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 3izi_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 0.000 176.094 176.094 0.000 0.000 1.182 2053 V CA 0.000 62.300 62.300 0.000 0.000 1.235 2053 V CB 0.000 31.825 31.823 0.003 0.000 1.184 2054 L N 3.836 125.057 121.223 -0.002 0.000 2.334 2054 L HA 0.625 4.965 4.340 -0.001 0.000 0.277 2054 L C -2.017 174.850 176.870 -0.006 0.000 1.075 2054 L CA -1.443 53.395 54.840 -0.003 0.000 0.804 2054 L CB 0.255 42.310 42.059 -0.007 0.000 1.174 2054 L HN 0.169 nan 8.230 nan 0.000 0.438 2055 P HA 0.068 nan 4.420 nan 0.000 0.272 2055 P C -0.636 176.658 177.300 -0.010 0.000 1.223 2055 P CA -0.571 62.525 63.100 -0.006 0.000 0.784 2055 P CB 0.578 32.276 31.700 -0.004 0.000 0.923 2056 E N 1.883 122.077 120.200 -0.010 0.000 2.415 2056 E HA -0.042 4.308 4.350 -0.001 0.000 0.260 2056 E C 0.628 177.220 176.600 -0.013 0.000 1.016 2056 E CA 0.811 57.204 56.400 -0.012 0.000 0.924 2056 E CB -0.437 29.257 29.700 -0.010 0.000 0.961 2056 E HN 0.610 nan 8.360 nan 0.000 0.459 2057 N N 2.354 121.044 118.700 -0.017 0.000 2.990 2057 N HA -0.200 4.540 4.740 -0.001 0.000 0.163 2057 N C -0.634 174.865 175.510 -0.019 0.000 1.452 2057 N CA 0.873 53.913 53.050 -0.017 0.000 1.624 2057 N CB -1.140 37.341 38.487 -0.011 0.000 1.088 2057 N HN 0.483 nan 8.380 nan 0.000 0.695 2058 M N 2.606 122.196 119.600 -0.017 0.000 2.238 2058 M HA 0.259 4.739 4.480 -0.001 0.000 0.350 2058 M C -0.419 175.859 176.300 -0.037 0.000 1.321 2058 M CA 0.494 55.785 55.300 -0.015 0.000 1.097 2058 M CB 0.557 33.153 32.600 -0.007 0.000 1.713 2058 M HN 0.055 nan 8.290 nan 0.000 0.455 2059 K N 4.210 124.587 120.400 -0.040 0.000 2.143 2059 K HA 0.512 4.832 4.320 -0.001 0.000 0.272 2059 K C -0.640 175.870 176.600 -0.150 0.000 1.001 2059 K CA -0.664 55.544 56.287 -0.130 0.000 0.915 2059 K CB 1.423 33.842 32.500 -0.135 0.000 1.047 2059 K HN 0.635 nan 8.250 nan 0.000 0.458 2060 R N 2.449 122.777 120.500 -0.287 0.000 2.628 2060 R HA 0.320 4.660 4.340 -0.001 0.000 0.288 2060 R C -1.601 174.483 176.300 -0.360 0.000 0.980 2060 R CA -0.587 55.399 56.100 -0.191 0.000 0.891 2060 R CB 0.950 31.200 30.300 -0.083 0.000 1.188 2060 R HN 0.534 nan 8.270 nan 0.000 0.450 2061 Y N 4.574 124.885 120.300 0.018 0.000 2.446 2061 Y HA 0.547 5.096 4.550 -0.001 0.000 0.345 2061 Y C 0.262 176.168 175.900 0.010 0.000 0.984 2061 Y CA -0.892 57.217 58.100 0.016 0.000 1.058 2061 Y CB 2.209 40.684 38.460 0.024 0.000 1.220 2061 Y HN 0.404 nan 8.280 nan 0.000 0.455 2062 M N 1.100 120.784 119.600 0.140 0.000 2.534 2062 M HA 0.754 5.234 4.480 -0.001 0.000 0.280 2062 M C 0.042 176.376 176.300 0.057 0.000 1.217 2062 M CA -0.203 55.144 55.300 0.078 0.000 0.893 2062 M CB 1.311 33.936 32.600 0.042 0.000 1.730 2062 M HN 0.845 nan 8.290 nan 0.000 0.483 2063 G N 3.034 111.854 108.800 0.034 0.000 2.629 2063 G HA2 -0.408 3.552 3.960 -0.001 0.000 0.313 2063 G HA3 -0.408 3.552 3.960 -0.001 0.000 0.313 2063 G C 0.510 175.416 174.900 0.010 0.000 1.217 2063 G CA 1.524 46.630 45.100 0.010 0.000 0.994 2063 G HN 1.173 nan 8.290 nan 0.000 0.549 2064 R N 1.028 121.531 120.500 0.005 0.000 2.159 2064 R HA -0.004 4.336 4.340 -0.001 0.000 0.237 2064 R C 2.129 178.448 176.300 0.031 0.000 1.131 2064 R CA 2.630 58.733 56.100 0.005 0.000 0.982 2064 R CB -0.622 29.679 30.300 0.001 0.000 0.868 2064 R HN 0.603 nan 8.270 nan 0.000 0.453 2065 D N -0.422 120.018 120.400 0.067 0.000 2.162 2065 D HA -0.011 4.628 4.640 -0.001 0.000 0.203 2065 D C 1.619 178.016 176.300 0.161 0.000 0.967 2065 D CA 1.379 55.463 54.000 0.141 0.000 0.840 2065 D CB -0.138 40.774 40.800 0.187 0.000 0.972 2065 D HN 0.354 nan 8.370 nan 0.000 0.482 2066 A N 1.096 123.996 122.820 0.133 0.000 1.930 2066 A HA -0.174 4.146 4.320 -0.001 0.000 0.217 2066 A C 2.146 179.723 177.584 -0.012 0.000 1.175 2066 A CA 1.153 53.241 52.037 0.085 0.000 0.627 2066 A CB -0.235 18.817 19.000 0.086 0.000 0.815 2066 A HN 0.064 nan 8.150 nan 0.000 0.443 2067 Q N -0.701 119.096 119.800 -0.006 0.000 2.062 2067 Q HA -0.099 4.240 4.340 -0.001 0.000 0.196 2067 Q C 2.277 178.251 176.000 -0.043 0.000 0.967 2067 Q CA 1.379 57.166 55.803 -0.026 0.000 0.832 2067 Q CB -0.413 28.311 28.738 -0.022 0.000 0.899 2067 Q HN 0.750 nan 8.270 nan 0.000 0.442 2068 R N 0.295 120.776 120.500 -0.032 0.000 2.083 2068 R HA -0.109 4.230 4.340 -0.001 0.000 0.237 2068 R C 2.285 178.523 176.300 -0.104 0.000 1.137 2068 R CA 1.368 57.442 56.100 -0.044 0.000 0.951 2068 R CB -0.175 30.119 30.300 -0.010 0.000 0.851 2068 R HN 0.184 nan 8.270 nan 0.000 0.434 2069 M N 1.032 120.538 119.600 -0.157 0.000 2.086 2069 M HA -0.162 4.317 4.480 -0.001 0.000 0.261 2069 M C 1.156 177.250 176.300 -0.343 0.000 1.067 2069 M CA 1.813 56.910 55.300 -0.338 0.000 1.116 2069 M CB -0.768 31.400 32.600 -0.720 0.000 1.348 2069 M HN 0.135 nan 8.290 nan 0.000 0.407 2070 N N 0.862 119.424 118.700 -0.230 0.000 2.166 2070 N HA -0.080 4.660 4.740 -0.001 0.000 0.186 2070 N C 1.809 177.234 175.510 -0.141 0.000 1.019 2070 N CA 1.438 54.389 53.050 -0.166 0.000 0.856 2070 N CB -0.463 37.972 38.487 -0.088 0.000 0.993 2070 N HN 0.483 nan 8.380 nan 0.000 0.426 2071 I N 0.127 120.629 120.570 -0.115 0.000 2.315 2071 I HA -0.196 3.973 4.170 -0.001 0.000 0.248 2071 I C 1.608 177.654 176.117 -0.117 0.000 1.117 2071 I CA 0.539 61.788 61.300 -0.084 0.000 1.404 2071 I CB -0.033 37.937 38.000 -0.051 0.000 1.071 2071 I HN 0.018 nan 8.210 nan 0.000 0.419 2072 L N 0.659 121.782 121.223 -0.167 0.000 2.093 2072 L HA -0.118 4.221 4.340 -0.001 0.000 0.208 2072 L C 2.662 179.377 176.870 -0.259 0.000 1.085 2072 L CA 1.966 56.693 54.840 -0.189 0.000 0.755 2072 L CB -1.264 40.674 42.059 -0.201 0.000 0.904 2072 L HN 0.183 nan 8.230 nan 0.000 0.435 2073 A N -0.623 121.959 122.820 -0.397 0.000 1.858 2073 A HA -0.087 4.232 4.320 -0.001 0.000 0.216 2073 A C 2.410 179.900 177.584 -0.157 