108.800 0.004 0.000 2.176 2326 G HA2 -0.060 3.900 3.960 0.000 0.000 0.232 2326 G HA3 -0.060 3.900 3.960 0.000 0.000 0.232 2326 G C 0.256 175.160 174.900 0.007 0.000 0.986 2326 G CA -0.001 45.102 45.100 0.005 0.000 0.643 2326 G HN 1.365 nan 8.290 nan 0.000 0.522 2327 A N 0.408 123.233 122.820 0.008 0.000 2.498 2327 A HA 0.570 4.890 4.320 0.000 0.000 0.239 2327 A C 1.000 178.584 177.584 -0.001 0.000 1.068 2327 A CA 1.290 53.333 52.037 0.010 0.000 0.766 2327 A CB 0.129 19.136 19.000 0.012 0.000 1.003 2327 A HN 1.357 nan 8.150 nan 0.000 0.497 2328 N N -0.354 118.344 118.700 -0.003 0.000 2.067 2328 N HA 0.176 4.916 4.740 0.000 0.000 0.227 2328 N C -0.901 174.588 175.510 -0.036 0.000 1.348 2328 N CA 0.126 53.166 53.050 -0.016 0.000 0.879 2328 N CB 0.523 39.005 38.487 -0.008 0.000 1.109 2328 N HN 0.269 nan 8.380 nan 0.000 0.501 2329 V N 1.517 121.410 119.914 -0.035 0.000 2.531 2329 V HA 0.599 4.719 4.120 0.000 0.000 0.301 2329 V C -1.354 174.668 176.094 -0.121 0.000 1.034 2329 V CA -0.815 61.428 62.300 -0.094 0.000 0.865 2329 V CB 1.809 33.618 31.823 -0.024 0.000 0.995 2329 V HN 0.219 nan 8.190 nan 0.000 0.424 2330 L N 5.540 126.592 121.223 -0.285 0.000 2.410 2330 L HA 0.736 5.076 4.340 0.000 0.000 0.270 2330 L C -1.572 175.036 176.870 -0.437 0.000 0.983 2330 L CA -0.067 54.647 54.840 -0.209 0.000 0.822 2330 L CB 1.741 43.736 42.059 -0.108 0.000 1.285 2330 L HN 0.476 nan 8.230 nan 0.000 0.409 2331 F N 4.631 124.585 119.950 0.006 0.000 2.427 2331 F HA 0.485 5.013 4.527 0.000 0.000 0.348 2331 F C -0.040 175.762 175.800 0.004 0.000 1.125 2331 F CA -0.438 57.564 58.000 0.003 0.000 0.989 2331 F CB 1.602 40.601 39.000 -0.001 0.000 1.165 2331 F HN 0.507 nan 8.300 nan 0.000 0.442 2332 C N 4.890 124.272 119.300 0.136 0.000 2.303 2332 C HA 0.244 4.704 4.460 0.000 0.000 0.326 2332 C C 1.642 176.684 174.990 0.087 0.000 1.285 2332 C CA -0.403 58.667 59.018 0.088 0.000 1.675 2332 C CB 0.756 28.524 27.740 0.046 0.000 2.289 2332 C HN 0.965 nan 8.230 nan 0.000 0.512 2333 Q N 3.396 123.238 119.800 0.070 0.000 2.124 2333 Q HA -0.051 4.289 4.340 0.000 0.000 0.202 2333 Q C 0.790 176.814 176.000 0.039 0.000 0.977 2333 Q CA 1.631 57.464 55.803 0.051 0.000 0.850 2333 Q CB 0.180 28.939 28.738 0.035 0.000 0.901 2333 Q HN 0.758 nan 8.270 nan 0.000 0.429 2334 K N -1.146 119.275 120.400 0.035 0.000 2.632 2334 K HA 0.433 4.753 4.320 0.000 0.000 0.267 2334 K C 0.328 176.945 176.600 0.028 0.000 1.028 2334 K CA -0.204 56.100 56.287 0.028 0.000 1.045 2334 K CB 0.147 32.661 32.500 0.024 0.000 1.400 2334 K HN 0.114 nan 8.250 nan 0.000 0.522 2335 G N 0.263 109.077 108.800 0.023 0.000 2.599 2335 G HA2 0.429 4.389 3.960 0.000 0.000 0.264 2335 G HA3 0.429 4.389 3.960 0.000 0.000 0.264 2335 G C -0.523 174.390 174.900 0.022 0.000 1.200 2335 G CA -0.513 44.599 45.100 0.021 0.000 0.896 2335 G HN 0.371 nan 8.290 nan 0.000 0.536 2336 I N 0.352 120.933 120.570 0.019 0.000 2.499 2336 I HA 0.169 4.339 4.170 0.000 0.000 0.288 2336 I C -0.584 175.546 176.117 0.021 0.000 1.048 2336 I CA -0.790 60.522 61.300 0.021 0.000 1.062 2336 I CB 2.151 40.160 38.000 0.016 0.000 1.238 2336 I HN 0.420 nan 8.210 nan 0.000 0.426 2337 D N 5.242 125.659 120.400 0.028 0.000 2.414 2337 D HA -0.037 4.603 4.640 0.000 0.000 0.242 2337 D C 0.631 176.946 176.300 0.024 0.000 1.129 2337 D CA 0.140 54.156 54.000 0.026 0.000 0.885 2337 D CB 1.320 42.141 40.800 0.035 0.000 1.198 2337 D HN 0.496 nan 8.370 nan 0.000 0.437 2338 D N 3.135 123.542 120.400 0.012 0.000 2.190 2338 D HA -0.169 4.471 4.640 0.000 0.000 0.200 2338 D C 1.911 178.208 176.300 -0.005 0.000 0.992 2338 D CA 0.765 54.766 54.000 0.001 0.000 0.854 2338 D CB 0.261 41.054 40.800 -0.012 0.000 0.936 2338 D HN 0.342 nan 8.370 nan 0.000 0.462 2339 L N 1.004 122.225 121.223 -0.003 0.000 2.056 2339 L HA -0.074 4.266 4.340 0.000 0.000 0.207 2339 L C 2.524 179.422 176.870 0.046 0.000 1.078 2339 L CA 1.223 56.049 54.840 -0.023 0.000 0.749 2339 L CB -1.066 41.010 42.059 0.028 0.000 0.901 2339 L HN -0.051 nan 8.230 nan 0.000 0.433 2340 A N -1.333 121.552 122.820 0.108 0.000 1.930 2340 A HA -0.225 4.095 4.320 0.000 0.000 0.217 2340 A C 2.213 179.862 177.584 0.107 0.000 1.175 2340 A CA 1.325 53.455 52.037 0.155 0.000 0.627 2340 A CB -0.433 18.630 19.000 0.105 0.000 0.815 2340 A HN 0.525 nan 8.150 nan 0.000 0.443 2341 Q N -1.280 118.553 119.800 0.056 0.000 2.084 2341 Q HA -0.217 4.123 4.340 0.000 0.000 0.202 2341 Q C 2.156 178.169 176.000 0.022 0.000 0.978 2341 Q CA 1.531 57.351 55.803 0.029 0.000 0.844 2341 Q CB -0.392 28.356 28.738 0.017 0.000 0.898 2341 Q HN 0.910 nan 8.270 nan 0.000 0.426 2342 H N -0.252 118.764 119.070 -0.090 0.000 2.293 2342 H HA -0.163 4.393 4.556 0.000 0.000 0.300 2342 H C 1.548 176.816 175.328 -0.100 0.000 1.082 2342 H CA 1.589 57.546 56.048 -0.151 0.000 1.308 2342 H CB -0.056 29.529 29.762 -0.295 0.000 1.375 2342 H HN 0.266 nan 8.280 nan 0.000 0.495 2343 Y N 0.910 121.228 120.300 0.030 0.000 2.274 2343 Y HA -0.120 4.430 4.550 0.000 0.000 0.290 2343 Y C 2.963 178.815 175.900 -0.080 0.000 1.145 2343 Y CA 0.637 58.719 58.100 -0.030 0.000 1.203 2343 Y CB -0.523 37.975 38.460 0.063 0.000 0.984 2343 Y HN 0.155 nan 8.280 nan 0.000 0.533 2344 L N -1.113 120.163 121.223 0.089 0.000 2.046 2344 L HA -0.236 4.104 4.340 0.000 0.000 0.208 2344 L C 2.642 179.491 176.870 -0.034 0.000 1.077 2344 L CA 1.221 56.073 54.840 0.020 0.000 0.747 2344 L CB -0.814 41.250 42.059 0.009 0.000 0.896 2344 L HN 0.192 nan 8.230 nan 0.000 0.432 2345 A N -0.444 122.328 122.820 -0.080 0.000 1.933 2345 A HA -0.168 4.152 4.320 0.000 0.000 0.218 2345 A C 2.249 179.759 177.584 -0.124 0.000 1.175 2345 A CA 1.381 53.353 52.037 -0.108 0.000 0.628 2345 A CB -0.234 18.685 19.000 -0.135 0.000 0.814 2345 A HN 0.195 nan 8.150 nan 0.000 0.444 2346 K N -0.047 120.249 120.400 -0.173 0.000 2.296 2346 K HA -0.003 4.317 4.320 0.000 0.000 0.200 2346 K C 1.151 177.725 176.600 -0.043 0.000 1.048 2346 K CA 0.640 56.852 56.287 -0.125 0.000 0.966 2346 K CB -0.055 32.355 32.500 -0.150 0.000 0.754 2346 K HN 0.475 nan 8.250 nan 0.000 0.466 2347 E N -0.107 120.079 120.200 -0.024 0.000 2.489 2347 E HA 0.023 4.373 4.350 0.000 0.000 0.193 2347 E C 0.742 177.330 176.600 -0.020 0.000 1.057 2347 E CA 0.351 56.744 56.400 -0.012 0.000 0.866 2347 E CB 0.211 29.910 29.700 -0.002 0.000 0.916 2347 E HN 0.433 nan 8.360 nan 0.000 0.500 2348 G N 1.875 110.657 108.800 -0.030 0.000 2.147 2348 G HA2 -0.283 3.677 3.960 0.000 0.000 0.244 2348 G HA3 -0.283 3.677 3.960 0.000 0.000 0.244 2348 G C 0.243 175.124 174.900 -0.031 0.000 1.005 2348 G CA 0.146 45.228 45.100 -0.029 0.000 0.713 2348 G HN 0.257 nan 8.290 nan 0.000 0.515 2349 I N 1.150 121.699 120.570 -0.034 0.000 2.315 2349 I HA 0.442 4.612 4.170 0.000 0.000 0.291 2349 I C 1.018 177.100 176.117 -0.059 0.000 1.006 2349 I CA -1.143 60.132 61.300 -0.041 0.000 1.265 2349 I CB 1.563 39.543 38.000 -0.033 0.000 1.387 2349 I HN 0.151 nan 8.210 nan 0.000 0.475 2350 V N 3.826 123.694 119.914 -0.076 0.000 2.644 2350 V HA 0.937 5.058 4.120 0.000 0.000 0.295 2350 V C 0.050 176.043 176.094 -0.167 0.000 1.053 2350 V CA -0.227 62.011 62.300 -0.103 0.000 0.987 2350 V CB 1.265 33.030 31.823 -0.097 0.000 1.006 2350 V HN 0.855 nan 8.190 nan 0.000 0.472 2351 A N 3.234 125.950 122.820 -0.173 0.000 2.594 2351 A HA 1.004 5.324 4.320 0.000 0.000 0.295 2351 A C -0.468 177.000 177.584 -0.193 0.000 1.071 2351 A CA -0.330 51.577 52.037 -0.217 0.000 0.685 2351 A CB 1.742 20.669 19.000 -0.122 0.000 1.285 2351 A HN 2.449 nan 8.150 nan 0.000 0.405 2352 A N 1.434 124.120 122.820 -0.224 0.000 2.398 2352 A HA 0.764 5.084 4.320 0.000 0.000 0.301 2352 A C -0.153 177.428 177.584 -0.005 0.000 1.041 2352 A CA -0.551 51.434 52.037 -0.088 0.000 0.711 2352 A CB 0.944 19.916 19.000 -0.047 0.000 1.240 2352 A HN 1.352 nan 8.150 nan 0.000 0.420 2353 R N 1.691 122.201 120.500 0.016 0.000 2.608 2353 R HA 0.731 5.071 4.340 0.000 0.000 0.255 2353 R C -0.346 175.982 176.300 0.048 0.000 1.086 2353 R CA -0.742 55.378 56.100 0.033 0.000 1.125 2353 R CB 0.400 30.711 30.300 0.019 0.000 1.193 2353 R HN 0.504 nan 8.270 nan 0.000 0.553 2354 R N -0.943 119.582 120.500 0.043 0.000 3.516 2354 R HA -0.110 4.230 4.340 0.000 0.000 0.271 2354 R C -0.712 175.615 176.300 0.045 0.000 1.098 2354 R CA 0.571 56.693 56.100 0.037 0.000 0.732 2354 R CB -2.661 27.655 30.300 0.026 0.000 1.152 2354 R HN 0.527 nan 8.270 nan 0.000 0.455 2355 V N 1.510 121.464 119.914 0.067 0.000 2.572 2355 V HA 0.035 4.155 4.120 0.000 0.000 0.291 2355 V C 1.492 177.605 176.094 0.031 0.000 1.039 2355 V CA -0.129 62.215 62.300 0.073 0.000 1.055 2355 V CB 1.166 33.069 31.823 0.134 0.000 0.969 2355 