0.000 1.190 2073 A CA 1.725 53.519 52.037 -0.405 0.000 0.617 2073 A CB -1.342 17.405 19.000 -0.422 0.000 0.827 2073 A HN 0.419 nan 8.150 nan 0.000 0.443 2074 G N -0.929 107.799 108.800 -0.120 0.000 2.402 2074 G HA2 -0.209 3.750 3.960 -0.001 0.000 0.216 2074 G HA3 -0.209 3.750 3.960 -0.001 0.000 0.216 2074 G C 1.746 176.609 174.900 -0.060 0.000 1.162 2074 G CA 0.986 46.046 45.100 -0.066 0.000 0.777 2074 G HN 0.551 nan 8.290 nan 0.000 0.539 2075 R N 0.003 120.459 120.500 -0.072 0.000 2.075 2075 R HA 0.065 4.405 4.340 -0.001 0.000 0.232 2075 R C 2.507 178.775 176.300 -0.052 0.000 1.126 2075 R CA 1.040 57.105 56.100 -0.059 0.000 0.963 2075 R CB -0.311 29.954 30.300 -0.058 0.000 0.858 2075 R HN 0.406 nan 8.270 nan 0.000 0.435 2076 I N 0.778 121.312 120.570 -0.060 0.000 2.226 2076 I HA -0.288 3.882 4.170 -0.001 0.000 0.245 2076 I C 2.070 178.171 176.117 -0.026 0.000 1.100 2076 I CA 0.821 62.097 61.300 -0.039 0.000 1.374 2076 I CB -0.189 37.790 38.000 -0.036 0.000 1.057 2076 I HN 0.212 nan 8.210 nan 0.000 0.413 2077 I N 1.062 121.616 120.570 -0.026 0.000 2.179 2077 I HA -0.264 3.905 4.170 -0.001 0.000 0.242 2077 I C 2.831 178.934 176.117 -0.023 0.000 1.088 2077 I CA 1.774 63.064 61.300 -0.017 0.000 1.357 2077 I CB -1.505 36.487 38.000 -0.013 0.000 1.051 2077 I HN 0.185 nan 8.210 nan 0.000 0.409 2078 A N 0.157 122.958 122.820 -0.032 0.000 1.969 2078 A HA -0.158 4.162 4.320 -0.001 0.000 0.218 2078 A C 2.170 179.733 177.584 -0.035 0.000 1.169 2078 A CA 1.175 53.190 52.037 -0.037 0.000 0.635 2078 A CB -0.374 18.600 19.000 -0.045 0.000 0.810 2078 A HN 0.338 nan 8.150 nan 0.000 0.445 2079 E N -0.298 119.882 120.200 -0.033 0.000 2.110 2079 E HA -0.112 4.238 4.350 -0.001 0.000 0.193 2079 E C 2.085 178.670 176.600 -0.025 0.000 0.988 2079 E CA 1.699 58.081 56.400 -0.030 0.000 0.804 2079 E CB -0.610 29.074 29.700 -0.028 0.000 0.745 2079 E HN 0.600 nan 8.360 nan 0.000 0.458 2080 T N 0.743 115.284 114.554 -0.022 0.000 2.770 2080 T HA -0.048 4.302 4.350 -0.001 0.000 0.263 2080 T C 2.121 176.809 174.700 -0.020 0.000 1.039 2080 T CA 0.974 63.063 62.100 -0.018 0.000 1.142 2080 T CB -0.099 68.761 68.868 -0.012 0.000 0.868 2080 T HN -0.036 nan 8.240 nan 0.000 0.435 2081 V N 2.757 122.658 119.914 -0.022 0.000 2.591 2081 V HA -0.112 4.007 4.120 -0.001 0.000 0.249 2081 V C 2.630 178.707 176.094 -0.028 0.000 1.053 2081 V CA 1.502 63.788 62.300 -0.023 0.000 1.068 2081 V CB -0.679 31.130 31.823 -0.023 0.000 0.689 2081 V HN 0.522 nan 8.190 nan 0.000 0.462 2082 R N 1.664 122.144 120.500 -0.033 0.000 2.200 2082 R HA -0.143 4.197 4.340 -0.001 0.000 0.234 2082 R C 2.064 178.342 176.300 -0.037 0.000 1.127 2082 R CA 1.733 57.811 56.100 -0.038 0.000 0.989 2082 R CB -0.884 29.390 30.300 -0.042 0.000 0.869 2082 R HN 0.598 nan 8.270 nan 0.000 0.459 2083 S N 0.283 115.963 115.700 -0.033 0.000 2.555 2083 S HA -0.077 4.392 4.470 -0.001 0.000 0.230 2083 S C 1.698 176.279 174.600 -0.033 0.000 0.978 2083 S CA 0.823 59.003 58.200 -0.033 0.000 0.934 2083 S CB -0.062 63.121 63.200 -0.028 0.000 0.766 2083 S HN 0.588 nan 8.310 nan 0.000 0.533 2084 T N -1.036 113.500 114.554 -0.030 0.000 3.060 2084 T HA 0.333 4.683 4.350 -0.001 0.000 0.249 2084 T C 0.376 175.057 174.700 -0.031 0.000 1.079 2084 T CA -0.496 61.587 62.100 -0.028 0.000 1.013 2084 T CB -0.447 68.408 68.868 -0.021 0.000 0.975 2084 T HN 0.279 nan 8.240 nan 0.000 0.518 2085 L N 2.851 124.053 121.223 -0.036 0.000 2.462 2085 L HA 0.522 4.862 4.340 -0.001 0.000 0.272 2085 L C 0.703 177.544 176.870 -0.048 0.000 1.166 2085 L CA 1.598 56.414 54.840 -0.039 0.000 0.880 2085 L CB -0.670 41.362 42.059 -0.044 0.000 1.142 2085 L HN 0.703 nan 8.230 nan 0.000 0.473 2086 G N 4.045 112.820 108.800 -0.042 0.000 2.663 2086 G HA2 -0.149 3.811 3.960 -0.001 0.000 0.686 2086 G HA3 -0.149 3.811 3.960 -0.001 0.000 0.686 2086 G C -2.117 172.745 174.900 -0.064 0.000 1.288 2086 G CA -0.455 44.612 45.100 -0.055 0.000 0.836 2086 G HN 0.481 nan 8.290 nan 0.000 0.584 2087 P HA -0.008 nan 4.420 nan 0.000 0.219 2087 P C 1.370 178.554 177.300 -0.192 0.000 1.146 2087 P CA 1.477 64.508 63.100 -0.115 0.000 0.808 2087 P CB 0.054 31.606 31.700 -0.247 0.000 0.779 2088 K N -0.781 119.481 120.400 -0.230 0.000 2.437 2088 K HA 0.266 4.585 4.320 -0.001 0.000 0.205 2088 K C 0.932 177.470 176.600 -0.103 0.000 1.026 2088 K CA -0.204 55.974 56.287 -0.181 0.000 1.153 2088 K CB -0.301 32.070 32.500 -0.214 0.000 0.863 2088 K HN 0.016 nan 8.250 nan 0.000 0.502 2089 G N 0.526 109.278 108.800 -0.079 0.000 2.594 2089 G HA2 0.167 4.126 3.960 -0.001 0.000 0.243 2089 G HA3 0.167 4.126 3.960 -0.001 0.000 0.243 2089 G C 0.037 174.913 174.900 -0.040 0.000 1.229 2089 G CA -0.385 44.684 45.100 -0.053 0.000 0.843 2089 G HN -0.020 nan 8.290 nan 0.000 0.578 2090 M N 0.074 119.654 119.600 -0.033 0.000 2.705 2090 M HA 0.400 4.880 4.480 -0.001 0.000 0.272 2090 M C -0.480 175.807 176.300 -0.021 0.000 1.172 2090 M CA -0.576 54.708 55.300 -0.026 0.000 0.901 2090 M CB 1.232 33.816 32.600 -0.027 0.000 1.516 2090 M HN 0.344 nan 8.290 nan 0.000 0.530 2091 D N 0.556 120.945 120.400 -0.019 0.000 2.326 2091 D HA 0.473 5.112 4.640 -0.001 0.000 0.248 2091 D C -0.531 175.758 176.300 -0.019 0.000 1.001 2091 D CA -0.335 53.655 54.000 -0.017 0.000 0.961 2091 D CB 1.269 42.059 40.800 -0.017 0.000 1.183 2091 D HN 0.089 nan 8.370 nan 0.000 0.502 2092 K N 0.777 121.165 120.400 -0.019 0.000 2.259 2092 K HA 0.433 4.753 4.320 -0.001 0.000 0.252 2092 K C -0.579 176.007 176.600 -0.024 0.000 0.936 2092 K CA -0.651 55.624 56.287 -0.019 0.000 0.810 2092 K CB 2.308 34.799 32.500 -0.015 0.000 1.143 2092 K HN 0.428 nan 8.250 nan 0.000 0.427 2093 M N 4.054 123.639 119.600 -0.026 0.000 2.036 2093 M HA 0.262 4.742 4.480 -0.001 0.000 0.337 2093 M C -1.544 174.740 176.300 -0.026 0.000 1.012 2093 M CA -0.923 54.357 55.300 -0.033 0.000 0.962 2093 M CB 0.314 32.892 32.600 -0.036 0.000 1.423 2093 M HN 0.333 nan 8.290 nan 0.000 0.405 2094 L N 5.964 127.172 121.223 -0.025 0.000 2.265 2094 L HA 0.493 4.833 4.340 -0.001 0.000 0.289 2094 L C -0.819 176.041 176.870 -0.016 0.000 1.033 2094 L CA -0.236 54.595 54.840 -0.016 0.000 0.814 2094 L CB 1.664 43.717 42.059 -0.010 0.000 1.203 2094 L HN 0.415 nan 8.230 nan 0.000 0.423 2095 V N 2.954 122.861 119.914 -0.012 0.000 2.384 2095 V HA 0.363 4.483 4.120 -0.001 0.000 0.287 2095 V C -0.199 175.893 176.094 -0.004 0.000 1.020 2095 V CA -0.947 61.347 62.300 -0.010 0.000 0.850 2095 V CB 1.524 33.340 31.823 -0.011 0.000 0.987 2095 V HN 0.789 nan 8.190 nan 0.000 0.436 2096 D N 2.372 122.772 120.400 0.000 0.000 2.447 2096 D HA 0.055 4.695 4.640 -0.001 0.000 0.265 2096 D C 0.889 177.190 176.300 0.002 0.000 1.250 2096 D CA -0.474 53.528 54.000 0.002 0.000 1.046 2096 D CB 0.644 41.448 40.800 0.006 0.000 1.095 2096 D HN 0.429 nan 8.370 nan 0.000 0.555 2097 D N -1.691 118.711 120.400 0.002 0.000 2.219 2097 D HA -0.100 4.540 4.640 -0.001 0.000 0.205 2097 D C 1.495 177.796 176.300 0.003 0.000 0.970 2097 D CA 0.687 54.688 54.000 0.002 0.000 0.851 2097 D CB 0.005 40.805 40.800 0.001 0.000 0.943 2097 D HN 0.193 nan 8.370 nan 0.000 0.488 2098 L N -1.098 120.128 121.223 0.005 0.000 2.558 2098 L HA 0.346 4.686 4.340 -0.001 0.000 0.225 2098 L C 2.043 178.918 176.870 0.008 0.000 1.128 2098 L CA 0.974 55.818 54.840 0.007 0.000 0.868 2098 L CB 0.131 42.195 42.059 0.008 0.000 1.006 2098 L HN 0.276 nan 8.230 nan 0.000 0.454 2099 G N -1.499 107.306 108.800 0.007 0.000 2.213 2099 G HA2 -0.262 3.698 3.960 -0.001 0.000 0.226 2099 G HA3 -0.262 3.698 3.960 -0.001 0.000 0.226 2099 G C 0.321 175.228 174.900 0.011 0.000 0.992 2099 G CA 0.114 45.218 45.100 0.007 0.000 0.632 2099 G HN 0.333 nan 8.290 nan 0.000 0.511 2100 D N 0.950 121.360 120.400 0.017 0.000 2.401 2100 D HA 0.414 5.054 4.640 -0.001 0.000 0.254 2100 D C 0.258 176.569 176.300 0.019 0.000 1.192 2100 D CA 0.502 54.520 54.000 0.029 0.000 0.885 2100 D CB 1.316 42.137 40.800 0.034 0.000 1.147 2100 D HN 0.587 nan 8.370 nan 0.000 0.478 2101 V N 4.888 124.809 119.914 0.012 0.000 2.555 2101 V HA 0.607 4.727 4.120 -0.001 0.000 0.302 2101 V C -1.054 175.014 176.094 -0.044 0.000 1.038 2101 V CA -0.638 61.647 62.300 -0.025 0.000 0.887 2101 V CB 1.904 33.694 31.823 -0.055 0.000 0.991 2101 V HN 0.344 nan 8.190 nan 0.000 0.434 2102 V N 6.931 126.822 119.914 -0.038 0.000 2.604 2102 V HA 0.711 4.830 4.120 -0.001 0.000 0.305 2102 V C -0.893 175.168 176.094 -0.053 0.000 1.043 2102 V CA -0.232 62.049 62.300 -0.032 0.000 0.888 2102 V CB 2.272 34.105 31.823 0.016 0.000 0.995 2102 V HN 0.786 nan 8.190 nan 0.000 0.429 2103 V N 5.850 125.724 119.914 -0.067 0.000 2.417 2103 V HA 0.789 4.909 4.120 -0.001 0.000 0.291 2103 V C 0.088 176.171 176.094 -0.018 0.000 1.024 2103 V CA 0.020 62.289 62.300 -0.052 0.000 0.861 2103 V CB 1.596 33.374 31.823 -0.075 0.000 0.985 2103 V HN 1.075 nan 8.190 nan 0.000 0.436 2104 T N 2.593 117.139 114.554 -0.013 0.000 2.769 2104 T HA 0.312 4.661 4.350 -0.001 0.000 0.306 2104 T C 0.070 174.767 174.700 -0.006 0.000 1.400 2104 T CA -0.359 61.739 62.100 -0.003 0.000 1.007 2104 T CB 1.996 70.865 68.868 0.003 0.000 1.392 2104 T HN 0.655 nan 8.240 nan 0.000 0.500 2105 N N 0.804 119.503 118.700 -0.002 0.000 2.210 2105 N HA 0.081 4.821 4.740 -0.001 0.000 0.203 2105 N C -0.312 175.195 175.510 -0.004 0.000 1.175 2105 N CA 0.015 53.062 53.050 -0.005 0.000 0.894 2105 N CB 0.470 38.955 38.487 -0.004 0.000 1.041 2105 N HN 0.693 nan 8.380 nan 0.000 0.506 2106 D N -0.098 120.302 120.400 -0.001 0.000 2.401 2106 D HA 0.185 4.825 4.640 -0.001 0.000 0.254 2106 D C 1.497 177.795 176.300 -0.003 0.000 1.192 2106 D CA 0.292 54.291 54.000 -0.000 0.000 0.885 2106 D CB 1.010 41.812 40.800 0.004 0.000 1.147 2106 D HN 0.269 nan 8.370 nan 0.000 0.478 2107 G N 2.612 111.409 108.800 -0.005 0.000 2.440 2107 G HA2 -0.241 3.719 3.960 -0.001 0.000 0.218 2107 G HA3 -0.241 3.719 3.960 -0.001 0.000 0.218 2107 G C 1.513 176.411 174.900 -0.004 0.000 1.154 2107 G CA 0.731 45.827 45.100 -0.007 0.000 0.767 2107 G HN 0.488 nan 8.290 nan 0.000 0.552 2108 V N 0.823 120.736 119.914 -0.002 0.000 2.270 2108 V HA -0.170 3.950 4.120 -0.001 0.000 0.245 2108 V C 3.179 179.274 176.094 0.001 0.000 1.043 2108 V CA 2.382 64.682 62.300 0.000 0.000 1.014 2108 V CB -0.903 30.920 31.823 0.001 0.000 0.645 2108 V HN 0.401 nan 8.190 nan 0.000 0.447 2109 T N 0.391 114.946 114.554 0.002 0.000 2.720 2109 T HA -0.182 4.168 4.350 -0.001 0.000 0.268 2109 T C 1.795 176.496 174.700 0.002 0.000 1.037 2109 T CA 1.950 64.052 62.100 0.004 0.000 1.144 2109 T CB -0.312 68.559 68.868 0.006 0.000 0.864 2109 T HN 0.338 nan 8.240 nan 0.000 0.444 2110 I N 0.248 120.818 120.570 -0.000 0.000 2.179 2110 I HA -0.137 4.032 4.170 -0.001 0.000 0.242 2110 I C 2.114 178.230 176.117 -0.000 0.000 1.088 2110 I CA 1.007 62.306 61.300 -0.002 0.000 1.357 2110 I CB -0.282 37.715 38.000 -0.005 0.000 1.051 2110 I HN 0.156 nan 8.210 nan 0.000 0.409 2111 L N 0.169 121.392 121.223 0.000 0.000 2.156 2111 L HA -0.088 4.252 4.340 -0.001 0.000 0.208 2111 L C 2.492 179.364 176.870 0.003 0.000 1.095 2111 L CA 1.494 56.335 54.840 0.002 0.000 0.770 2111 L CB -0.956 41.104 42.059 0.001 0.000 0.914 2111 L HN 0.151 nan 8.230 nan 0.000 0.439 2112 R N -0.106 120.396 120.500 0.003 0.000 2.066 2112 R HA -0.106 4.234 4.340 -0.001 0.000 0.232 2112 R C 1.923 178.225 176.300 0.004 0.000 1.131 2112 R CA 1.238 57.340 56.100 0.004 0.000 0.955 2112 R CB 0.044 30.346 30.300 0.004 0.000 0.851 2112 R HN 0.320 nan 8.270 nan 0.000 0.432 2113 E N 1.040 121.242 120.200 0.003 0.000 2.112 2113 E HA -0.075 4.275 4.350 -0.001 0.000 0.190 2113 E C 1.207 177.808 176.600 0.002 0.000 0.979 2113 E CA 0.536 56.938 56.400 0.004 0.000 0.814 2113 E CB -0.355 29.347 29.700 0.004 0.000 