V HN 0.148 nan 8.190 nan 0.000 0.482 2356 K N 4.139 124.545 120.400 0.010 0.000 2.484 2356 K HA -0.026 4.295 4.320 0.000 0.000 0.280 2356 K C 1.377 177.968 176.600 -0.015 0.000 1.013 2356 K CA 0.091 56.374 56.287 -0.006 0.000 1.029 2356 K CB 0.321 32.810 32.500 -0.017 0.000 0.902 2356 K HN 0.710 nan 8.250 nan 0.000 0.481 2357 K N 2.299 122.692 120.400 -0.010 0.000 2.113 2357 K HA -0.219 4.102 4.320 0.000 0.000 0.208 2357 K C 1.863 178.446 176.600 -0.028 0.000 1.047 2357 K CA 2.026 58.304 56.287 -0.014 0.000 0.928 2357 K CB -0.139 32.356 32.500 -0.008 0.000 0.716 2357 K HN 0.619 nan 8.250 nan 0.000 0.446 2358 S N 0.652 116.333 115.700 -0.031 0.000 2.368 2358 S HA -0.156 4.314 4.470 0.000 0.000 0.225 2358 S C 1.349 175.911 174.600 -0.062 0.000 1.030 2358 S CA 1.735 59.911 58.200 -0.040 0.000 0.999 2358 S CB -0.340 62.839 63.200 -0.036 0.000 0.844 2358 S HN 0.372 nan 8.310 nan 0.000 0.459 2359 D N 0.858 121.214 120.400 -0.074 0.000 2.144 2359 D HA -0.034 4.606 4.640 0.000 0.000 0.200 2359 D C 1.975 178.182 176.300 -0.155 0.000 0.978 2359 D CA 0.877 54.805 54.000 -0.120 0.000 0.833 2359 D CB -0.235 40.492 40.800 -0.121 0.000 0.961 2359 D HN 0.375 nan 8.370 nan 0.000 0.470 2360 M N 0.476 120.012 119.600 -0.106 0.000 2.159 2360 M HA -0.089 4.392 4.480 0.000 0.000 0.263 2360 M C 1.881 178.131 176.300 -0.084 0.000 1.063 2360 M CA 1.195 56.439 55.300 -0.093 0.000 1.110 2360 M CB -0.735 31.845 32.600 -0.034 0.000 1.374 2360 M HN 0.111 nan 8.290 nan 0.000 0.411 2361 E N -0.003 120.157 120.200 -0.067 0.000 2.107 2361 E HA -0.135 4.215 4.350 0.000 0.000 0.191 2361 E C 2.011 178.571 176.600 -0.068 0.000 0.982 2361 E CA 0.824 57.191 56.400 -0.054 0.000 0.809 2361 E CB 0.021 29.697 29.700 -0.040 0.000 0.756 2361 E HN 0.499 nan 8.360 nan 0.000 0.459 2362 K N 0.534 120.881 120.400 -0.088 0.000 2.148 2362 K HA -0.059 4.261 4.320 0.000 0.000 0.204 2362 K C 2.108 178.638 176.600 -0.117 0.000 1.050 2362 K CA 0.639 56.868 56.287 -0.095 0.000 0.942 2362 K CB 0.030 32.468 32.500 -0.104 0.000 0.724 2362 K HN 0.088 nan 8.250 nan 0.000 0.446 2363 L N 0.367 121.493 121.223 -0.161 0.000 2.093 2363 L HA -0.148 4.192 4.340 0.000 0.000 0.208 2363 L C 2.545 179.355 176.870 -0.101 0.000 1.085 2363 L CA 0.995 55.722 54.840 -0.188 0.000 0.755 2363 L CB -0.491 41.370 42.059 -0.329 0.000 0.904 2363 L HN 0.183 nan 8.230 nan 0.000 0.435 2364 A N 0.227 123.003 122.820 -0.073 0.000 1.877 2364 A HA -0.212 4.108 4.320 0.000 0.000 0.216 2364 A C 2.323 179.891 177.584 -0.026 0.000 1.186 2364 A CA 1.686 53.702 52.037 -0.035 0.000 0.620 2364 A CB -0.300 18.685 19.000 -0.026 0.000 0.822 2364 A HN 0.316 nan 8.150 nan 0.000 0.443 2365 K N -0.436 119.943 120.400 -0.035 0.000 2.103 2365 K HA 0.068 4.388 4.320 0.000 0.000 0.204 2365 K C 2.340 178.923 176.600 -0.028 0.000 1.052 2365 K CA 0.937 57.208 56.287 -0.026 0.000 0.945 2365 K CB -0.256 32.224 32.500 -0.032 0.000 0.722 2365 K HN 0.426 nan 8.250 nan 0.000 0.443 2366 A N 1.345 124.139 122.820 -0.044 0.000 1.840 2366 A HA -0.146 4.174 4.320 0.000 0.000 0.214 2366 A C 2.329 179.901 177.584 -0.021 0.000 1.198 2366 A CA 2.213 54.223 52.037 -0.045 0.000 0.608 2366 A CB -1.098 17.866 19.000 -0.059 0.000 0.839 2366 A HN 0.437 nan 8.150 nan 0.000 0.443 2367 T N -4.156 110.389 114.554 -0.016 0.000 3.043 2367 T HA 0.356 4.706 4.350 0.000 0.000 0.263 2367 T C 1.424 176.137 174.700 0.021 0.000 1.094 2367 T CA 1.245 63.350 62.100 0.009 0.000 1.127 2367 T CB -0.155 68.723 68.868 0.017 0.000 0.905 2367 T HN 1.853 nan 8.240 nan 0.000 0.490 2368 G N 1.349 110.158 108.800 0.014 0.000 2.137 2368 G HA2 -0.000 3.960 3.960 0.000 0.000 0.237 2368 G HA3 -0.000 3.960 3.960 0.000 0.000 0.237 2368 G C 0.220 175.131 174.900 0.020 0.000 1.002 2368 G CA -0.039 45.074 45.100 0.022 0.000 0.702 2368 G HN 1.175 nan 8.290 nan 0.000 0.515 2369 A N -0.386 122.444 122.820 0.016 0.000 2.407 2369 A HA 0.623 4.943 4.320 0.000 0.000 0.248 2369 A C 0.418 178.012 177.584 0.016 0.000 1.082 2369 A CA 0.375 52.425 52.037 0.023 0.000 0.785 2369 A CB 0.475 19.494 19.000 0.032 0.000 1.020 2369 A HN 0.773 nan 8.150 nan 0.000 0.489 2370 N N 1.218 119.931 118.700 0.021 0.000 2.421 2370 N HA 0.371 5.111 4.740 0.000 0.000 0.285 2370 N C -0.879 174.643 175.510 0.019 0.000 1.027 2370 N CA -0.364 52.696 53.050 0.017 0.000 0.918 2370 N CB 1.307 39.804 38.487 0.016 0.000 1.152 2370 N HN 0.281 nan 8.380 nan 0.000 0.485 2371 V N 4.901 124.823 119.914 0.014 0.000 2.446 2371 V HA 0.180 4.300 4.120 0.000 0.000 0.276 2371 V C 0.257 176.361 176.094 0.018 0.000 1.030 2371 V CA -0.086 62.224 62.300 0.016 0.000 1.033 2371 V CB -0.269 31.559 31.823 0.008 0.000 0.993 2371 V HN 0.514 nan 8.190 nan 0.000 0.477 2372 I N 4.011 124.595 120.570 0.024 0.000 2.474 2372 I HA 0.455 4.625 4.170 0.000 0.000 0.294 2372 I C 0.976 177.106 176.117 0.022 0.000 1.005 2372 I CA -0.374 60.939 61.300 0.022 0.000 1.113 2372 I CB 1.477 39.491 38.000 0.023 0.000 1.289 2372 I HN 0.602 nan 8.210 nan 0.000 0.436 2373 A N 5.487 128.317 122.820 0.018 0.000 1.840 2373 A HA 0.360 4.680 4.320 0.000 0.000 0.214 2373 A C 1.109 178.704 177.584 0.018 0.000 1.198 2373 A CA 1.112 53.160 52.037 0.017 0.000 0.608 2373 A CB -0.155 18.853 19.000 0.014 0.000 0.839 2373 A HN 0.732 nan 8.150 nan 0.000 0.443 2374 A N -1.102 121.728 122.820 0.017 0.000 2.312 2374 A HA 0.651 4.971 4.320 0.000 0.000 0.328 2374 A C 0.824 178.418 177.584 0.016 0.000 1.158 2374 A CA -0.571 51.476 52.037 0.016 0.000 0.821 2374 A CB 0.400 19.408 19.000 0.013 0.000 1.170 2374 A HN 0.347 nan 8.150 nan 0.000 0.490 2375 I N 1.483 122.063 120.570 0.016 0.000 2.226 2375 I HA -0.287 3.883 4.170 0.000 0.000 0.245 2375 I C 2.780 178.904 176.117 0.012 0.000 1.100 2375 I CA 1.750 63.059 61.300 0.015 0.000 1.374 2375 I CB -0.270 37.738 38.000 0.015 0.000 1.057 2375 I HN 0.761 nan 8.210 nan 0.000 0.413 2376 A N 0.728 123.554 122.820 0.010 0.000 1.978 2376 A HA -0.183 4.137 4.320 0.000 0.000 0.220 2376 A C 2.447 180.035 177.584 0.008 0.000 1.170 2376 A CA 1.869 53.910 52.037 0.007 0.000 0.636 2376 A CB -0.716 18.288 19.000 0.006 0.000 0.810 2376 A HN 0.457 nan 8.150 nan 0.000 0.448 2377 A N -0.744 122.081 122.820 0.010 0.000 2.168 2377 A HA 0.308 4.628 4.320 0.000 0.000 0.215 2377 A C 0.991 178.582 177.584 0.011 0.000 1.152 2377 A CA -0.024 52.019 52.037 0.010 0.000 0.716 2377 A CB -0.466 18.541 19.000 0.011 0.000 0.794 2377 A HN 0.460 nan 8.150 nan 0.000 0.465 2378 L N 1.455 122.685 121.223 0.013 0.000 2.490 2378 L HA 0.214 4.554 4.340 0.000 0.000 0.274 2378 L C 0.668 177.544 176.870 0.011 0.000 1.201 2378 L CA 0.253 55.101 54.840 0.014 0.000 0.869 2378 L CB 0.569 42.638 42.059 0.015 0.000 1.123 2378 L HN 0.491 nan 8.230 nan 0.000 0.484 2379 S N 1.207 116.914 115.700 0.013 0.000 2.625 2379 S HA 0.569 5.039 4.470 0.000 0.000 0.271 2379 S C 0.357 174.964 174.600 0.013 0.000 1.161 2379 S CA -0.291 57.915 58.200 0.011 0.000 0.820 2379 S CB 1.520 64.725 63.200 0.009 0.000 1.137 2379 S HN 0.602 nan 8.310 nan 0.000 0.470 2380 A N 0.571 123.398 122.820 0.011 0.000 1.978 2380 A HA -0.133 4.187 4.320 0.000 0.000 0.220 2380 A C 2.057 179.650 177.584 0.014 0.000 1.170 2380 A CA 2.023 54.068 52.037 0.013 0.000 0.636 2380 A CB -1.110 17.896 19.000 0.010 0.000 0.810 2380 A HN 0.901 nan 8.150 nan 0.000 0.448 2381 Q N -0.794 119.013 119.800 0.012 0.000 2.369 2381 Q HA -0.144 4.196 4.340 0.000 0.000 0.206 2381 Q C 0.533 176.542 176.000 0.015 0.000 0.963 2381 Q CA 1.292 57.103 55.803 0.013 0.000 0.894 2381 Q CB 0.007 28.751 28.738 0.010 0.000 0.965 2381 Q HN 0.610 nan 8.270 nan 0.000 0.475 2382 D N -0.147 120.263 120.400 0.017 0.000 2.354 2382 D HA 0.079 4.719 4.640 0.000 0.000 0.209 2382 D C 0.122 176.437 176.300 0.025 0.000 1.015 2382 D CA 0.211 54.223 54.000 0.019 0.000 0.867 2382 D CB 0.392 41.203 40.800 0.019 0.000 0.933 2382 D HN 0.272 nan 8.370 nan 0.000 0.520 2383 L N 0.706 121.945 121.223 0.027 0.000 2.395 2383 L HA 0.397 4.737 4.340 0.000 0.000 0.269 2383 L C 1.194 178.084 176.870 0.034 0.000 1.133 2383 L CA -0.502 54.358 54.840 0.034 0.000 0.812 2383 L CB 1.204 43.282 42.059 0.032 0.000 1.125 2383 L HN -0.138 nan 8.230 nan 0.000 0.452 2384 G N 0.531 109.357 108.800 0.043 0.000 2.491 2384 G HA2 0.499 4.459 3.960 0.000 0.000 0.327 2384 G HA3 0.499 4.459 3.960 0.000 0.000 0.327 2384 G C -1.341 173.587 174.900 0.046 0.000 1.189 2384 G CA -0.424 44.701 45.100 0.041 0.000 0.956 2384 G HN 0.519 nan 8.290 nan 0.000 0.491 2385 D N -0.327 120.099 120.400 0.042 0.000 2.362 2385 D HA 0.657 5.297 4.640 0.000 0.000 0.247 2385 D C -0.269 176.059 176.300 0.046 0.000 1.050 2385 D CA 0.058 54.084 54.000 0.043 0.000 0.839 2385 D CB 1.979 42.801 40.800 0.037 0.000 1.283 2385 D HN 0.590 nan 8.370 nan 0.000 0.477 2386 A N 0.425 123.276 122.820 0.051 0.000 2.486 2386 A HA 0.649 4.969 4.320 0.000 0.000 0.300 2386 A C 1.001 178.614 177.584 0.049 0.000 1.048 2386 A CA -0.407 51.662 52.037 0.053 0.000 0.696 2386 A CB 1.670 20.712 19.000 0.071 0.000 1.278 2386 A HN 0.487 nan 8.150 nan 0.000 0.405 2387 G N 0.180 109.006 108.800 0.044 0.000 2.402 2387 G HA2 0.312 4.272 3.960 0.000 0.000 0.216 2387 G HA3 0.312 4.272 3.960 0.000 0.000 0.216 2387 G C 0.279 175.203 174.900 0.040 0.000 1.162 2387 G CA 1.659 46.782 45.100 0.038 0.000 0.777 2387 G HN 1.177 nan 8.290 nan 0.000 0.539 2388 L N -0.156 121.098 121.223 0.051 0.000 2.493 2388 L HA 0.639 4.979 4.340 0.000 0.000 0.265 2388 L C -1.413 175.507 176.870 0.083 0.000 0.954 2388 L CA -0.800 54.073 54.840 0.055 0.000 0.844 2388 L CB 2.545 44.630 42.059 0.043 0.000 1.302 2388 L HN -0.133 nan 8.230 nan 0.000 0.405 2389 V N 4.220 124.184 119.914 0.084 0.000 2.407 2389 V HA 0.637 4.758 4.120 0.000 0.000 0.291 2389 V C -0.535 175.617 176.094 0.096 0.000 1.018 2389 V CA -0.440 61.929 62.300 0.114 0.000 0.842 2389 V CB 1.455 33.347 31.823 0.114 0.000 0.996 2389 V HN 0.827 nan 8.190 nan 0.000 0.426 2390 E N 3.187 123.467 120.200 0.133 0.000 2.292 2390 E HA 0.412 4.762 4.350 0.000 0.000 0.272 2390 E C -1.038 175.658 176.600 0.160 0.000 0.881 2390 E CA -0.656 55.805 56.400 0.102 0.000 0.754 2390 E CB 2.194 31.922 29.700 0.047 0.000 1.201 2390 E HN 0.751 nan 8.360 nan 0.000 0.425 2391 E N 4.310 124.575 120.200 0.108 0.000 2.130 2391 E HA 0.261 4.611 4.350 0.000 0.000 0.284 2391 E C -0.898 175.761 176.600 0.097 0.000 1.018 2391 E CA -0.286 56.189 56.400 0.125 0.000 0.817 2391 E CB 0.698 30.442 29.700 0.072 0.000 1.078 2391 E HN 0.354 nan 8.360 nan 0.000 0.396 2392 R N 3.427 124.021 120.500 0.158 0.000 2.807 2392 R HA 0.381 4.721 4.340 0.000 0.000 0.276 2392 R C -0.740 175.631 176.300 0.118 0.000 0.979 2392 R CA -0.964 55.178 56.100 0.070 0.000 0.928 2392 R CB 1.880 32.116 30.300 -0.106 0.000 1.191 2392 R HN 0.321 nan 8.270 nan 0.000 0.471 2393 K N 2.489 122.923 120.400 0.057 0.000 2.262 2393 K HA 0.335 4.655 4.320 0.000 0.000 0.282 2393 K C -0.483 176.157 176.600 0.066 0.000 1.066 2393 K CA -0.328 55.995 56.287 0.061 0.000 0.901 2393 K CB 0.793 33.311 32.500 0.031 0.000 1.089 2393 K HN 0.255 nan 8.250 nan 0.000 0.476 2394 I N 2.523 123.154 120.570 0.100 0.000 2.359 2394 I HA 0.051 4.221 4.170 0.000 0.000 0.284 2394 I C 0.700 176.854 176.117 0.061 0.000 1.018 2394 I CA -0.179 61.182 61.300 0.101 0.000 1.173 2394 I CB 0.656 38.761 38.000 0.175 0.000 1.326 2394 I HN 0.727 nan 8.210 nan 0.000 0.462 2395 S N 4.551 120.275 115.700 0.041 0.000 3.635 2395 S HA -0.212 4.258 4.470 0.000 0.000 0.328 2395 S C 1.389 176.002 174.600 0.022 0.000 1.135 2395 S CA 1.543 59.759 58.200 0.025 0.000 0.942 2395 S CB -1.046 62.167 63.200 0.022 0.000 0.930 2395 S HN 1.472 nan 8.310 nan 0.000 0.512 2396 G N -0.049 108.766 108.800 0.025 0.000 2.363 2396 G HA2 -0.283 3.677 3.960 0.000 0.000 0.238 2396 G HA3 -0.283 3.677 3.960 0.000 0.000 0.238 2396 G C -0.295 174.622 174.900 0.028 0.000 1.062 2396 G CA 0.306 45.419 45.100 0.022 0.000 0.629 2396 G HN 0.686 nan 8.290 nan 0.000 0.514 2397 D N 1.893 122.312 120.400 0.032 0.000 2.425 2397 D HA 0.460 5.100 4.640 0.000 0.000 0.247 2397 D C 1.020 177.352 176.300 0.053 0.000 1.147 2397 D CA 0.823 54.844 54.000 0.034 0.000 0.879 2397 D CB 1.275 42.092 40.800 0.027 0.000 1.179 2397 D HN 0.652 nan 8.370 nan 0.000 0.456 2398 S N 2.389 118.117 115.700 0.048 0.000 2.488 2398 S HA 0.461 4.931 4.470 0.000 0.000 0.278 2398 S C 0.129 174.771 174.600 0.070 0.000 1.259 2398 S CA -0.610 57.628 58.200 0.063 0.000 1.061 2398 S CB 0.502 63.730 63.200 0.046 0.000 0.910 2398 S HN 0.365 nan 8.310 nan 0.000 0.491 2399 M N 2.901 122.570 119.600 0.115 0.000 2.550 2399 M HA 0.517 4.997 4.480 0.000 0.000 0.292 2399 M C -1.094 175.296 176.300 0.150 0.000 1.221 2399 M CA -0.576 54.775 55.300 0.084 0.000 0.873 2399 M CB 2.283 34.907 32.600 0.040 0.000 1.727 2399 M HN 0.549 nan 8.290 nan 0.000 0.459 2400 I N 1.781 122.384 120.570 0.056 0.000 2.362 2400 I HA 0.367 4.538 4.170 0.000 0.000 0.289 2400 I C -1.332 174.794 176.117 0.016 0.000 0.994 2400 I CA -0.389 60.995 61.300 0.140 0.000 1.158 2400 I CB 1.067 39.172 38.000 0.177 0.000 1.315 2400 I HN 0.467 nan 8.210 nan 0.000 0.451 2401 F N 6.114 126.102 119.950 0.062 0.000 2.334 2401 F HA 0.333 4.860 4.527 0.000 0.000 0.367 2401 F C 0.130 175.965 175.800 0.060 0.000 1.115 2401 F CA -0.676 57.351 58.000 0.046 0.000 1.116 2401 F CB 1.226 40.243 39.000 0.028 0.000 1.230 2401 F HN 0.037 nan 8.300 nan 0.000 0.484 2402 V N 4.651 124.655 119.914 0.149 0.000 2.304 2402 V HA 0.315 4.435 4.120 0.000 0.000 0.269 2402 V C -0.136 176.013 176.094 0.092 0.000 1.036 2402 V CA -0.516 61.858 62.300 0.124 0.000 0.840 2402 V CB 0.343 32.217 31.823 0.084 0.000 1.036 2402 V HN 0.793 nan 8.190 nan 0.000 0.466 2403 E N 3.159 123.423 120.200 0.107 0.000 2.423 2403 E HA 0.609 4.959 4.350 0.000 0.000 0.269 2403 E C -0.726 175.910 176.600 0.060 0.000 0.948 2403 E CA -0.856 55.596 56.400 0.086 0.000 0.802 2403 E CB 1.568 31.338 29.700 0.117 0.000 1.339 2403 E HN 0.206 nan 8.360 nan 0.000 0.445 2404 E N -0.794 119.433 120.200 0.045 0.000 2.416 2404 E HA -0.150 4.200 4.350 0.000 0.000 0.249 2404 E C -0.725 175.894 176.600 0.032 0.000 1.124 2404 E CA 0.570 56.990 56.400 0.034 0.000 0.732 2404 E CB -2.290 27.430 29.700 0.034 0.000 1.286 2404 E HN 0.567 nan 8.360 nan 0.000 0.394 2405 C N 0.640 119.955 119.300 0.026 0.000 2.676 2405 C HA 0.068 4.528 4.460 0.000 0.000 0.416 2405 C C 2.282 177.291 174.990 0.031 0.000 1.299 2405 C CA -0.156 58.876 59.018 0.024 0.000 2.048 2405 C CB 0.450 28.194 27.740 0.006 0.000 2.713 2405 C HN 0.410 nan 8.230 nan 0.000 0.624 2406 K N 0.629 121.058 120.400 0.047 0.000 1.969 2406 K HA -0.145 4.175 4.320 0.000 0.000 0.216 2406 K C 0.601 177.270 176.600 0.115 0.000 1.048 2406 K CA 1.714 58.043 56.287 0.070 0.000 0.948 2406 K CB -0.124 32.418 32.500 0.070 0.000 0.726 2406 K HN 0.749 nan 8.250 nan 0.000 0.442 2407 H N 0.621 119.695 119.070 0.006 0.000 2.569 2407 H HA 0.217 4.773 4.556 0.000 0.000 0.247 2407 H C -2.676 172.653 175.328 0.001 0.000 1.346 2407 H CA -2.319 53.732 56.048 0.004 0.000 1.502 2407 H CB 0.539 30.303 29.762 0.003 0.000 1.512 2407 H HN -0.020 nan 8.280 nan 0.000 0.502 2408 P HA 0.075 nan 4.420 nan 0.000 0.271 2408 P C 0.317 177.478 177.300 -0.232 0.000 1.220 2408 P CA -0.264 62.747 63.100 -0.147 0.000 0.768 2408 P CB 1.668 33.309 31.700 -0.099 0.000 0.848 2409 K N 1.618 121.939 120.400 -0.131 0.000 2.374 2409 K HA 0.317 4.637 4.320 0.000 0.000 0.196 2409 K C -0.040 176.515 176.600 -0.075 0.000 1.023 2409 K CA -0.081 56.145 56.287 -0.102 0.000 1.103 2409 K CB 0.361 32.839 32.500 -0.037 0.000 0.848 2409 K HN 0.576 nan 8.250 nan 0.000 0.528 2410 A N 0.955 123.730 122.820 -0.075 0.000 2.427 2410 A HA 0.528 4.848 4.320 0.000 0.000 0.298 2410 A C -0.941 176.604 177.584 -0.065 0.000 1.036 2410 A CA -0.740 51.259 52.037 -0.063 0.000 0.701 2410 A CB 1.467 20.430 19.000 -0.061 0.000 1.250 2410 A HN 0.042 nan 8.150 nan 0.000 0.412 2411 V N -0.795 119.085 119.914 -0.057 0.000 3.074 2411 V HA 0.969 5.089 4.120 0.000 0.000 0.314 2411 V C -0.429 175.636 176.094 -0.049 0.000 1.117 2411 V CA -0.612 61.659 62.300 -0.049 0.000 1.014 2411 V CB 1.722 33.521 31.823 -0.041 0.000 1.057 2411 V HN 0.826 nan 8.190 nan 0.000 0.438 2412 T N 3.977 118.504 114.554 -0.045 0.000 2.841 2412 T HA 0.552 4.902 4.350 0.000 0.000 0.285 2412 T C -0.572 174.109 174.700 -0.032 0.000 0.991 2412 T CA -0.208 61.860 62.100 -0.053 0.000 0.966 2412 T CB 1.358 70.173 68.868 -0.089 0.000 0.962 2412 T HN 0.956 nan 8.240 nan 0.000 0.438 2413 M N 4.625 124.208 119.600 -0.028 0.000 2.101 2413 M HA 0.544 5.024 4.480 0.000 0.000 0.340 2413 M C -1.421 174.873 176.300 -0.010 0.000 1.057 2413 M CA -1.087 54.207 55.300 -0.009 0.000 0.984 2413 M CB 0.564 33.159 32.600 -0.008 0.000 1.560 2413 M HN 0.484 nan 8.290 nan 0.000 0.435 2414 L N 7.059 128.289 121.223 0.013 0.000 2.257 2414 L HA 0.518 4.858 4.340 0.000 0.000 0.290 2414 L C -1.386 175.502 176.870 0.030 0.000 1.044 2414 L CA -0.034 54.819 54.840 0.022 0.000 0.810 2414 L CB 0.806 42.908 42.059 0.071 0.000 1.193 2414 L HN 0.674 nan 8.230 nan 0.000 0.425 2415 I N 5.965 126.545 120.570 0.017 0.000 2.331 2415 I HA 0.480 4.651 4.170 0.000 0.000 0.292 2415 I C 0.163 176.294 176.117 0.022 0.000 0.998 2415 I CA -0.074 61.236 61.300 0.017 0.000 1.267 2415 I CB 0.686 38.692 38.000 0.009 0.000 1.386 2415 I HN 0.522 nan 8.210 nan 0.000 