0.762 2113 E HN 0.462 nan 8.360 nan 0.000 0.460 2114 M N 0.715 120.316 119.600 0.002 0.000 2.252 2114 M HA 0.098 4.577 4.480 -0.001 0.000 0.333 2114 M C 0.208 176.509 176.300 0.002 0.000 1.111 2114 M CA 0.142 55.443 55.300 0.002 0.000 1.140 2114 M CB 0.432 33.033 32.600 0.002 0.000 1.538 2114 M HN -0.230 nan 8.290 nan 0.000 0.448 2115 S N 2.362 118.062 115.700 0.000 0.000 2.955 2115 S HA 0.468 4.938 4.470 -0.001 0.000 0.294 2115 S C -0.253 174.345 174.600 -0.003 0.000 1.198 2115 S CA -1.001 57.197 58.200 -0.002 0.000 1.008 2115 S CB -0.356 62.841 63.200 -0.005 0.000 1.279 2115 S HN 0.570 nan 8.310 nan 0.000 0.508 2116 V N 3.391 123.306 119.914 0.000 0.000 2.686 2116 V HA 0.214 4.334 4.120 -0.001 0.000 0.295 2116 V C 1.394 177.478 176.094 -0.016 0.000 1.055 2116 V CA -0.101 62.202 62.300 0.005 0.000 1.050 2116 V CB 1.268 33.102 31.823 0.018 0.000 0.984 2116 V HN 0.874 nan 8.190 nan 0.000 0.482 2117 E N 1.934 122.107 120.200 -0.045 0.000 2.256 2117 E HA 0.034 4.384 4.350 -0.001 0.000 0.198 2117 E C 0.457 176.968 176.600 -0.150 0.000 0.908 2117 E CA 0.194 56.518 56.400 -0.127 0.000 0.915 2117 E CB 0.298 29.863 29.700 -0.224 0.000 0.890 2117 E HN 0.743 nan 8.360 nan 0.000 0.484 2118 H N 1.675 120.733 119.070 -0.019 0.000 2.848 2118 H HA 0.075 4.631 4.556 -0.000 0.000 0.317 2118 H C -1.676 173.637 175.328 -0.026 0.000 1.046 2118 H CA -1.220 54.806 56.048 -0.036 0.000 1.470 2118 H CB 1.140 30.867 29.762 -0.059 0.000 1.483 2118 H HN 0.082 nan 8.280 nan 0.000 0.548 2119 P HA -0.133 nan 4.420 nan 0.000 0.218 2119 P C 1.334 178.660 177.300 0.042 0.000 1.148 2119 P CA 1.494 64.622 63.100 0.048 0.000 0.822 2119 P CB 0.269 31.993 31.700 0.039 0.000 0.784 2120 A N 0.243 123.089 122.820 0.043 0.000 1.902 2120 A HA -0.136 4.183 4.320 -0.001 0.000 0.217 2120 A C 2.331 179.923 177.584 0.013 0.000 1.181 2120 A CA 2.155 54.199 52.037 0.011 0.000 0.623 2120 A CB -1.602 17.379 19.000 -0.032 0.000 0.818 2120 A HN 0.203 nan 8.150 nan 0.000 0.443 2121 A N -0.279 122.561 122.820 0.033 0.000 1.933 2121 A HA -0.140 4.179 4.320 -0.001 0.000 0.218 2121 A C 2.070 179.669 177.584 0.025 0.000 1.175 2121 A CA 1.732 53.786 52.037 0.028 0.000 0.628 2121 A CB -0.408 18.625 19.000 0.055 0.000 0.814 2121 A HN 0.555 nan 8.150 nan 0.000 0.444 2122 K N -0.995 119.423 120.400 0.031 0.000 2.147 2122 K HA -0.065 4.254 4.320 -0.001 0.000 0.205 2122 K C 1.830 178.440 176.600 0.017 0.000 1.049 2122 K CA 1.329 57.628 56.287 0.021 0.000 0.936 2122 K CB -0.186 32.327 32.500 0.021 0.000 0.722 2122 K HN 0.376 nan 8.250 nan 0.000 0.446 2123 M N 0.344 119.955 119.600 0.017 0.000 2.334 2123 M HA -0.026 4.454 4.480 -0.001 0.000 0.266 2123 M C 2.136 178.444 176.300 0.013 0.000 1.082 2123 M CA 1.027 56.336 55.300 0.015 0.000 1.141 2123 M CB -0.607 32.004 32.600 0.017 0.000 1.380 2123 M HN 0.183 nan 8.290 nan 0.000 0.440 2124 L N 0.335 121.565 121.223 0.010 0.000 2.083 2124 L HA -0.198 4.141 4.340 -0.001 0.000 0.209 2124 L C 2.218 179.091 176.870 0.005 0.000 1.083 2124 L CA 1.040 55.883 54.840 0.006 0.000 0.752 2124 L CB -0.198 41.860 42.059 -0.001 0.000 0.899 2124 L HN 0.181 nan 8.230 nan 0.000 0.433 2125 I N -0.318 120.255 120.570 0.006 0.000 2.335 2125 I HA -0.307 3.863 4.170 -0.001 0.000 0.251 2125 I C 2.367 178.487 176.117 0.005 0.000 1.129 2125 I CA 1.038 62.341 61.300 0.005 0.000 1.402 2125 I CB -0.340 37.664 38.000 0.007 0.000 1.069 2125 I HN 0.306 nan 8.210 nan 0.000 0.424 2126 E N 0.393 120.598 120.200 0.008 0.000 2.204 2126 E HA -0.152 4.198 4.350 -0.001 0.000 0.195 2126 E C 2.401 179.006 176.600 0.007 0.000 0.990 2126 E CA 1.060 57.465 56.400 0.008 0.000 0.821 2126 E CB -0.207 29.499 29.700 0.010 0.000 0.750 2126 E HN 0.384 nan 8.360 nan 0.000 0.477 2127 V N 1.490 121.408 119.914 0.007 0.000 2.307 2127 V HA -0.220 3.900 4.120 -0.001 0.000 0.245 2127 V C 2.480 178.575 176.094 0.002 0.000 1.045 2127 V CA 1.757 64.060 62.300 0.006 0.000 1.024 2127 V CB -0.854 30.972 31.823 0.005 0.000 0.651 2127 V HN 0.241 nan 8.190 nan 0.000 0.449 2128 A N -0.284 122.536 122.820 0.000 0.000 1.940 2128 A HA -0.248 4.072 4.320 -0.001 0.000 0.219 2128 A C 2.295 179.879 177.584 0.001 0.000 1.176 2128 A CA 2.032 54.068 52.037 -0.001 0.000 0.631 2128 A CB -0.417 18.582 19.000 -0.002 0.000 0.814 2128 A HN 0.558 nan 8.150 nan 0.000 0.446 2129 K N -1.606 118.795 120.400 0.002 0.000 2.062 2129 K HA -0.082 4.238 4.320 -0.001 0.000 0.205 2129 K C 2.138 178.740 176.600 0.003 0.000 1.051 2129 K CA 1.535 57.824 56.287 0.003 0.000 0.941 2129 K CB -0.368 32.134 32.500 0.004 0.000 0.719 2129 K HN 0.422 nan 8.250 nan 0.000 0.440 2130 T N 0.774 115.331 114.554 0.004 0.000 2.995 2130 T HA -0.074 4.276 4.350 -0.001 0.000 0.269 2130 T C 1.775 176.477 174.700 0.004 0.000 1.091 2130 T CA 0.810 62.912 62.100 0.004 0.000 1.128 2130 T CB 0.066 68.938 68.868 0.006 0.000 0.891 2130 T HN 0.085 nan 8.240 nan 0.000 0.492 2131 Q N 0.957 120.759 119.800 0.003 0.000 2.020 2131 Q HA -0.046 4.293 4.340 -0.001 0.000 0.202 2131 Q C 2.301 178.302 176.000 0.001 0.000 0.982 2131 Q CA 1.237 57.041 55.803 0.001 0.000 0.838 2131 Q CB -0.485 28.253 28.738 -0.001 0.000 0.899 2131 Q HN 0.538 nan 8.270 nan 0.000 0.423 2132 E N 0.903 121.104 120.200 0.001 0.000 2.106 2132 E HA -0.146 4.204 4.350 -0.001 0.000 0.192 2132 E C 1.720 178.321 176.600 0.002 0.000 0.984 2132 E CA 0.953 57.354 56.400 0.002 0.000 0.806 2132 E CB 0.229 29.930 29.700 0.002 0.000 0.750 2132 E HN 0.282 nan 8.360 nan 0.000 0.458 2133 K N 0.074 120.475 120.400 0.002 0.000 2.076 2133 K HA -0.128 4.192 4.320 -0.001 0.000 0.204 2133 K C 2.154 178.755 176.600 0.002 0.000 1.051 2133 K CA 1.186 57.474 56.287 0.002 0.000 0.949 2133 K CB -0.013 32.489 32.500 0.002 0.000 0.726 2133 K HN -0.088 nan 8.250 nan 0.000 0.443 2134 E N 0.337 120.539 120.200 0.002 0.000 2.060 2134 E HA -0.097 4.253 4.350 -0.001 0.000 0.189 2134 E C 1.594 178.196 176.600 0.002 0.000 0.974 2134 E CA 1.104 57.506 56.400 0.003 0.000 0.808 2134 E CB 0.515 30.217 29.700 0.003 0.000 0.768 2134 E HN 0.160 nan 8.360 nan 0.000 0.453 2135 V N -4.944 114.971 119.914 0.002 0.000 3.497 2135 V HA 0.586 4.705 4.120 -0.001 0.000 0.272 2135 V C 1.389 177.484 176.094 0.003 0.000 1.474 2135 V CA 0.742 63.043 62.300 0.003 0.000 1.025 2135 V CB 0.494 32.319 31.823 0.003 0.000 0.820 2135 V HN 0.304 nan 8.190 nan 0.000 0.437 2136 G N 0.693 109.494 108.800 0.002 0.000 3.586 2136 G HA2 -0.272 3.688 3.960 -0.001 0.000 0.212 2136 G HA3 -0.272 3.688 3.960 -0.001 0.000 0.212 2136 G C 0.203 175.104 174.900 0.002 0.000 1.411 2136 G CA 0.498 45.600 45.100 0.003 0.000 0.898 2136 G HN 0.629 nan 8.290 nan 0.000 0.575 2137 D N 0.802 121.204 120.400 0.003 0.000 2.511 2137 D HA 0.495 5.134 4.640 -0.001 0.000 0.276 2137 D C 1.519 177.818 176.300 -0.001 0.000 1.220 2137 D CA 1.157 55.158 54.000 0.002 0.000 1.077 2137 D CB 0.657 41.459 40.800 0.004 0.000 1.126 2137 D HN 1.595 nan 8.370 nan 0.000 0.583 2138 G N -0.628 108.170 108.800 -0.004 0.000 2.143 2138 G HA2 -0.312 3.648 3.960 -0.001 0.000 0.249 2138 G HA3 -0.312 3.648 3.960 -0.001 0.000 0.249 2138 G C 1.036 175.929 174.900 -0.011 0.000 0.981 2138 G CA 1.480 46.575 45.100 -0.008 0.000 0.665 2138 G HN 0.593 nan 8.290 nan 0.000 0.528 2139 T N -2.056 112.493 114.554 -0.009 0.000 2.588 2139 T HA -0.150 4.200 4.350 -0.001 0.000 0.261 2139 T C 2.202 176.893 174.700 -0.016 0.000 1.069 2139 T CA 2.621 64.716 62.100 -0.010 0.000 1.172 2139 T CB -1.010 67.854 68.868 -0.007 0.000 0.863 2139 T HN 0.342 nan 8.240 nan 0.000 0.408 2140 T N 1.848 116.392 114.554 -0.017 0.000 2.635 2140 T HA -0.151 4.198 4.350 -0.001 0.000 0.267 2140 T C 2.275 176.956 174.700 -0.032 0.000 1.040 2140 T CA 2.089 64.175 62.100 -0.024 0.000 1.156 2140 T CB -1.241 67.612 68.868 -0.024 0.000 0.863 2140 T HN 0.566 nan 8.240 nan 0.000 0.430 2141 T N 1.998 116.533 114.554 -0.032 0.000 2.635 2141 T HA -0.160 4.189 4.350 -0.001 0.000 0.267 2141 T C 2.345 177.015 174.700 -0.050 0.000 1.040 2141 T CA 1.528 63.602 62.100 -0.042 0.000 1.156 2141 T CB -0.698 68.148 68.868 -0.036 0.000 0.863 2141 T HN 0.473 nan 8.240 nan 0.000 0.430 2142 A N 0.661 123.458 122.820 -0.038 0.000 1.933 2142 A HA -0.038 4.282 4.320 -0.001 0.000 0.218 2142 A C 2.600 180.159 177.584 -0.042 0.000 1.175 2142 A CA 1.438 53.452 52.037 -0.038 0.000 0.628 2142 A CB -0.904 18.084 19.000 -0.020 0.000 0.814 2142 A HN 0.378 nan 8.150 nan 0.000 0.444 2143 V N -0.508 119.385 119.914 -0.036 0.000 2.358 2143 V HA -0.196 3.924 4.120 -0.001 0.000 0.246 2143 V C 2.548 178.613 176.094 -0.048 0.000 1.047 2143 V CA 1.833 64.113 62.300 -0.035 0.000 1.035 2143 V CB -0.734 31.073 31.823 -0.026 0.000 0.658 2143 V HN 0.362 nan 8.190 nan 0.000 0.452 2144 V N 0.850 120.731 119.914 -0.055 0.000 2.295 2144 V HA -0.199 3.920 4.120 -0.001 0.000 0.246 2144 V C 2.582 178.623 176.094 -0.088 0.000 1.049 2144 V CA 2.185 64.447 62.300 -0.065 0.000 1.024 2144 V CB -0.541 31.244 31.823 -0.063 0.000 0.648 2144 V HN 0.564 nan 8.190 nan 0.000 0.447 2145 V N -0.952 118.897 119.914 -0.109 0.000 2.626 2145 V HA -0.064 4.055 4.120 -0.001 0.000 0.252 2145 V C 2.404 178.396 176.094 -0.170 0.000 1.067 2145 V CA 1.686 63.887 62.300 -0.165 0.000 1.081 2145 V CB -1.231 30.471 31.823 -0.203 0.000 0.686 2145 V HN 0.372 nan 8.190 nan 0.000 0.468 2146 A N 1.571 124.325 122.820 -0.111 0.000 1.873 2146 A HA 0.096 4.415 4.320 -0.001 0.000 0.215 2146 A C 2.396 179.943 177.584 -0.062 0.000 1.186 2146 A CA 1.856 53.848 52.037 -0.076 0.000 0.616 2146 A CB -1.482 17.494 19.000 -0.040 0.000 0.823 2146 A HN 0.671 nan 8.150 nan 0.000 0.442 2147 G N -0.741 108.023 108.800 -0.061 0.000 2.408 2147 G HA2 -0.177 3.783 3.960 -0.001 0.000 0.217 2147 G HA3 -0.177 3.783 3.960 -0.001 0.000 0.217 2147 G C 1.461 176.327 174.900 -0.057 0.000 1.150 2147 G CA 1.289 46.358 45.100 -0.052 0.000 0.776 2147 G HN 0.536 nan 8.290 nan 0.000 0.542 2148 E N 0.337 120.488 120.200 -0.082 0.000 2.072 2148 E HA 0.026 4.376 4.350 -0.001 0.000 0.191 2148 E C 2.528 179.071 176.600 -0.094 0.000 0.985 2148 E CA 0.512 56.858 56.400 -0.091 0.000 0.801 2148 E CB -0.366 29.261 29.700 -0.120 0.000 0.750 2148 E HN 0.418 nan 8.360 nan 0.000 0.452 2149 L N -0.081 121.058 121.223 -0.141 0.000 2.046 2149 L HA -0.184 4.155 4.340 -0.001 0.000 0.208 2149 L C 2.425 179.328 176.870 0.056 0.000 1.077 2149 L CA 0.945 55.690 54.840 -0.158 0.000 0.747 2149 L CB -0.385 41.498 42.059 -0.293 0.000 0.896 2149 L HN 0.220 nan 8.230 nan 0.000 0.432 2150 L N -0.764 120.483 121.223 0.040 0.000 2.046 2150 L HA -0.219 4.120 4.340 -0.001 0.000 0.208 2150 L C 2.825 179.719 176.870 0.041 0.000 1.077 2150 L CA 1.126 56.003 54.840 0.061 0.000 0.747 2150 L CB -0.517 41.550 42.059 0.013 0.000 0.896 2150 L HN 0.256 nan 8.230 nan 0.000 0.432 2151 R N 0.344 120.851 120.500 0.010 0.000 2.083 2151 R HA -0.172 4.168 4.340 -0.001 0.000 0.237 2151 R C 2.285 178.603 176.300 0.029 0.000 1.137 2151 R CA 1.297 57.400 56.100 0.005 0.000 0.951 2151 R CB 0.054 30.345 30.300 -0.015 0.000 0.851 2151 R HN 0.148 nan 8.270 nan 0.000 0.434 2152 K N 0.226 120.656 120.400 0.050 0.000 2.148 2152 K HA -0.050 4.270 4.320 -0.001 0.000 0.204 2152 K C 1.945 178.625 176.600 0.134 0.000 1.050 2152 K CA 1.185 57.525 56.287 0.089 0.000 0.942 2152 K CB -0.328 32.233 32.500 0.102 0.000 0.724 2152 K HN 0.272 nan 8.250 nan 0.000 0.446 2153 A N 1.426 124.346 122.820 0.168 0.000 1.883 2153 A HA -0.225 4.095 4.320 -0.001 0.000 0.217 2153 A C 2.198 179.806 177.584 0.040 0.000 1.186 2153 A CA 1.917 54.030 52.037 0.126 0.000 0.624 2153 A CB -0.466 18.615 19.000 0.135 0.000 0.822 2153 A HN 0.457 nan 8.150 nan 0.000 0.444 2154 E N -0.470 119.747 120.200 0.030 0.000 2.106 2154 E HA -0.225 4.125 4.350 -0.001 0.000 0.192 2154 E