0.476 2416 R N 3.993 124.507 120.500 0.024 0.000 2.873 2416 R HA 0.944 5.284 4.340 0.000 0.000 0.264 2416 R C -0.231 176.080 176.300 0.019 0.000 1.026 2416 R CA -1.153 54.961 56.100 0.024 0.000 1.002 2416 R CB 1.797 32.114 30.300 0.028 0.000 1.174 2416 R HN 0.821 nan 8.270 nan 0.000 0.488 2417 G N -0.872 107.938 108.800 0.017 0.000 2.340 2417 G HA2 0.061 4.021 3.960 0.000 0.000 0.298 2417 G HA3 0.061 4.021 3.960 0.000 0.000 0.298 2417 G C -0.009 174.900 174.900 0.015 0.000 1.498 2417 G CA -0.560 44.550 45.100 0.017 0.000 0.847 2417 G HN 0.303 nan 8.290 nan 0.000 0.594 2418 T N 0.372 114.936 114.554 0.017 0.000 2.915 2418 T HA 0.200 4.550 4.350 0.000 0.000 0.269 2418 T C 0.865 175.575 174.700 0.015 0.000 1.071 2418 T CA 2.027 64.137 62.100 0.016 0.000 1.132 2418 T CB -0.162 68.717 68.868 0.019 0.000 0.878 2418 T HN 0.666 nan 8.240 nan 0.000 0.479 2419 T N -0.172 114.392 114.554 0.017 0.000 2.889 2419 T HA 0.280 4.630 4.350 0.000 0.000 0.315 2419 T C 0.604 175.297 174.700 -0.012 0.000 1.291 2419 T CA -0.746 61.359 62.100 0.009 0.000 1.028 2419 T CB 2.550 71.441 68.868 0.038 0.000 1.235 2419 T HN -0.081 nan 8.240 nan 0.000 0.491 2420 E N 0.798 120.955 120.200 -0.073 0.000 2.086 2420 E HA -0.256 4.094 4.350 0.000 0.000 0.200 2420 E C 1.543 178.062 176.600 -0.136 0.000 1.012 2420 E CA 2.053 58.367 56.400 -0.144 0.000 0.812 2420 E CB -0.127 29.419 29.700 -0.258 0.000 0.743 2420 E HN 0.626 nan 8.360 nan 0.000 0.453 2421 H N -0.935 118.138 119.070 0.004 0.000 2.495 2421 H HA 0.014 4.570 4.556 0.000 0.000 0.287 2421 H C 2.123 177.453 175.328 0.004 0.000 1.033 2421 H CA 1.213 57.262 56.048 0.003 0.000 1.307 2421 H CB -0.010 29.753 29.762 0.002 0.000 1.401 2421 H HN 0.120 nan 8.280 nan 0.000 0.555 2422 V N 2.035 122.014 119.914 0.109 0.000 2.283 2422 V HA -0.211 3.909 4.120 0.000 0.000 0.243 2422 V C 2.673 178.793 176.094 0.043 0.000 1.039 2422 V CA 1.745 64.083 62.300 0.064 0.000 1.016 2422 V CB -0.571 31.280 31.823 0.046 0.000 0.650 2422 V HN 0.408 nan 8.190 nan 0.000 0.449 2423 I N -1.017 119.568 120.570 0.026 0.000 2.614 2423 I HA -0.161 4.009 4.170 0.000 0.000 0.258 2423 I C 2.256 178.382 176.117 0.016 0.000 1.189 2423 I CA 1.904 63.213 61.300 0.015 0.000 1.462 2423 I CB -0.520 37.483 38.000 0.003 0.000 1.092 2423 I HN 0.427 nan 8.210 nan 0.000 0.442 2424 E N 1.863 122.079 120.200 0.025 0.000 2.047 2424 E HA -0.293 4.057 4.350 0.000 0.000 0.191 2424 E C 2.210 178.834 176.600 0.040 0.000 0.987 2424 E CA 1.386 57.807 56.400 0.035 0.000 0.799 2424 E CB -0.100 29.642 29.700 0.069 0.000 0.752 2424 E HN 0.681 nan 8.360 nan 0.000 0.449 2425 E N -0.173 120.057 120.200 0.049 0.000 2.106 2425 E HA -0.146 4.204 4.350 0.000 0.000 0.192 2425 E C 2.069 178.684 176.600 0.025 0.000 0.984 2425 E CA 1.091 57.513 56.400 0.036 0.000 0.806 2425 E CB 0.245 29.968 29.700 0.037 0.000 0.750 2425 E HN 0.168 nan 8.360 nan 0.000 0.458 2426 V N 1.039 120.967 119.914 0.024 0.000 2.379 2426 V HA -0.209 3.911 4.120 0.000 0.000 0.245 2426 V C 2.428 178.529 176.094 0.013 0.000 1.044 2426 V CA 1.630 63.941 62.300 0.018 0.000 1.036 2426 V CB -0.653 31.181 31.823 0.018 0.000 0.664 2426 V HN 0.408 nan 8.190 nan 0.000 0.453 2427 A N 0.550 123.376 122.820 0.011 0.000 1.908 2427 A HA -0.292 4.028 4.320 0.000 0.000 0.218 2427 A C 2.304 179.892 177.584 0.005 0.000 1.181 2427 A CA 2.370 54.410 52.037 0.005 0.000 0.627 2427 A CB -0.537 18.464 19.000 0.002 0.000 0.818 2427 A HN 0.482 nan 8.150 nan 0.000 0.445 2428 R N 0.083 120.589 120.500 0.010 0.000 2.075 2428 R HA 0.010 4.350 4.340 0.000 0.000 0.232 2428 R C 2.152 178.457 176.300 0.008 0.000 1.126 2428 R CA 1.921 58.026 56.100 0.009 0.000 0.963 2428 R CB -0.842 29.465 30.300 0.012 0.000 0.858 2428 R HN 0.377 nan 8.270 nan 0.000 0.435 2429 A N 0.200 123.027 122.820 0.011 0.000 1.877 2429 A HA -0.122 4.198 4.320 0.000 0.000 0.216 2429 A C 2.241 179.830 177.584 0.008 0.000 1.186 2429 A CA 1.983 54.027 52.037 0.011 0.000 0.620 2429 A CB -0.952 18.057 19.000 0.015 0.000 0.822 2429 A HN 0.333 nan 8.150 nan 0.000 0.443 2430 V N -2.324 117.594 119.914 0.007 0.000 2.871 2430 V HA -0.130 3.990 4.120 0.000 0.000 0.256 2430 V C 1.927 178.021 176.094 0.001 0.000 1.082 2430 V CA 2.058 64.361 62.300 0.004 0.000 1.105 2430 V CB -0.709 31.116 31.823 0.003 0.000 0.713 2430 V HN 0.542 nan 8.190 nan 0.000 0.473 2431 D N 1.526 121.926 120.400 0.000 0.000 2.123 2431 D HA -0.258 4.382 4.640 0.000 0.000 0.196 2431 D C 1.602 177.902 176.300 -0.001 0.000 0.992 2431 D CA 2.262 56.261 54.000 -0.002 0.000 0.833 2431 D CB -0.069 40.730 40.800 -0.002 0.000 0.954 2431 D HN 0.612 nan 8.370 nan 0.000 0.455 2432 D N -0.033 120.367 120.400 0.002 0.000 2.149 2432 D HA -0.017 4.623 4.640 0.000 0.000 0.201 2432 D C 2.012 178.314 176.300 0.003 0.000 0.972 2432 D CA 1.203 55.205 54.000 0.003 0.000 0.835 2432 D CB -0.240 40.563 40.800 0.005 0.000 0.966 2432 D HN 0.240 nan 8.370 nan 0.000 0.476 2433 A N 0.407 123.229 122.820 0.004 0.000 1.933 2433 A HA -0.144 4.177 4.320 0.000 0.000 0.218 2433 A C 2.335 179.919 177.584 0.001 0.000 1.175 2433 A CA 1.064 53.103 52.037 0.004 0.000 0.628 2433 A CB -0.788 18.214 19.000 0.004 0.000 0.814 2433 A HN 0.149 nan 8.150 nan 0.000 0.444 2434 V N -0.075 119.838 119.914 -0.001 0.000 2.343 2434 V HA -0.182 3.938 4.120 0.000 0.000 0.247 2434 V C 2.805 178.898 176.094 -0.003 0.000 1.051 2434 V CA 1.887 64.185 62.300 -0.004 0.000 1.036 2434 V CB -1.436 30.383 31.823 -0.007 0.000 0.654 2434 V HN 0.618 nan 8.190 nan 0.000 0.451 2435 G N 0.549 109.348 108.800 -0.002 0.000 2.446 2435 G HA2 -0.231 3.729 3.960 0.000 0.000 0.217 2435 G HA3 -0.231 3.729 3.960 0.000 0.000 0.217 2435 G C 1.694 176.594 174.900 0.000 0.000 1.168 2435 G CA 1.672 46.771 45.100 -0.001 0.000 0.771 2435 G HN 0.603 nan 8.290 nan 0.000 0.551 2436 V N -1.721 118.193 119.914 0.001 0.000 2.788 2436 V HA 0.068 4.189 4.120 0.000 0.000 0.251 2436 V C 2.566 178.662 176.094 0.002 0.000 1.068 2436 V CA 1.170 63.472 62.300 0.003 0.000 1.090 2436 V CB -0.182 31.644 31.823 0.005 0.000 0.710 2436 V HN 0.123 nan 8.190 nan 0.000 0.467 2437 V N 1.846 121.761 119.914 0.001 0.000 2.719 2437 V HA 0.077 4.197 4.120 0.000 0.000 0.252 2437 V C 2.783 178.877 176.094 -0.000 0.000 1.065 2437 V CA 1.857 64.157 62.300 0.001 0.000 1.086 2437 V CB -0.819 31.003 31.823 -0.001 0.000 0.700 2437 V HN 0.616 nan 8.190 nan 0.000 0.467 2438 G N -1.233 107.567 108.800 -0.001 0.000 2.421 2438 G HA2 -0.208 3.752 3.960 0.000 0.000 0.217 2438 G HA3 -0.208 3.752 3.960 0.000 0.000 0.217 2438 G C 1.682 176.582 174.900 0.000 0.000 1.143 2438 G CA 1.157 46.256 45.100 -0.001 0.000 0.784 2438 G HN 0.527 nan 8.290 nan 0.000 0.541 2439 C N 0.620 119.921 119.300 0.001 0.000 2.429 2439 C HA -0.013 4.447 4.460 0.000 0.000 0.277 2439 C C 3.184 178.175 174.990 0.002 0.000 1.262 2439 C CA 1.514 60.533 59.018 0.002 0.000 1.733 2439 C CB -0.923 26.819 27.740 0.002 0.000 2.010 2439 C HN 0.414 nan 8.230 nan 0.000 0.483 2440 T N 1.033 115.588 114.554 0.003 0.000 2.915 2440 T HA -0.005 4.346 4.350 0.000 0.000 0.269 2440 T C 1.574 176.276 174.700 0.003 0.000 1.071 2440 T CA 1.061 63.163 62.100 0.003 0.000 1.132 2440 T CB -0.192 68.678 68.868 0.003 0.000 0.878 2440 T HN 0.504 nan 8.240 nan 0.000 0.479 2441 I N 0.528 121.099 120.570 0.003 0.000 2.333 2441 I HA -0.040 4.130 4.170 0.000 0.000 0.246 2441 I C 2.549 178.668 176.117 0.003 0.000 1.106 2441 I CA 1.117 62.419 61.300 0.003 0.000 1.411 2441 I CB -0.163 37.839 38.000 0.003 0.000 1.082 2441 I HN 0.244 nan 8.210 nan 0.000 0.420 2442 E N -0.081 120.121 120.200 0.003 0.000 2.072 2442 E HA -0.142 4.208 4.350 0.000 0.000 0.190 2442 E C 0.508 177.109 176.600 0.003 0.000 0.982 2442 E CA 0.719 57.121 56.400 0.003 0.000 0.803 2442 E CB 0.245 29.946 29.700 0.003 0.000 0.755 2442 E HN 0.191 nan 8.360 nan 0.000 0.453 2443 D N -0.585 119.817 120.400 0.003 0.000 2.454 2443 D HA 0.126 4.766 4.640 0.000 0.000 0.247 2443 D C -0.077 176.225 176.300 0.003 0.000 1.129 2443 D CA -0.302 53.700 54.000 0.003 0.000 0.877 2443 D CB 1.348 42.149 40.800 0.003 0.000 1.082 2443 D HN 0.088 nan 8.370 nan 0.000 0.537 2444 G N 3.209 112.011 108.800 0.003 0.000 3.332 2444 G HA2 0.031 3.991 3.960 0.000 0.000 0.242 2444 G HA3 0.031 3.991 3.960 0.000 0.000 0.242 2444 G C 0.476 175.378 174.900 0.004 0.000 1.276 2444 G CA -0.179 44.923 45.100 0.003 0.000 0.988 2444 G HN 0.204 nan 8.290 nan 0.000 0.517 2445 R N -0.342 120.160 120.500 0.004 0.000 2.562 2445 R HA 0.658 4.998 4.340 0.000 0.000 0.298 2445 R C -0.319 175.984 176.300 0.005 0.000 0.961 2445 R CA -0.639 55.464 56.100 0.005 0.000 0.881 2445 R CB 1.659 31.962 30.300 0.004 0.000 1.159 2445 R HN 0.294 nan 8.270 nan 0.000 0.450 2446 I N -0.918 119.655 120.570 0.007 0.000 3.145 2446 I HA 0.859 5.029 4.170 0.000 0.000 0.313 2446 I C -0.668 175.455 176.117 0.010 0.000 1.122 2446 I CA -1.254 60.051 61.300 0.008 0.000 0.987 2446 I CB 2.249 40.254 38.000 0.008 0.000 1.236 2446 I HN 0.336 nan 8.210 nan 0.000 0.453 2447 V N -0.255 119.666 119.914 0.013 0.000 3.049 2447 V HA 0.826 4.946 4.120 0.000 0.000 0.309 2447 V C 0.018 176.125 176.094 0.021 0.000 1.148 2447 V CA -0.380 61.931 62.300 0.017 0.000 0.990 2447 V CB 1.023 32.856 31.823 0.018 0.000 1.039 2447 V HN 1.178 nan 8.190 nan 0.000 0.430 2448 S N 1.949 117.666 115.700 0.028 0.000 2.576 2448 S HA 0.705 5.175 4.470 0.000 0.000 0.276 2448 S C 0.573 175.192 174.600 0.031 0.000 1.339 2448 S CA 0.178 58.397 58.200 0.032 0.000 1.039 2448 S CB 1.014 64.239 63.200 0.041 0.000 0.902 2448 S HN 1.826 nan 8.310 nan 0.000 0.516 2449 G N 0.147 108.966 108.800 0.031 0.000 2.630 2449 G HA2 0.532 4.492 3.960 0.000 0.000 0.223 2449 G HA3 0.532 4.492 3.960 0.000 0.000 0.223 2449 G C 0.925 175.842 174.900 0.028 0.000 1.434 2449 G CA -0.512 44.604 45.100 0.027 0.000 1.057 2449 G HN 2.055 nan 8.290 nan 0.000 0.570 2450 G N -2.047 106.768 108.800 0.025 0.000 2.153 2450 G HA2 0.221 4.181 3.960 0.000 0.000 0.252 2450 G HA3 0.221 4.181 3.960 0.000 0.000 0.252 2450 G C 1.525 176.423 174.900 -0.003 0.000 0.994 2450 G CA 1.157 46.268 45.100 0.020 0.000 0.698 2450 G HN 2.469 nan 8.290 nan 0.000 0.521 2451 G N -1.158 107.632 108.800 -0.017 0.000 2.168 2451 G HA2 -0.143 3.817 3.960 0.000 0.000 0.263 2451 G HA3 -0.143 3.817 3.960 0.000 0.000 0.263 2451 G C 1.500 176.357 174.900 -0.073 0.000 0.977 2451 G CA 1.767 46.840 45.100 -0.045 0.000 0.659 2451 G HN 1.981 nan 8.290 nan 0.000 0.533 2452 S N 0.086 115.762 115.700 -0.040 0.000 2.382 2452 S HA -0.160 4.311 4.470 0.000 0.000 0.228 2452 S C 2.799 177.337 174.600 -0.105 0.000 1.027 2452 S CA 2.656 60.821 58.200 -0.059 0.000 0.991 2452 S CB -0.593 62.679 63.200 0.120 0.000 0.823 2452 S HN 1.377 nan 8.310 nan 0.000 0.469 2453 T N 0.136 114.674 114.554 -0.027 0.000 2.569 2453 T HA -0.125 4.225 4.350 0.000 0.000 0.263 2453 T C 1.570 176.230 174.700 -0.066 0.000 1.074 2453 T CA 1.679 63.770 62.100 -0.014 0.000 1.176 2453 T CB -1.070 67.795 68.868 -0.004 0.000 0.863 2453 T HN 0.375 nan 8.240 nan 0.000 0.410 2454 E N 0.859 121.011 120.200 -0.080 0.000 2.219 2454 E HA -0.051 4.299 4.350 0.000 0.000 0.198 2454 E C 2.216 178.739 176.600 -0.128 0.000 0.998 2454 E CA 0.738 57.083 56.400 -0.092 0.000 0.818 2454 E CB -0.727 28.915 29.700 -0.096 0.000 0.741 2454 E HN 0.457 nan 8.360 nan 0.000 0.477 2455 V N 0.380 120.164 119.914 -0.216 0.000 2.453 2455 V HA -0.218 3.902 4.120 0.000 0.000 0.247 2455 V C 2.259 178.182 176.094 -0.285 0.000 1.048 2455 V CA 1.825 63.940 62.300 -0.309 0.000 1.049 2455 V CB -0.365 31.144 31.823 -0.524 0.000 0.672 2455 V HN 0.223 nan 8.190 nan 0.000 0.457 2456 E N 0.516 120.554 120.200 -0.269 0.000 2.051 2456 E HA -0.204 4.146 4.350 0.000 0.000 0.192 2456 E C 1.881 178.501 176.600 0.032 0.000 0.991 2456 E CA 1.448 57.883 56.400 0.059 0.000 0.799 2456 E CB -0.324 29.496 29.700 0.201 0.000 0.748 2456 E HN 0.368 nan 8.360 nan 0.000 0.449 2457 L N 0.357 121.578 121.223 -0.003 0.000 2.093 2457 L HA -0.052 4.288 4.340 0.000 0.000 0.208 2457 L C 2.410 179.294 176.870 0.022 0.000 1.085 2457 L CA 1.515 56.363 54.840 0.013 0.000 0.755 2457 L CB -0.879 41.185 42.059 0.010 0.000 0.904 2457 L HN 0.062 nan 8.230 nan 0.000 0.435 2458 S N -1.097 114.598 115.700 -0.009 0.000 2.356 2458 S HA -0.169 4.301 4.470 0.000 0.000 0.223 2458 S C 1.983 176.601 174.600 0.029 0.000 1.032 2458 S CA 1.227 59.428 58.200 0.001 0.000 1.005 2458 S CB -0.183 62.995 63.200 -0.037 0.000 0.867 2458 S HN 0.292 nan 8.310 nan 0.000 0.449 2459 M N 0.993 120.609 119.600 0.027 0.000 2.099 2459 M HA 0.007 4.487 4.480 0.000 0.000 0.262 2459 M C 1.997 178.336 176.300 0.064 0.000 1.067 2459 M CA 1.504 56.833 55.300 0.048 0.000 1.124 2459 M CB -1.167 31.472 32.600 0.064 0.000 1.353 2459 M HN 0.054 nan 8.290 nan 0.000 0.410 2460 K N 0.391 120.830 120.400 0.064 0.000 2.155 2460 K HA 0.072 4.393 4.320 0.000 0.000 0.203 2460 K C 1.960 178.621 176.600 0.101 0.000 1.052 2460 K CA 0.750 57.079 56.287 0.071 0.000 0.948 2460 K CB -0.428 32.101 32.500 0.048 0.000 0.728 2460 K HN 0.268 nan 8.250 nan 0.000 0.448 2461 L N -0.139 121.143 121.223 0.098 0.000 2.240 2461 L HA -0.057 4.283 4.340 0.000 0.000 0.211 2461 L C 2.113 179.094 176.870 0.185 0.000 1.106 2461 L CA 0.849 55.781 54.840 0.153 0.000 0.793 2461 L CB -0.171 41.978 42.059 0.150 0.000 0.927 2461 L HN 0.113 nan 8.230 nan 0.000 0.446 2462 R N 0.141 120.716 120.500 0.125 0.000 2.092 2462 R HA -0.148 4.192 4.340 0.000 0.000 0.231 2462 R C 2.046 178.401 176.300 0.093 0.000 1.119 2462 R CA 1.240 57.399 56.100 0.099 0.000 0.970 2462 R CB -0.171 30.170 30.300 0.068 0.000 0.864 2462 R HN 0.449 nan 8.270 nan 0.000 0.440 2463 E N -0.370 119.892 120.200 0.102 0.000 2.107 2463 E HA -0.200 4.150 4.350 0.000 0.000 0.191 2463 E C 1.581 178.249 176.600 0.113 0.000 0.982 2463 E CA 0.859 57.314 56.400 0.090 0.000 0.809 2463 E CB -0.100 29.652 29.700 0.086 0.000 0.756 2463 E HN 0.298 nan 8.360 nan 0.000 0.459 2464 Y N 1.382 121.694 120.300 0.021 0.000 2.181 2464 Y HA -0.207 4.343 4.550 0.000 0.000 0.288 2464 Y C 2.210 178.119 175.900 0.014 0.000 1.146 2464 Y CA 1.305 59.413 58.100 0.014 0.000 1.164 2464 Y CB -0.395 38.071 38.460 0.010 0.000 0.982 2464 Y HN -0.010 nan 8.280 nan 0.000 0.515 2465 A N -0.141 122.702 122.820 0.037 0.000 1.933 2465 A HA -0.225 4.095 4.320 0.000 0.000 0.218 2465 A C 2.103 179.647 177.584 -0.066 0.000 1.175 2465 A CA 1.884 53.906 52.037 -0.026 0.000 0.628 2465 A CB -0.790 18.246 19.000 0.061 0.000 0.814 2465 A HN 0.501 nan 8.150 nan 0.000 0.444 2466 E N -0.049 120.131 120.200 -0.033 0.000 2.110 2466 E HA -0.076 4.274 4.350 0.000 0.000 0.193 2466 E C 1.932 178.491 176.600 -0.068 0.000 0.988 2466 E CA 1.497 57.877 56.400 -0.032 0.000 0.804 2466 E CB -0.656 29.041 29.700 -0.005 0.000 0.745 2466 E HN 0.444 nan 8.360 nan 0.000 0.458 2467 G N 0.321 109.053 108.800 -0.113 0.000 2.421 2467 G HA2 -0.133 3.827 3.960 0.000 0.000 0.217 2467 G HA3 -0.133 3.827 3.960 0.000 0.000 0.217 2467 G C 1.433 176.221 174.900 -0.187 0.000 1.143 2467 G CA 0.614 45.630 45.100 -0.140 0.000 0.784 2467 G HN 0.201 nan 8.290 nan 0.000 0.541 2468 I N 0.367 120.778 120.570 -0.265 0.000 2.193 2468 I HA 0.005 4.175 4.170 0.000 0.000 0.240 2468 I C 1.704 177.749 176.117 -0.121 0.000 1.084 2468 I CA 1.084 62.244 61.300 -0.234 0.000 1.365 2468 I CB -1.091 36.744 38.000 -0.275 0.000 1.064 2468 I HN 0.298 nan 8.210 nan 0.000 0.410 2469 S N -1.235 114.411 115.700 -0.090 0.000 3.443 2469 S HA -0.117 4.353 4.470 0.000 0.000 0.635 2469 S C 0.766 175.344 174.600 -0.037 0.000 2.555 2469 S CA 1.445 59.615 58.200 -0.051 0.000 2.778 2469 S CB -1.357 61.815 63.200 -0.046 0.000 0.331 2469 S HN 1.427 nan 8.310 nan 0.000 1.765 2470 G N 1.143 109.927 108.800 -0.025 0.000 2.566 2470 G HA2 -0.337 3.623 3.960 0.000 0.000 0.280 2470 G HA3 -0.337 3.623 3.960 0.000 0.000 0.280 2470 G C 0.350 175.245 174.900 -0.007 0.000 1.225 2470 G CA 1.673 46.763 45.100 -0.017 0.000 0.966 2470 G HN 1.869 nan 8.290 nan 0.000 0.560 2471 R N 0.421 120.919 120.500 -0.003 0.000 2.223 2471 R HA 0.322 4.662 4.340 0.000 0.000 0.198 2471 R C 2.044 178.352 176.300 0.013 0.000 0.984 2471 R CA 1.361 57.465 56.100 0.008 0.000 1.018 2471 R CB -0.209 30.099 30.300 0.012 0.000 0.945 2471 R HN 0.640 nan 8.270 nan 0.000 0.479 2472 E N 2.085 122.288 120.200 0.003 0.000 2.204 2472 E HA -0.257 4.093 4.350 0.000 0.000 0.195 2472 E C 1.985 178.597 176.600 0.022 0.000 0.990 2472 E CA 1.616 58.021 56.400 0.008 0.000 0.821 2472 E CB -0.055 29.639 29.700 -0.010 0.000 0.750 2472 E HN 0.653 nan 8.360 nan 0.000 0.477 2473 Q N 0.841 120.645 119.800 0.007 0.000 2.124 2473 Q HA -0.188 4.152 4.340 0.000 0.000 0.202 2473 Q C 2.246 178.280 176.000 0.056 0.000 0.977 2473 Q CA 1.091 56.902 55.803 0.013 0.000 0.850 2473 Q CB -0.318 28.416 28.738 -0.006 0.000 0.901 2473 Q HN 0.223 nan 8.270 nan 0.000 0.429 2474 L N 1.208 122.465 121.223 0.056 0.000 2.083 2474 L HA -0.050 4.290 4.340 0.000 0.000 0.209 2474 L C 2.428 179.375 176.870 0.129 0.000 1.083 2474 L CA 2.025 56.910 54.840 0.076 0.000 0.752 2474 L CB -0.857 41.236 42.059 0.056 0.000 0.899 2474 L HN 0.338 nan 8.230 nan 0.000 0.433 2475 A N -1.347 121.557 122.820 0.141 0.000 1.902 2475 A HA -0.133 4.187 4.320 0.000 0.000 0.217 2475 A C 2.228 180.039 177.584 0.378 0.000 1.181 2475 A CA 1.925 54.115 52.037 0.256 0.000 0.623 2475 A