C 2.003 178.608 176.600 0.008 0.000 0.984 2154 E CA 1.122 57.526 56.400 0.006 0.000 0.806 2154 E CB -0.149 29.552 29.700 0.001 0.000 0.750 2154 E HN 0.750 nan 8.360 nan 0.000 0.458 2155 E N -0.084 120.128 120.200 0.021 0.000 2.070 2155 E HA -0.235 4.115 4.350 -0.001 0.000 0.197 2155 E C 1.911 178.522 176.600 0.019 0.000 1.004 2155 E CA 1.142 57.555 56.400 0.021 0.000 0.805 2155 E CB 0.050 29.767 29.700 0.030 0.000 0.744 2155 E HN 0.209 nan 8.360 nan 0.000 0.451 2156 L N 0.280 121.518 121.223 0.025 0.000 2.109 2156 L HA -0.123 4.217 4.340 -0.001 0.000 0.207 2156 L C 2.262 179.128 176.870 -0.008 0.000 1.086 2156 L CA 0.963 55.812 54.840 0.015 0.000 0.760 2156 L CB -0.694 41.377 42.059 0.019 0.000 0.910 2156 L HN 0.233 nan 8.230 nan 0.000 0.437 2157 L N -0.653 120.557 121.223 -0.021 0.000 2.083 2157 L HA -0.218 4.122 4.340 -0.001 0.000 0.209 2157 L C 2.121 178.972 176.870 -0.030 0.000 1.083 2157 L CA 1.650 56.464 54.840 -0.043 0.000 0.752 2157 L CB -0.826 41.202 42.059 -0.052 0.000 0.899 2157 L HN 0.280 nan 8.230 nan 0.000 0.433 2158 D N -1.813 118.578 120.400 -0.015 0.000 2.249 2158 D HA -0.110 4.530 4.640 -0.001 0.000 0.205 2158 D C 1.778 178.076 176.300 -0.003 0.000 0.962 2158 D CA 0.470 54.465 54.000 -0.009 0.000 0.860 2158 D CB 0.218 41.016 40.800 -0.004 0.000 0.955 2158 D HN 0.193 nan 8.370 nan 0.000 0.505 2159 Q N 0.141 119.941 119.800 0.001 0.000 2.373 2159 Q HA 0.060 4.400 4.340 -0.001 0.000 0.206 2159 Q C 0.004 176.008 176.000 0.007 0.000 0.942 2159 Q CA 0.132 55.938 55.803 0.006 0.000 0.953 2159 Q CB 0.206 28.951 28.738 0.012 0.000 1.022 2159 Q HN 0.251 nan 8.270 nan 0.000 0.502 2160 N N -0.854 117.848 118.700 0.003 0.000 2.861 2160 N HA -0.138 4.601 4.740 -0.001 0.000 0.247 2160 N C -1.582 173.940 175.510 0.019 0.000 1.117 2160 N CA 0.262 53.318 53.050 0.010 0.000 0.703 2160 N CB -1.071 37.424 38.487 0.013 0.000 1.052 2160 N HN -0.046 nan 8.380 nan 0.000 0.555 2161 V N 1.825 121.745 119.914 0.010 0.000 2.334 2161 V HA 0.230 4.350 4.120 -0.001 0.000 0.281 2161 V C 0.622 176.728 176.094 0.019 0.000 1.016 2161 V CA -0.870 61.442 62.300 0.019 0.000 0.832 2161 V CB 1.245 33.070 31.823 0.004 0.000 0.999 2161 V HN 0.306 nan 8.190 nan 0.000 0.439 2162 H N 7.785 126.835 119.070 -0.033 0.000 2.928 2162 H HA 0.097 4.653 4.556 -0.000 0.000 0.338 2162 H C -1.731 173.566 175.328 -0.053 0.000 1.047 2162 H CA -1.268 54.760 56.048 -0.035 0.000 1.435 2162 H CB 1.945 31.689 29.762 -0.029 0.000 1.428 2162 H HN 0.351 nan 8.280 nan 0.000 0.590 2163 P HA -0.188 nan 4.420 nan 0.000 0.217 2163 P C 1.402 178.730 177.300 0.046 0.000 1.148 2163 P CA 2.461 65.499 63.100 -0.102 0.000 0.834 2163 P CB 0.018 31.609 31.700 -0.182 0.000 0.783 2164 T N -4.098 110.633 114.554 0.295 0.000 2.995 2164 T HA -0.064 4.286 4.350 -0.001 0.000 0.269 2164 T C 1.624 176.347 174.700 0.039 0.000 1.091 2164 T CA 0.808 62.993 62.100 0.141 0.000 1.128 2164 T CB -0.941 67.987 68.868 0.099 0.000 0.891 2164 T HN -0.048 nan 8.240 nan 0.000 0.492 2165 I N 0.878 121.475 120.570 0.046 0.000 2.480 2165 I HA 0.042 4.212 4.170 -0.001 0.000 0.251 2165 I C 2.576 178.641 176.117 -0.088 0.000 1.124 2165 I CA 0.384 61.675 61.300 -0.016 0.000 1.444 2165 I CB -0.283 37.719 38.000 0.004 0.000 1.098 2165 I HN 0.072 nan 8.210 nan 0.000 0.428 2166 V N 0.723 120.551 119.914 -0.144 0.000 2.295 2166 V HA -0.238 3.881 4.120 -0.001 0.000 0.246 2166 V C 2.561 178.323 176.094 -0.553 0.000 1.049 2166 V CA 2.041 64.118 62.300 -0.371 0.000 1.024 2166 V CB -0.767 30.842 31.823 -0.356 0.000 0.648 2166 V HN 0.439 nan 8.190 nan 0.000 0.447 2167 V N -0.706 119.038 119.914 -0.283 0.000 2.667 2167 V HA -0.144 3.976 4.120 -0.001 0.000 0.252 2167 V C 2.361 178.413 176.094 -0.069 0.000 1.065 2167 V CA 2.189 64.397 62.300 -0.153 0.000 1.083 2167 V CB -0.798 30.992 31.823 -0.053 0.000 0.692 2167 V HN 0.514 nan 8.190 nan 0.000 0.468 2168 K N 2.305 122.664 120.400 -0.069 0.000 2.031 2168 K HA 0.107 4.426 4.320 -0.001 0.000 0.205 2168 K C 2.122 178.714 176.600 -0.013 0.000 1.049 2168 K CA 2.009 58.279 56.287 -0.029 0.000 0.939 2168 K CB -1.264 31.220 32.500 -0.026 0.000 0.717 2168 K HN 0.426 nan 8.250 nan 0.000 0.438 2169 G N -0.715 108.069 108.800 -0.027 0.000 2.408 2169 G HA2 -0.196 3.763 3.960 -0.001 0.000 0.217 2169 G HA3 -0.196 3.763 3.960 -0.001 0.000 0.217 2169 G C 1.135 176.110 174.900 0.125 0.000 1.150 2169 G CA 0.717 45.850 45.100 0.054 0.000 0.776 2169 G HN 0.271 nan 8.290 nan 0.000 0.542 2170 Y N 0.341 120.589 120.300 -0.085 0.000 2.263 2170 Y HA -0.021 4.529 4.550 -0.001 0.000 0.292 2170 Y C 2.853 178.537 175.900 -0.359 0.000 1.130 2170 Y CA 0.916 58.890 58.100 -0.210 0.000 1.179 2170 Y CB -0.930 37.601 38.460 0.118 0.000 0.998 2170 Y HN 0.264 nan 8.280 nan 0.000 0.532 2171 Q N 0.423 120.230 119.800 0.012 0.000 2.083 2171 Q HA -0.047 4.292 4.340 -0.001 0.000 0.198 2171 Q C 2.362 178.303 176.000 -0.098 0.000 0.969 2171 Q CA 1.743 57.527 55.803 -0.032 0.000 0.838 2171 Q CB -0.456 28.287 28.738 0.007 0.000 0.900 2171 Q HN 0.319 nan 8.270 nan 0.000 0.436 2172 A N 0.265 123.052 122.820 -0.054 0.000 1.873 2172 A HA -0.009 4.311 4.320 -0.001 0.000 0.215 2172 A C 2.276 179.817 177.584 -0.073 0.000 1.186 2172 A CA 1.851 53.903 52.037 0.024 0.000 0.616 2172 A CB -1.160 17.930 19.000 0.151 0.000 0.823 2172 A HN 0.500 nan 8.150 nan 0.000 0.442 2173 A N -0.299 122.388 122.820 -0.221 0.000 1.930 2173 A HA 0.225 4.544 4.320 -0.001 0.000 0.217 2173 A C 2.451 179.688 177.584 -0.580 0.000 1.175 2173 A CA 1.884 53.654 52.037 -0.445 0.000 0.627 2173 A CB -0.860 17.765 19.000 -0.625 0.000 0.815 2173 A HN 0.995 nan 8.150 nan 0.000 0.443 2174 A N -1.155 121.254 122.820 -0.684 0.000 1.930 2174 A HA -0.132 4.188 4.320 -0.001 0.000 0.217 2174 A C 2.111 179.603 177.584 -0.153 0.000 1.175 2174 A CA 1.491 53.364 52.037 -0.272 0.000 0.627 2174 A CB -0.391 18.524 19.000 -0.140 0.000 0.815 2174 A HN 0.464 nan 8.150 nan 0.000 0.443 2175 Q N -0.306 119.391 119.800 -0.172 0.000 2.119 2175 Q HA -0.168 4.172 4.340 -0.001 0.000 0.201 2175 Q C 2.017 177.910 176.000 -0.178 0.000 0.972 2175 Q CA 1.847 57.575 55.803 -0.127 0.000 0.847 2175 Q CB -0.338 28.348 28.738 -0.087 0.000 0.903 2175 Q HN 0.632 nan 8.270 nan 0.000 0.433 2176 K N 0.909 121.111 120.400 -0.330 0.000 2.148 2176 K HA 0.009 4.329 4.320 -0.001 0.000 0.204 2176 K C 1.821 178.268 176.600 -0.255 0.000 1.050 2176 K CA 1.150 57.173 56.287 -0.441 0.000 0.942 2176 K CB -0.363 31.490 32.500 -1.079 0.000 0.724 2176 K HN 0.125 nan 8.250 nan 0.000 0.446 2177 A N 0.532 123.241 122.820 -0.184 0.000 1.933 2177 A HA -0.196 4.123 4.320 -0.001 0.000 0.218 2177 A C 2.035 179.596 177.584 -0.039 0.000 1.175 2177 A CA 1.579 53.581 52.037 -0.058 0.000 0.628 2177 A CB -0.483 18.546 19.000 0.049 0.000 0.814 2177 A HN 0.496 nan 8.150 nan 0.000 0.444 2178 Q N -0.877 118.893 119.800 -0.051 0.000 2.084 2178 Q HA -0.211 4.128 4.340 -0.001 0.000 0.202 2178 Q C 2.140 178.119 176.000 -0.035 0.000 0.978 2178 Q CA 1.637 57.420 55.803 -0.033 0.000 0.844 2178 Q CB -0.159 28.559 28.738 -0.033 0.000 0.898 2178 Q HN 0.863 nan 8.270 nan 0.000 0.426 2179 E N 0.767 120.933 120.200 -0.057 0.000 2.072 2179 E HA -0.179 4.171 4.350 -0.001 0.000 0.191 2179 E C 1.988 178.567 176.600 -0.035 0.000 0.985 2179 E CA 0.633 57.005 56.400 -0.047 0.000 0.801 2179 E CB 0.001 29.663 29.700 -0.063 0.000 0.750 2179 E HN 0.295 nan 8.360 nan 0.000 0.452 2180 L N 0.601 121.797 121.223 -0.045 0.000 2.042 2180 L HA -0.212 4.128 4.340 -0.001 0.000 0.210 2180 L C 2.566 179.434 176.870 -0.002 0.000 1.076 2180 L CA 0.924 55.751 54.840 -0.021 0.000 0.749 2180 L CB -0.327 41.717 42.059 -0.024 0.000 0.893 2180 L HN 0.266 nan 8.230 nan 0.000 0.432 2181 L N -0.798 120.423 121.223 -0.005 0.000 2.109 2181 L HA -0.135 4.204 4.340 -0.001 0.000 0.207 2181 L C 2.609 179.481 176.870 0.004 0.000 1.086 2181 L CA 0.782 55.624 54.840 0.004 0.000 0.760 2181 L CB -0.428 41.633 42.059 0.004 0.000 0.910 2181 L HN 0.164 nan 8.230 nan 0.000 0.437 2182 K N -0.149 120.249 120.400 -0.003 0.000 2.211 2182 K HA -0.083 4.237 4.320 -0.001 0.000 0.203 2182 K C 2.070 178.670 176.600 0.001 0.000 1.050 2182 K CA 1.768 58.054 56.287 -0.002 0.000 0.945 2182 K CB -0.353 32.144 32.500 -0.006 0.000 0.732 2182 K HN 0.466 nan 8.250 nan 0.000 0.451 2183 T N -1.892 112.663 114.554 0.001 0.000 3.040 2183 T HA 0.062 4.412 4.350 -0.001 0.000 0.252 2183 T C 1.830 176.536 174.700 0.009 0.000 1.064 2183 T CA -0.017 62.085 62.100 0.004 0.000 1.110 2183 T CB -0.006 68.864 68.868 0.002 0.000 0.921 2183 T HN -0.064 nan 8.240 nan 0.000 0.480 2184 I N 2.134 122.713 120.570 0.015 0.000 2.876 2184 I HA 0.443 4.612 4.170 -0.001 0.000 0.264 2184 I C 1.402 177.532 176.117 0.022 0.000 1.204 2184 I CA -0.626 60.689 61.300 0.025 0.000 1.485 2184 I CB -0.616 37.410 38.000 0.043 0.000 1.103 2184 I HN 0.347 nan 8.210 nan 0.000 0.446 2185 A N 0.038 122.867 122.820 0.016 0.000 2.531 2185 A HA 0.097 4.417 4.320 -0.001 0.000 0.236 2185 A C 0.088 177.679 177.584 0.011 0.000 1.062 2185 A CA 0.044 52.089 52.037 0.013 0.000 0.760 2185 A CB -0.468 18.537 19.000 0.009 0.000 0.995 2185 A HN 0.433 nan 8.150 nan 0.000 0.501 2186 C N 3.126 122.433 119.300 0.011 0.000 2.264 2186 C HA 0.434 4.894 4.460 -0.001 0.000 0.324 2186 C C 0.366 175.359 174.990 0.006 0.000 1.267 2186 C CA -0.579 58.444 59.018 0.008 0.000 1.618 2186 C CB -0.509 27.237 27.740 0.010 0.000 2.278 2186 C HN 0.932 nan 8.230 nan 0.000 0.499 2187 E N 1.336 121.539 120.200 0.004 0.000 2.414 2187 E HA 0.358 4.708 4.350 -0.001 0.000 0.263 2187 E C -0.138 176.464 176.600 0.003 0.000 1.000 2187 E CA 0.403 56.805 56.400 0.003 0.000 0.914 2187 E CB 0.522 30.224 29.700 0.002 0.000 0.948 2187 E HN 0.497 nan 8.360 nan 0.000 0.444 2188 V N 2.150 122.065 119.914 0.003 0.000 3.087 2188 V HA 0.628 4.747 4.120 -0.001 0.000 0.306 2188 V C -0.185 175.910 176.094 0.002 0.000 1.187 2188 V CA -0.590 61.712 62.300 0.003 0.000 0.999 2188 V CB 2.255 34.080 31.823 0.003 0.000 1.049 2188 V HN 0.752 nan 8.190 nan 0.000 0.431 2189 G N 3.160 111.961 108.800 0.002 0.000 2.254 2189 G HA2 0.402 4.361 3.960 -0.001 0.000 0.253 2189 G HA3 0.402 4.361 3.960 -0.001 0.000 0.253 2189 G C 1.028 175.929 174.900 0.002 0.000 1.246 2189 G CA 0.383 45.484 45.100 0.002 0.000 0.946 2189 G HN 1.559 nan 8.290 nan 0.000 0.474 2190 A N 2.636 125.457 122.820 0.002 0.000 1.933 2190 A HA -0.070 4.249 4.320 -0.001 0.000 0.218 2190 A C 2.052 179.638 177.584 0.003 0.000 1.175 2190 A CA 1.214 53.252 52.037 0.002 0.000 0.628 2190 A CB -0.023 18.978 19.000 0.002 0.000 0.814 2190 A HN 0.577 nan 8.150 nan 0.000 0.444 2191 Q N -0.207 119.595 119.800 0.003 0.000 2.198 2191 Q HA 0.058 4.398 4.340 -0.001 0.000 0.209 2191 Q C -0.745 175.257 176.000 0.003 0.000 0.848 2191 Q CA -0.123 55.681 55.803 0.003 0.000 0.974 2191 Q CB 0.062 28.802 28.738 0.003 0.000 1.115 2191 Q HN 0.745 nan 8.270 nan 0.000 0.494 2192 D N 1.074 121.475 120.400 0.002 0.000 2.412 2192 D HA -0.048 4.591 4.640 -0.001 0.000 0.257 2192 D C 1.234 177.534 176.300 0.001 0.000 1.217 2192 D CA 0.159 54.160 54.000 0.001 0.000 0.897 2192 D CB 0.916 41.717 40.800 0.001 0.000 1.132 2192 D HN -0.220 nan 8.370 nan 0.000 0.493 2193 K N 2.997 123.398 120.400 0.001 0.000 2.077 2193 K HA -0.257 4.062 4.320 -0.001 0.000 0.213 2193 K C 1.448 178.048 176.600 -0.001 0.000 1.051 2193 K CA 1.687 57.974 56.287 0.000 0.000 0.929 2193 K CB 0.018 32.518 32.500 -0.000 0.000 0.715 2193 K HN 0.492 nan 8.250 nan 0.000 0.451 2194 E N 0.051 120.250 120.200 -0.002 0.000 2.017 2194 E HA -0.186 4.164 4.350 -0.001 0.000 0.193 2194 E C 2.113 178.711 176.600 -0.003 0.000 0.997 2194 E CA 1.402 57.800 56.400 -0.004 0.000 0.804 2194 E CB -0.469 29.228 29.700 -0.004 0.000 