CB -0.973 18.112 19.000 0.141 0.000 0.818 2475 A HN 0.289 nan 8.150 nan 0.000 0.443 2476 V N -0.122 119.935 119.914 0.238 0.000 2.453 2476 V HA -0.213 3.907 4.120 0.000 0.000 0.247 2476 V C 2.582 178.811 176.094 0.224 0.000 1.048 2476 V CA 1.999 64.435 62.300 0.227 0.000 1.049 2476 V CB -0.813 31.118 31.823 0.180 0.000 0.672 2476 V HN 0.508 nan 8.190 nan 0.000 0.457 2477 R N 0.385 120.985 120.500 0.168 0.000 2.081 2477 R HA -0.087 4.253 4.340 0.000 0.000 0.235 2477 R C 2.444 178.821 176.300 0.128 0.000 1.131 2477 R CA 1.492 57.669 56.100 0.128 0.000 0.960 2477 R CB -0.566 29.788 30.300 0.089 0.000 0.856 2477 R HN 0.520 nan 8.270 nan 0.000 0.436 2478 A N 0.565 123.482 122.820 0.163 0.000 1.930 2478 A HA -0.161 4.159 4.320 0.000 0.000 0.217 2478 A C 1.942 179.578 177.584 0.088 0.000 1.175 2478 A CA 0.888 53.011 52.037 0.143 0.000 0.627 2478 A CB -0.557 18.573 19.000 0.216 0.000 0.815 2478 A HN 0.341 nan 8.150 nan 0.000 0.443 2479 F N 0.917 120.837 119.950 -0.051 0.000 2.102 2479 F HA -0.088 4.439 4.527 0.000 0.000 0.298 2479 F C 2.538 178.253 175.800 -0.141 0.000 1.105 2479 F CA 1.336 59.177 58.000 -0.264 0.000 1.239 2479 F CB -0.264 38.549 39.000 -0.311 0.000 0.991 2479 F HN 0.255 nan 8.300 nan 0.000 0.474 2480 A N -0.158 122.755 122.820 0.155 0.000 1.877 2480 A HA -0.198 4.122 4.320 0.000 0.000 0.216 2480 A C 1.933 179.498 177.584 -0.031 0.000 1.186 2480 A CA 2.028 54.112 52.037 0.077 0.000 0.620 2480 A CB -0.982 18.087 19.000 0.116 0.000 0.822 2480 A HN 0.419 nan 8.150 nan 0.000 0.443 2481 D N -0.111 120.277 120.400 -0.021 0.000 2.178 2481 D HA 0.024 4.664 4.640 0.000 0.000 0.202 2481 D C 2.155 178.402 176.300 -0.089 0.000 0.974 2481 D CA 1.264 55.241 54.000 -0.039 0.000 0.841 2481 D CB -0.329 40.467 40.800 -0.008 0.000 0.953 2481 D HN 0.418 nan 8.370 nan 0.000 0.478 2482 A N 0.425 123.156 122.820 -0.148 0.000 1.972 2482 A HA -0.126 4.194 4.320 0.000 0.000 0.219 2482 A C 1.994 179.440 177.584 -0.230 0.000 1.169 2482 A CA 0.771 52.686 52.037 -0.204 0.000 0.635 2482 A CB -0.499 18.316 19.000 -0.308 0.000 0.810 2482 A HN 0.151 nan 8.150 nan 0.000 0.446 2483 L N 0.364 121.428 121.223 -0.265 0.000 2.353 2483 L HA -0.110 4.230 4.340 0.000 0.000 0.220 2483 L C 2.000 178.784 176.870 -0.143 0.000 1.133 2483 L CA 1.336 56.043 54.840 -0.222 0.000 0.798 2483 L CB -0.582 41.355 42.059 -0.204 0.000 0.922 2483 L HN 0.393 nan 8.230 nan 0.000 0.445 2484 E N -1.013 119.116 120.200 -0.117 0.000 2.409 2484 E HA -0.136 4.215 4.350 0.000 0.000 0.198 2484 E C 2.337 178.888 176.600 -0.081 0.000 1.024 2484 E CA 0.663 57.010 56.400 -0.088 0.000 0.861 2484 E CB -0.401 29.258 29.700 -0.068 0.000 0.788 2484 E HN 0.352 nan 8.360 nan 0.000 0.521 2485 V N 1.283 121.142 119.914 -0.092 0.000 2.568 2485 V HA -0.231 3.889 4.120 0.000 0.000 0.253 2485 V C 1.889 177.941 176.094 -0.070 0.000 1.072 2485 V CA 1.023 63.276 62.300 -0.077 0.000 1.084 2485 V CB -0.273 31.499 31.823 -0.085 0.000 0.676 2485 V HN 0.126 nan 8.190 nan 0.000 0.469 2486 I N 1.364 121.888 120.570 -0.077 0.000 2.133 2486 I HA -0.051 4.119 4.170 0.000 0.000 0.238 2486 I C 0.227 176.310 176.117 -0.058 0.000 1.074 2486 I CA 1.787 63.047 61.300 -0.067 0.000 1.342 2486 I CB -2.909 35.049 38.000 -0.070 0.000 1.053 2486 I HN 0.348 nan 8.210 nan 0.000 0.404 2487 P HA -0.145 nan 4.420 nan 0.000 0.221 2487 P C 1.750 179.022 177.300 -0.047 0.000 1.150 2487 P CA 1.388 64.458 63.100 -0.051 0.000 0.800 2487 P CB -0.130 31.538 31.700 -0.053 0.000 0.787 2488 R N -0.055 120.416 120.500 -0.049 0.000 2.066 2488 R HA -0.050 4.290 4.340 0.000 0.000 0.232 2488 R C 1.978 178.252 176.300 -0.043 0.000 1.131 2488 R CA 1.915 57.989 56.100 -0.043 0.000 0.955 2488 R CB -0.691 29.584 30.300 -0.043 0.000 0.851 2488 R HN 0.052 nan 8.270 nan 0.000 0.432 2489 T N 1.327 115.853 114.554 -0.047 0.000 2.942 2489 T HA 0.016 4.367 4.350 0.000 0.000 0.265 2489 T C 1.773 176.443 174.700 -0.050 0.000 1.062 2489 T CA 0.759 62.832 62.100 -0.046 0.000 1.139 2489 T CB -0.015 68.826 68.868 -0.046 0.000 0.883 2489 T HN 0.142 nan 8.240 nan 0.000 0.468 2490 L N 0.920 122.110 121.223 -0.054 0.000 2.042 2490 L HA -0.136 4.204 4.340 0.000 0.000 0.210 2490 L C 3.003 179.833 176.870 -0.067 0.000 1.076 2490 L CA 1.385 56.187 54.840 -0.063 0.000 0.749 2490 L CB -0.614 41.409 42.059 -0.060 0.000 0.893 2490 L HN 0.250 nan 8.230 nan 0.000 0.432 2491 A N -0.510 122.277 122.820 -0.055 0.000 1.929 2491 A HA -0.184 4.136 4.320 0.000 0.000 0.216 2491 A C 2.169 179.724 177.584 -0.049 0.000 1.176 2491 A CA 1.334 53.340 52.037 -0.051 0.000 0.628 2491 A CB -0.359 18.617 19.000 -0.040 0.000 0.816 2491 A HN 0.415 nan 8.150 nan 0.000 0.444 2492 E N 0.036 120.210 120.200 -0.044 0.000 2.058 2492 E HA -0.194 4.156 4.350 0.000 0.000 0.194 2492 E C 1.645 178.218 176.600 -0.044 0.000 0.997 2492 E CA 1.298 57.674 56.400 -0.040 0.000 0.801 2492 E CB -0.173 29.506 29.700 -0.036 0.000 0.746 2492 E HN 0.530 nan 8.360 nan 0.000 0.450 2493 N N 0.287 118.956 118.700 -0.052 0.000 2.244 2493 N HA -0.085 4.655 4.740 0.000 0.000 0.183 2493 N C 1.451 176.918 175.510 -0.071 0.000 1.016 2493 N CA 1.060 54.075 53.050 -0.058 0.000 0.866 2493 N CB -0.134 38.316 38.487 -0.062 0.000 0.980 2493 N HN 0.109 nan 8.380 nan 0.000 0.430 2494 A N -0.023 122.748 122.820 -0.082 0.000 2.067 2494 A HA 0.320 4.640 4.320 0.000 0.000 0.217 2494 A C 1.464 179.008 177.584 -0.066 0.000 1.156 2494 A CA 1.061 53.040 52.037 -0.096 0.000 0.683 2494 A CB -0.413 18.519 19.000 -0.114 0.000 0.808 2494 A HN 0.310 nan 8.150 nan 0.000 0.455 2495 G N -1.150 107.619 108.800 -0.051 0.000 2.171 2495 G HA2 -0.182 3.778 3.960 0.000 0.000 0.238 2495 G HA3 -0.182 3.778 3.960 0.000 0.000 0.238 2495 G C -0.060 174.821 174.900 -0.031 0.000 1.039 2495 G CA 0.318 45.396 45.100 -0.037 0.000 0.759 2495 G HN 0.446 nan 8.290 nan 0.000 0.501 2496 L N -0.091 121.112 121.223 -0.034 0.000 2.375 2496 L HA 0.484 4.824 4.340 0.000 0.000 0.268 2496 L C 0.478 177.334 176.870 -0.023 0.000 1.058 2496 L CA -1.074 53.749 54.840 -0.027 0.000 0.803 2496 L CB 0.930 42.971 42.059 -0.031 0.000 1.212 2496 L HN 0.112 nan 8.230 nan 0.000 0.451 2497 D N 1.054 121.444 120.400 -0.017 0.000 2.342 2497 D HA 0.118 4.758 4.640 0.000 0.000 0.260 2497 D C 0.739 177.030 176.300 -0.016 0.000 1.278 2497 D CA 0.117 54.109 54.000 -0.014 0.000 0.910 2497 D CB 1.732 42.526 40.800 -0.010 0.000 1.079 2497 D HN 0.632 nan 8.370 nan 0.000 0.496 2498 A N 5.460 128.269 122.820 -0.018 0.000 1.908 2498 A HA -0.196 4.124 4.320 0.000 0.000 0.218 2498 A C 2.158 179.733 177.584 -0.016 0.000 1.181 2498 A CA 0.863 52.888 52.037 -0.020 0.000 0.627 2498 A CB -0.269 18.717 19.000 -0.022 0.000 0.818 2498 A HN 0.704 nan 8.150 nan 0.000 0.445 2499 I N -0.162 120.400 120.570 -0.013 0.000 2.179 2499 I HA -0.213 3.957 4.170 0.000 0.000 0.242 2499 I C 2.452 178.565 176.117 -0.007 0.000 1.088 2499 I CA 1.868 63.163 61.300 -0.010 0.000 1.357 2499 I CB -1.462 36.534 38.000 -0.007 0.000 1.051 2499 I HN 0.601 nan 8.210 nan 0.000 0.409 2500 E N 1.483 121.680 120.200 -0.006 0.000 2.051 2500 E HA -0.229 4.122 4.350 0.000 0.000 0.192 2500 E C 2.342 178.941 176.600 -0.002 0.000 0.991 2500 E CA 1.799 58.197 56.400 -0.003 0.000 0.799 2500 E CB -0.110 29.589 29.700 -0.003 0.000 0.748 2500 E HN 0.610 nan 8.360 nan 0.000 0.449 2501 I N -1.415 119.152 120.570 -0.005 0.000 2.439 2501 I HA -0.163 4.007 4.170 0.000 0.000 0.251 2501 I C 2.225 178.339 176.117 -0.006 0.000 1.139 2501 I CA 0.874 62.171 61.300 -0.005 0.000 1.438 2501 I CB -0.340 37.654 38.000 -0.010 0.000 1.085 2501 I HN 0.073 nan 8.210 nan 0.000 0.427 2502 L N 0.779 121.996 121.223 -0.010 0.000 2.093 2502 L HA -0.110 4.230 4.340 0.000 0.000 0.208 2502 L C 2.681 179.548 176.870 -0.005 0.000 1.085 2502 L CA 0.809 55.641 54.840 -0.013 0.000 0.755 2502 L CB -0.405 41.644 42.059 -0.017 0.000 0.904 2502 L HN 0.168 nan 8.230 nan 0.000 0.435 2503 V N -0.267 119.647 119.914 -0.001 0.000 2.323 2503 V HA -0.231 3.889 4.120 0.000 0.000 0.244 2503 V C 2.377 178.478 176.094 0.012 0.000 1.041 2503 V CA 1.650 63.953 62.300 0.005 0.000 1.025 2503 V CB -0.382 31.444 31.823 0.005 0.000 0.656 2503 V HN 0.384 nan 8.190 nan 0.000 0.451 2504 K N -0.369 120.038 120.400 0.011 0.000 2.103 2504 K HA -0.047 4.273 4.320 0.000 0.000 0.204 2504 K C 2.046 178.662 176.600 0.026 0.000 1.052 2504 K CA 1.005 57.302 56.287 0.017 0.000 0.945 2504 K CB -0.187 32.321 32.500 0.013 0.000 0.722 2504 K HN 0.292 nan 8.250 nan 0.000 0.443 2505 V N 1.183 121.111 119.914 0.023 0.000 2.323 2505 V HA -0.175 3.945 4.120 0.000 0.000 0.244 2505 V C 2.356 178.484 176.094 0.057 0.000 1.041 2505 V CA 1.460 63.781 62.300 0.035 0.000 1.025 2505 V CB -0.394 31.436 31.823 0.012 0.000 0.656 2505 V HN 0.270 nan 8.190 nan 0.000 0.451 2506 R N 0.093 120.611 120.500 0.030 0.000 2.081 2506 R HA -0.164 4.176 4.340 0.000 0.000 0.235 2506 R C 2.292 178.640 176.300 0.080 0.000 1.131 2506 R CA 1.720 57.843 56.100 0.037 0.000 0.960 2506 R CB -0.411 29.894 30.300 0.009 0.000 0.856 2506 R HN 0.500 nan 8.270 nan 0.000 0.436 2507 A N 0.494 123.347 122.820 0.055 0.000 1.873 2507 A HA -0.050 4.270 4.320 0.000 0.000 0.215 2507 A C 2.316 179.933 177.584 0.054 0.000 1.186 2507 A CA 1.538 53.604 52.037 0.049 0.000 0.616 2507 A CB -0.754 18.264 19.000 0.031 0.000 0.823 2507 A HN 0.506 nan 8.150 nan 0.000 0.442 2508 A N -0.984 121.869 122.820 0.056 0.000 1.933 2508 A HA -0.148 4.172 4.320 0.000 0.000 0.218 2508 A C 1.984 179.600 177.584 0.053 0.000 1.175 2508 A CA 2.072 54.136 52.037 0.046 0.000 0.628 2508 A CB -0.848 18.177 19.000 0.042 0.000 0.814 2508 A HN 0.806 nan 8.150 nan 0.000 0.444 2509 H N -0.114 118.959 119.070 0.005 0.000 2.293 2509 H HA 0.049 4.605 4.556 0.000 0.000 0.300 2509 H C 2.179 177.511 175.328 0.005 0.000 1.082 2509 H CA 2.062 58.113 56.048 0.005 0.000 1.308 2509 H CB -0.245 29.519 29.762 0.004 0.000 1.375 2509 H HN 0.367 nan 8.280 nan 0.000 0.495 2510 A N -0.542 122.334 122.820 0.094 0.000 1.940 2510 A HA -0.187 4.133 4.320 0.000 0.000 0.219 2510 A C 2.582 180.146 177.584 -0.032 0.000 1.176 2510 A CA 2.008 54.072 52.037 0.045 0.000 0.631 2510 A CB -1.064 17.989 19.000 0.088 0.000 0.814 2510 A HN 0.529 nan 8.150 nan 0.000 0.446 2511 S N -0.492 115.193 115.700 -0.024 0.000 2.341 2511 S HA -0.087 4.383 4.470 0.000 0.000 0.216 2511 S C 1.859 176.428 174.600 -0.051 0.000 1.034 2511 S CA 1.061 59.245 58.200 -0.027 0.000 0.964 2511 S CB -0.405 62.790 63.200 -0.008 0.000 0.882 2511 S HN 0.598 nan 8.310 nan 0.000 0.469 2512 N N 1.160 119.825 118.700 -0.058 0.000 2.396 2512 N HA 0.215 4.955 4.740 0.000 0.000 0.180 2512 N C 1.074 176.522 175.510 -0.103 0.000 1.028 2512 N CA 1.000 54.013 53.050 -0.062 0.000 0.893 2512 N CB -0.072 38.392 38.487 -0.038 0.000 0.967 2512 N HN 0.623 nan 8.380 nan 0.000 0.440 2513 G N 0.363 109.043 108.800 -0.200 0.000 2.396 2513 G HA2 -0.227 3.734 3.960 0.000 0.000 0.254 2513 G HA3 -0.227 3.734 3.960 0.000 0.000 0.254 2513 G C 0.014 174.670 174.900 -0.406 0.000 1.248 2513 G CA 0.042 44.981 45.100 -0.268 0.000 1.033 2513 G HN 0.253 nan 8.290 nan 0.000 0.502 2514 N N -0.479 118.081 118.700 -0.234 0.000 2.414 2514 N HA 0.028 4.768 4.740 0.000 0.000 0.177 2514 N C 1.503 177.018 175.510 0.008 0.000 1.062 2514 N CA 0.754 53.768 53.050 -0.060 0.000 0.890 2514 N CB 0.036 38.554 38.487 0.052 0.000 1.070 2514 N HN 0.296 nan 8.380 nan 0.000 0.454 2515 K N 0.004 120.393 120.400 -0.019 0.000 2.404 2515 K HA 0.156 4.476 4.320 0.000 0.000 0.194 2515 K C -0.249 176.348 176.600 -0.005 0.000 1.023 2515 K CA 0.064 56.349 56.287 -0.003 0.000 1.094 2515 K CB 0.033 32.529 32.500 -0.007 0.000 0.841 2515 K HN 0.093 nan 8.250 nan 0.000 0.523 2516 C N 0.159 119.450 119.300 -0.015 0.000 3.517 2516 C HA 0.820 5.280 4.460 0.000 0.000 0.202 2516 C C -0.265 174.726 174.990 0.000 0.000 1.370 2516 C CA -0.168 58.845 59.018 -0.009 0.000 1.308 2516 C CB -1.398 26.328 27.740 -0.024 0.000 1.840 2516 C HN 0.450 nan 8.230 nan 0.000 0.525 2517 A N 1.295 124.137 122.820 0.037 0.000 5.650 2517 A HA 0.955 5.275 4.320 0.000 0.000 0.194 2517 A C 0.425 178.058 177.584 0.080 0.000 0.895 2517 A CA 0.472 52.554 52.037 0.075 0.000 0.804 2517 A CB -0.379 18.712 19.000 0.151 0.000 2.103 2517 A HN 2.342 nan 8.150 nan 0.000 1.022 2518 G N -1.866 106.996 108.800 0.104 0.000 2.846 2518 G HA2 0.342 4.302 3.960 0.000 0.000 0.660 2518 G HA3 0.342 4.302 3.960 0.000 0.000 0.660 2518 G C -0.624 174.303 174.900 0.045 0.000 1.464 2518 G CA 0.043 45.181 45.100 0.064 0.000 0.891 2518 G HN 2.104 nan 8.290 nan 0.000 0.552 2519 L N 0.919 122.159 121.223 0.029 0.000 2.289 2519 L HA 0.620 4.960 4.340 0.000 0.000 0.285 2519 L C 0.522 177.414 176.870 0.037 0.000 1.049 2519 L CA -0.770 54.084 54.840 0.023 0.000 0.804 2519 L CB 1.402 43.461 42.059 0.001 0.000 1.195 2519 L HN 0.731 nan 8.230 nan 0.000 0.428 2520 N N 4.065 122.796 118.700 0.051 0.000 2.485 2520 N HA 0.125 4.865 4.740 0.000 0.000 0.243 2520 N C 0.906 176.451 175.510 0.059 0.000 0.987 2520 N CA -0.155 52.951 53.050 0.094 0.000 0.940 2520 N CB 1.403 39.960 38.487 0.117 0.000 1.122 2520 N HN 0.713 nan 8.380 nan 0.000 0.509 2521 V N 2.081 121.989 119.914 -0.010 0.000 2.970 2521 V HA -0.041 4.079 4.120 0.000 0.000 0.260 2521 V C 1.410 177.400 176.094 -0.173 0.000 1.100 2521 V CA 1.013 63.232 62.300 -0.135 0.000 1.122 2521 V CB -1.079 30.591 31.823 -0.254 0.000 0.721 2521 V HN 0.475 nan 8.190 nan 0.000 0.483 2522 F N 2.471 122.420 119.950 -0.002 0.000 2.259 2522 F HA -0.021 4.506 4.527 0.000 0.000 0.298 2522 F C 2.660 178.459 175.800 -0.001 0.000 1.088 2522 F CA 1.779 59.778 58.000 -0.002 0.000 1.358 2522 F CB -0.333 38.666 39.000 -0.001 0.000 1.040 2522 F HN 0.377 nan 8.300 nan 0.000 0.505 2523 T N -4.102 110.554 114.554 0.170 0.000 3.001 2523 T HA 0.375 4.725 4.350 0.000 0.000 0.251 2523 T C 1.482 176.211 174.700 0.048 0.000 1.040 2523 T CA 0.415 62.570 62.100 0.092 0.000 0.985 2523 T CB 0.326 69.240 68.868 0.076 0.000 1.011 2523 T HN 0.343 nan 8.240 nan 0.000 0.509 2524 G N 1.099 109.919 108.800 0.033 0.000 2.248 2524 G HA2 0.273 4.233 3.960 0.000 0.000 0.263 2524 G HA3 0.273 4.233 3.960 0.000 0.000 0.263 2524 G C 0.060 174.966 174.900 0.010 0.000 1.082 2524 G CA -0.226 44.877 45.100 0.005 0.000 0.863 2524 G HN 1.424 nan 8.290 nan 0.000 0.495 2525 A N -1.661 121.170 122.820 0.020 0.000 2.608 2525 A HA 0.881 5.201 4.320 0.000 0.000 0.292 2525 A C 0.035 177.634 177.584 0.026 0.000 1.066 2525 A CA 0.129 52.178 52.037 0.019 0.000 0.676 2525 A CB 1.389 20.401 19.000 0.021 0.000 1.277 2525 A HN 1.802 nan 8.150 nan 0.000 0.413 2526 V N 1.668 121.596 119.914 0.023 0.000 2.673 2526 V HA 0.406 4.527 4.120 0.000 0.000 0.303 2526 V C 0.020 176.134 176.094 0.032 0.000 1.046 2526 V CA 1.025 63.342 62.300 0.029 0.000 1.126 2526 V CB 0.443 32.283 31.823 0.029 0.000 0.934 2526 V HN 0.914 nan 8.190 nan 0.000 0.487 2527 E N 3.827 124.050 120.200 0.038 0.000 2.359 2527 E HA 0.373 4.723 4.350 0.000 0.000 0.223 2527 E C -1.476 175.145 176.600 0.035 0.000 0.877 2527 E CA -0.654 55.767 56.400 0.035 0.000 0.887 2527 E CB 0.828 30.553 29.700 0.041 0.000 1.890 2527 E HN 0.707 nan 8.360 nan 0.000 0.419 2528 D N 1.234 121.652 120.400 0.029 0.000 2.472 2528 D HA 0.193 4.833 4.640 0.000 0.000 0.234 2528 D C 0.832 177.149 176.300 0.028 0.000 1.088 2528 D CA -0.274 53.742 54.000 0.025 0.000 0.882 2528 D CB 0.580 41.389 40.800 0.015 0.000 1.037 2528 D HN 0.186 nan 8.370 nan 0.000 0.520 2529 M N 1.748 121.370 119.600 0.037 0.000 2.117 2529 M HA -0.142 4.338 4.480 0.000 0.000 0.262 2529 M C 2.310 178.626 176.300 0.027 0.000 1.065 2529 M CA 0.818 56.141 55.300 0.039 0.000 1.114 2529 M CB -1.157 31.471 32.600 0.047 0.000 1.361 2529 M HN 0.549 nan 8.290 nan 0.000 0.408 2530 C N 0.602 119.916 119.300 0.023 0.000 2.432 2530 C HA -0.184 4.276 4.460 0.000 0.000 0.277 2530 C C 2.732 177.726 174.990 0.008 0.000 1.249 2530 C CA 1.620 60.647 59.018 0.015 0.000 1.725 2530 C CB -0.871 26.877 27.740 0.013 0.000 2.028 2530 C HN 0.600 nan 8.230 nan 0.000 0.477 2531 E N 1.121 121.325 120.200 0.007 0.000 2.110 2531 E HA -0.139 4.211 4.350 0.000 0.000 0.193 2531 E C 1.608 178.207 176.600 -0.002 0.000 0.988 2531 E CA 1.567 57.968 56.400 0.001 0.000 0.804 2531 E CB -0.420 29.281 29.700 0.002 0.000 0.745 2531 E HN 0.624 nan 8.360 nan 0.000 0.458 2532 N N -0.335 118.365 118.700 0.000 0.000 2.461 2532 N HA 0.055 4.795 4.740 0.000 0.000 0.188 2532 N C 0.622 176.123 175.510 -0.015 0.000 1.134 2532 N CA 0.944 53.988 53.050 -0.009 0.000 0.878 2532 N CB 0.554 39.040 38.487 -0.002 0.000 0.972 2532 N HN 0.319 nan 8.380 nan 0.000 0.456 2533 G N -0.083 108.714 108.800 -0.006 0.000 2.153 2533 G HA2 -0.265 3.695 3.960 0.000 0.000 0.252 2533 G HA3 -0.265 3.695 3.960 0.000 0.000 0.252 2533 G C -0.050 174.850 174.900 0.001 0.000 0.994 2533 G CA 0.183 45.279 45.100 -0.006 0.000 0.698 2533 G HN 0.207 nan 8.290 nan 0.000 0.521 2534 V N 1.463 121.385 119.914 0.013 0.000 2.222 2534 V HA 0.487 4.607 4.120 0.000 0.000 0.253 2534 V C 0.787 176.897 176.094 0.028 0.000 1.210 2534 V CA 0.119 62.437 62.300 0.030 0.000 1.079 2534 V CB 0.463 32.317 31.823 0.052 0.000 1.265 2534 V HN 1.046 nan 8.190 nan 0.000 0.494 2535 V N 1.564 121.491 119.914 0.021 0.000 2.876 2535 V HA 0.900 5.020 4.120 0.000 0.000 0.312 2535 V C -0.632 175.472 176.094 0.017 0.000 1.085 2535 V CA -0.711 61.600 62.300 0.019 0.000 0.945 2535 V CB 2.490 34.322 31.823 0.014 0.000 1.017 2535 V HN 0.657 nan 8.190 nan 0.000 0.428 2536 E N 2.364 122.573 120.200 0.015 0.000 2.336 2536 E HA 0.654 5.004 4.350 0.000 0.000 0.267 2536 E C -3.234 173.372 176.600 0.010 0.000 0.906 2536 E CA -2.432 53.975 56.400 0.012 0.000 0.781 2536 E CB 2.090 31.798 29.700 0.012 0.000 1.261 2536 E HN 0.464 nan 8.360 nan 0.000 0.436 2537 P HA -0.026 nan 4.420 nan 0.000 0.266 2537 P C 0.892 178.196 177.300 0.006 0.000 1.195 2537 P CA -0.304 62.800 63.100 0.006 0.000 0.768 2537 P CB 0.444 32.147 31.700 0.005 0.000 0.838 2538 L N 4.028 125.254 121.223 0.006 0.000 2.079 2538 L HA -0.206 4.135 4.340 0.000 0.000 0.210 2538 L C 2.088 178.960 176.870 0.004 0.000 1.081 2538 L CA 1.947 56.791 54.840 0.006 0.000 0.752 2538 L CB -0.617 41.445 42.059 0.005 0.000 0.896 2538 L HN 0.242 nan 8.230 nan 0.000 0.433 2539 R N -0.531 119.971 120.500 0.004 0.000 2.117 2539 R HA -0.130 4.210 4.340 0.000 0.000 0.243 2539 R C 2.231 178.533 176.300 0.003 0.000 1.143 2539 R CA 1.559 57.661 56.100 0.004 0.000 0.968 2539 R CB -1.366 28.936 30.300 0.003 0.000 0.863 2539 R HN 0.389 nan 8.270 nan 0.000 0.444 2540 V N 1.654 121.569 119.914 0.003 0.000 2.287 2540 V HA -0.239 3.881 4.120 0.000 0.000 0.248 2540 V C 2.393 178.487 176.094 -0.001 0.000 1.053 2540 V CA 1.755 64.055 62.300 0.001 0.000 1.027 2540 V CB -0.300 31.524 31.823 0.002 0.000 0.646 2540 V HN 0.212 nan 8.190 nan 0.000 0.447 2541 K N -0.715 119.685 120.400 -0.000 0.000 2.137 2541 K HA -0.038 4.282 4.320 0.000 0.000 0.202 2541 K C 2.291 178.892 176.600 0.001 0.000 1.052 2541 K CA 1.501 57.786 56.287 -0.002 0.000 0.961 2541 K CB -0.665 31.834 32.500 -0.002 0.000 0.741 2541 K HN 0.458 nan 8.250 nan 0.000 0.452 2542 T N 0.714 115.271 114.554 0.004 0.000 2.942 2542 T HA -0.119 4.231 4.350 0.000 0.000 0.265 2542 T C 1.824 176.529 174.700 0.009 0.000 1.062 2542 T CA 1.207 63.311 62.100 0.007 0.000 1.139 2542 T CB 0.174 69.045 68.868 0.006 0.000 0.883 2542 T HN 0.071 nan 8.240 nan 0.000 0.468 2543 Q N 0.636 120.440 119.800 0.007 0.000 2.137 2543 Q HA 0.317 4.657 4.340 0.000 0.000 0.198 2543 Q C 2.209 178.214 176.000 0.008 0.000 0.960 2543 Q CA 1.532 57.339 55.803 0.007 0.000 0.847 2543 Q CB -0.686 28.055 28.738 0.005 0.000 0.915 2543 Q HN 0.515 nan 8.270 nan 0.000 0.448 2544 A N 0.747 123.569 122.820 0.003 0.000 1.865 2544 A HA -0.160 4.160 4.320 0.000 0.000 0.217 2544 A C 1.931 179.518 177.584 0.004 0.000 1.191 2544 A CA 1.626 53.661 52.037 -0.002 0.000 0.623 2544 A CB -0.760 18.233 19.000 -0.011 0.000 0.826 2544 A HN 0.450 nan 8.150 nan 0.000 0.444 2545 I N -0.242 120.335 120.570 0.011 0.000 2.315 2545 I HA -0.190 3.980 4.170 0.000 0.000 0.248 2545 I C 2.658 178.807 176.117 0.053 0.000 1.117 2545 I CA 1.197 62.519 61.300 0.037 0.000 1.404 2545 I CB -1.356 36.673 38.000 0.048 0.000 1.071 2545 I HN 0.396 nan 8.210 nan 0.000 0.419 2546 Q N 0.537 120.358 119.800 0.035 0.000 1.965 2546 Q HA -0.115 4.225 4.340 0.000 0.000 0.200 2546 Q C 2.485 178.507 176.000 0.037 0.000 0.981 2546 Q CA 1.764 57.588 55.803 0.033 0.000 0.834 2546 Q CB -0.426 28.325 28.738 0.021 0.000 0.900 2546 Q HN 0.372 nan 8.270 nan 0.000 0.426 2547 S N 0.986 116.702 115.700 0.027 0.000 2.368 2547 S HA -0.117 4.353 4.470 0.000 0.000 0.225 2547 S C 1.951 176.571 174.600 0.033 0.000 1.030 2547 S CA 1.050 59.266 58.200 0.026 0.000 0.999 2547 S CB -0.235 62.975 63.200 0.017 0.000 0.844 2547 S HN 0.492 nan 8.310 nan 0.000 0.459 2548 A N 1.565 124.404 122.820 0.031 0.000 1.873 2548 A HA 0.136 4.456 4.320 0.000 0.000 0.215 2548 A C 2.362 179.986 177.584 0.066 0.000 1.186 2548 A CA 1.678 53.734 52.037 0.032 0.000 0.616 2548 A CB -1.117 17.886 19.000 0.006 0.000 0.823 2548 A HN 0.509 nan 8.150 nan 0.000 0.442 2549 A N -0.618 122.259 122.820 0.096 0.000 1.902 2549 A HA -0.130 4.190 4.320 0.000 0.000 0.217 2549 A C 1.991 179.657 177.584 0.136 0.000 1.181 2549 A CA 1.706 53.841 52.037 0.163 0.000 0.623 2549 A CB -0.375 18.737 19.000 0.186 0.000 0.818 2549 A HN 0.449 nan 8.150 nan 0.000 0.443 2550 E N -0.502 119.752 120.200 0.089 0.000 2.072 2550 E HA -0.088 4.262 4.350 0.000 0.000 0.190 2550 E C 2.310 178.949 176.600 0.065 0.000 0.982 2550 E CA 1.234 57.676 56.400 0.070 0.000 0.803 2550 E CB -0.488 29.240 29.700 0.047 0.000 0.755 2550 E HN 0.519 nan 8.360 nan 0.000 0.453 2551 S N -0.114 115.621 115.700 0.058 0.000 2.387 2551 S HA -0.083 4.387 4.470 0.000 0.000 0.226 2551 S C 1.998 176.633 174.600 0.059 0.000 1.026 2551 S CA 1.431 59.660 58.200 0.048 0.000 0.972 2551 S CB -0.106 63.115 63.200 0.036 0.000 0.814 2551 S HN 0.194 nan 8.310 nan 0.000 0.477 2552 T N 1.506 116.109 114.554 0.082 0.000 2.708 2552 T HA -0.094 4.256 4.350 0.000 0.000 0.266 2552 T C 1.750 176.533 174.700 0.137 0.000 1.037 2552 T CA 1.581 63.747 62.100 0.111 0.000 1.146 2552 T CB -0.372 68.581 68.868 0.140 0.000 0.865 2552 T HN 0.578 nan 8.240 nan 0.000 0.435 2553 E N 0.520 120.815 120.200 0.159 0.000 2.106 2553 E HA -0.113 4.237 4.350 0.000 0.000 0.192 2553 E C 2.215 178.854 176.600 0.064 0.000 0.984 2553 E CA 0.783 57.261 56.400 0.131 0.000 0.806 2553 E CB -0.184 29.600 29.700 0.138 0.000 0.750 2553 E HN 0.471 nan 8.360 nan 0.000 0.458 2554 M N 0.191 119.825 119.600 0.057 0.000 2.086 2554 M HA -0.196 4.284 4.480 0.000 0.000 0.261 2554 M C 1.791 178.106 176.300 0.025 0.000 1.067 2554 M CA 1.236 56.557 55.300 0.035 0.000 1.116 2554 M CB -0.005 32.615 32.600 0.033 0.000 1.348 2554 M HN 0.186 nan 8.290 nan 0.000 0.407 2555 L N 0.792 122.032 121.223 0.029 0.000 2.042 2555 L HA -0.173 4.167 4.340 0.000 0.000 0.210 2555 L C 2.239 179.113 176.870 0.006 0.000 1.076 2555 L CA 1.749 56.598 54.840 0.016 0.000 0.749 2555 L CB -1.071 41.001 42.059 0.020 0.000 0.893 2555 L HN 0.401 nan 8.230 nan 0.000 0.432 2556 L N -1.467 119.764 121.223 0.013 0.000 2.201 2556 L HA -0.153 4.187 4.340 0.000 0.000 0.212 2556 L C 2.480 179.336 176.870 -0.023 0.000 1.105 2556 L CA 0.743 55.575 54.840 -0.014 0.000 0.775 2556 L CB -0.387 41.654 42.059 -0.030 0.000 0.913 2556 L HN 0.214 nan 8.230 nan 0.000 0.440 2557 R N -0.076 120.420 120.500 -0.006 0.000 2.193 2557 R HA 0.102 4.442 4.340 0.000 0.000 0.213 2557 R C 0.536 176.834 176.300 -0.003 0.000 1.055 2557 R CA 0.315 56.413 56.100 -0.003 0.000 0.995 2557 R CB -0.040 30.264 30.300 0.008 0.000 0.893 2557 R HN 0.254 nan 8.270 nan 0.000 0.459 2558 I N 2.580 123.148 120.570 -0.003 0.000 2.471 2558 I HA -0.047 4.123 4.170 0.000 0.000 0.286 2558 I C 0.409 176.520 176.117 -0.009 0.000 1.079 2558 I CA 0.050 61.349 61.300 -0.003 0.000 1.398 2558 I CB 0.990 38.989 38.000 -0.003 0.000 1.403 2558 I HN 0.135 nan 8.210 nan 0.000 0.530 2559 D N 2.998 123.396 120.400 -0.003 0.000 2.503 2559 D HA 0.127 4.768 4.640 0.000 0.000 0.218 2559 D C -0.286 176.020 176.300 0.011 0.000 1.183 2559 D CA -0.040 53.957 54.000 -0.005 0.000 0.827 2559 D CB 0.387 41.180 40.800 -0.012 0.000 1.034 2559 D HN 0.355 nan 8.370 nan 0.000 0.510 2560 D N 0.058 120.471 120.400 0.022 0.000 2.688 2560 D HA 0.248 4.888 4.640 0.000 0.000 0.210 2560 D C -1.711 174.619 176.300 0.051 0.000 1.333 2560 D CA -0.471 53.552 54.000 0.038 0.000 0.920 2560 D CB 1.931 42.746 40.800 0.025 0.000 1.554 2560 D HN -0.170 nan 8.370 nan 0.000 0.579 2561 V N 4.267 124.239 119.914 0.096 0.000 2.444 2561 V HA 0.556 4.676 4.120 0.000 0.000 0.294 2561 V C -0.122 176.058 176.094 0.143 0.000 1.022 2561 V CA -0.668 61.703 62.300 0.118 0.000 0.850 2561 V CB 1.479 33.380 31.823 0.130 0.000 0.992 2561 V HN 0.431 nan 8.190 nan 0.000 0.426 2562 I N 4.575 125.198 120.570 0.089 0.000 2.390 2562 I HA 0.772 4.942 4.170 0.000 0.000 0.283 2562 I C 0.292 176.448 176.117 0.066 0.000 1.016 2562 I CA -0.054 61.282 61.300 0.060 0.000 1.151 2562 I CB 1.632 39.650 38.000 0.031 0.000 1.293 2562 I HN 0.684 nan 8.210 nan 0.000 0.458 2563 A N 4.344 127.211 122.820 0.079 0.000 2.401 2563 A HA 0.949 5.269 4.320 0.000 0.000 0.310 2563 A C -0.063 177.552 177.584 0.052 0.000 1.075 2563 A CA -0.684 51.402 52.037 0.082 0.000 0.746 2563 A CB 1.245 20.328 19.000 0.138 0.000 1.277 2563 A HN 0.748 nan 8.150 nan 0.000 0.425 2564 A N 0.742 123.589 122.820 0.044 0.000 2.448 2564 A HA 0.428 4.749 4.320 0.000 0.000 0.239 2564 A C 0.844 178.447 177.584 0.032 0.000 1.080 2564 A CA 0.012 52.067 52.037 0.029 0.000 0.779 2564 A CB -0.016 19.000 19.000 0.026 0.000 1.026 2564 A HN 0.923 nan 8.150 nan 0.000 0.499 2565 E N 0.000 120.211 120.200 0.019 0.000 2.725 2565 E HA 0.000 4.350 4.350 0.000 0.000 0.291 2565 E CA 0.000 56.411 56.400 0.018 0.000 0.976 2565 E CB 0.000 29.705 29.700 0.008 0.000 0.812 2565 E HN 0.000 nan 8.360 nan 0.000 0.440