0.757 2194 E HN 0.343 nan 8.360 nan 0.000 0.448 2195 I N 1.215 121.784 120.570 -0.001 0.000 2.335 2195 I HA -0.233 3.937 4.170 -0.001 0.000 0.251 2195 I C 2.248 178.365 176.117 0.001 0.000 1.129 2195 I CA 0.941 62.241 61.300 -0.000 0.000 1.402 2195 I CB -0.165 37.836 38.000 0.001 0.000 1.069 2195 I HN 0.035 nan 8.210 nan 0.000 0.424 2196 L N -0.415 120.808 121.223 0.001 0.000 2.056 2196 L HA -0.188 4.151 4.340 -0.001 0.000 0.207 2196 L C 2.496 179.366 176.870 0.001 0.000 1.078 2196 L CA 1.860 56.701 54.840 0.002 0.000 0.749 2196 L CB -1.175 40.886 42.059 0.002 0.000 0.901 2196 L HN 0.406 nan 8.230 nan 0.000 0.433 2197 T N -3.745 110.808 114.554 -0.001 0.000 2.985 2197 T HA -0.093 4.257 4.350 -0.001 0.000 0.266 2197 T C 1.862 176.559 174.700 -0.005 0.000 1.076 2197 T CA 0.573 62.672 62.100 -0.003 0.000 1.135 2197 T CB 0.006 68.871 68.868 -0.005 0.000 0.890 2197 T HN 0.005 nan 8.240 nan 0.000 0.480 2198 K N 0.797 121.193 120.400 -0.005 0.000 2.062 2198 K HA 0.248 4.568 4.320 -0.001 0.000 0.205 2198 K C 2.126 178.726 176.600 -0.001 0.000 1.051 2198 K CA 0.594 56.877 56.287 -0.007 0.000 0.941 2198 K CB -0.429 32.068 32.500 -0.006 0.000 0.719 2198 K HN 0.266 nan 8.250 nan 0.000 0.440 2199 I N 0.739 121.311 120.570 0.002 0.000 2.179 2199 I HA -0.211 3.959 4.170 -0.001 0.000 0.242 2199 I C 2.162 178.284 176.117 0.007 0.000 1.088 2199 I CA 1.435 62.739 61.300 0.006 0.000 1.357 2199 I CB -1.336 36.668 38.000 0.006 0.000 1.051 2199 I HN 0.090 nan 8.210 nan 0.000 0.409 2200 A N 0.818 123.641 122.820 0.005 0.000 1.873 2200 A HA -0.245 4.074 4.320 -0.001 0.000 0.218 2200 A C 2.410 179.998 177.584 0.007 0.000 1.193 2200 A CA 2.001 54.041 52.037 0.006 0.000 0.629 2200 A CB -0.638 18.365 19.000 0.004 0.000 0.826 2200 A HN 0.355 nan 8.150 nan 0.000 0.447 2201 M N -0.310 119.292 119.600 0.003 0.000 2.132 2201 M HA -0.130 4.350 4.480 -0.001 0.000 0.263 2201 M C 2.427 178.734 176.300 0.012 0.000 1.065 2201 M CA 2.019 57.319 55.300 0.000 0.000 1.122 2201 M CB -0.746 31.844 32.600 -0.016 0.000 1.365 2201 M HN 0.725 nan 8.290 nan 0.000 0.411 2202 T N -2.719 111.844 114.554 0.015 0.000 2.867 2202 T HA -0.094 4.255 4.350 -0.001 0.000 0.268 2202 T C 1.888 176.613 174.700 0.042 0.000 1.057 2202 T CA 1.628 63.749 62.100 0.035 0.000 1.136 2202 T CB -0.456 68.431 68.868 0.031 0.000 0.874 2202 T HN 0.298 nan 8.240 nan 0.000 0.466 2203 S N 0.923 116.640 115.700 0.028 0.000 2.368 2203 S HA 0.050 4.519 4.470 -0.001 0.000 0.224 2203 S C 2.001 176.618 174.600 0.029 0.000 1.029 2203 S CA 0.724 58.938 58.200 0.025 0.000 0.988 2203 S CB -0.616 62.594 63.200 0.017 0.000 0.838 2203 S HN 0.589 nan 8.310 nan 0.000 0.462 2204 I N 1.761 122.348 120.570 0.029 0.000 2.361 2204 I HA -0.101 4.069 4.170 -0.001 0.000 0.251 2204 I C 1.276 177.421 176.117 0.047 0.000 1.133 2204 I CA 0.895 62.213 61.300 0.031 0.000 1.413 2204 I CB -0.907 37.107 38.000 0.024 0.000 1.073 2204 I HN 0.428 nan 8.210 nan 0.000 0.424 2205 T N -0.585 114.011 114.554 0.069 0.000 2.932 2205 T HA 0.321 4.670 4.350 -0.001 0.000 0.312 2205 T C 1.161 175.919 174.700 0.097 0.000 1.071 2205 T CA 0.100 62.273 62.100 0.121 0.000 1.128 2205 T CB 1.287 70.281 68.868 0.210 0.000 0.984 2205 T HN 0.604 nan 8.240 nan 0.000 0.549 2206 G N 1.510 110.368 108.800 0.097 0.000 2.176 2206 G HA2 -0.207 3.753 3.960 -0.001 0.000 0.253 2206 G HA3 -0.207 3.753 3.960 -0.001 0.000 0.253 2206 G C -0.068 174.848 174.900 0.028 0.000 0.979 2206 G CA 0.394 45.516 45.100 0.037 0.000 0.641 2206 G HN 0.943 nan 8.290 nan 0.000 0.530 2207 K N -0.939 119.485 120.400 0.040 0.000 2.350 2207 K HA 0.621 4.940 4.320 -0.001 0.000 0.241 2207 K C 1.495 178.116 176.600 0.035 0.000 0.994 2207 K CA -0.520 55.785 56.287 0.030 0.000 0.839 2207 K CB 1.434 33.951 32.500 0.027 0.000 1.244 2207 K HN 0.160 nan 8.250 nan 0.000 0.443 2208 G N 0.376 109.193 108.800 0.028 0.000 2.422 2208 G HA2 -0.223 3.737 3.960 -0.001 0.000 0.218 2208 G HA3 -0.223 3.737 3.960 -0.001 0.000 0.218 2208 G C 1.291 176.209 174.900 0.030 0.000 1.140 2208 G CA 0.985 46.102 45.100 0.029 0.000 0.775 2208 G HN 0.616 nan 8.290 nan 0.000 0.545 2209 A N 1.691 124.528 122.820 0.028 0.000 2.125 2209 A HA -0.030 4.290 4.320 -0.001 0.000 0.219 2209 A C 2.131 179.730 177.584 0.025 0.000 1.156 2209 A CA 1.764 53.816 52.037 0.025 0.000 0.671 2209 A CB -0.438 18.576 19.000 0.023 0.000 0.794 2209 A HN 0.662 nan 8.150 nan 0.000 0.459 2210 E N 1.234 121.454 120.200 0.033 0.000 2.331 2210 E HA -0.294 4.056 4.350 -0.001 0.000 0.199 2210 E C 1.614 178.227 176.600 0.022 0.000 1.008 2210 E CA 1.368 57.788 56.400 0.033 0.000 0.843 2210 E CB -0.547 29.189 29.700 0.060 0.000 0.761 2210 E HN 0.820 nan 8.360 nan 0.000 0.507 2211 K N 0.860 121.274 120.400 0.024 0.000 2.211 2211 K HA -0.073 4.247 4.320 -0.001 0.000 0.204 2211 K C 1.501 178.106 176.600 0.008 0.000 1.047 2211 K CA 1.492 57.789 56.287 0.016 0.000 0.935 2211 K CB -0.006 32.505 32.500 0.019 0.000 0.728 2211 K HN 0.160 nan 8.250 nan 0.000 0.452 2212 A N 1.768 124.593 122.820 0.009 0.000 2.616 2212 A HA 0.145 4.464 4.320 -0.001 0.000 0.294 2212 A C 1.304 178.890 177.584 0.003 0.000 1.091 2212 A CA -0.562 51.478 52.037 0.005 0.000 0.971 2212 A CB -0.054 18.951 19.000 0.008 0.000 1.222 2212 A HN 0.415 nan 8.150 nan 0.000 0.521 2213 K N 0.165 120.566 120.400 0.002 0.000 2.286 2213 K HA -0.211 4.108 4.320 -0.001 0.000 0.203 2213 K C 0.864 177.461 176.600 -0.005 0.000 1.045 2213 K CA 1.929 58.216 56.287 -0.000 0.000 0.935 2213 K CB -0.102 32.395 32.500 -0.004 0.000 0.737 2213 K HN 0.333 nan 8.250 nan 0.000 0.460 2214 E N 1.488 121.682 120.200 -0.009 0.000 2.046 2214 E HA -0.140 4.210 4.350 -0.001 0.000 0.190 2214 E C 1.914 178.511 176.600 -0.004 0.000 0.982 2214 E CA 1.300 57.694 56.400 -0.010 0.000 0.800 2214 E CB -0.073 29.619 29.700 -0.013 0.000 0.756 2214 E HN 0.257 nan 8.360 nan 0.000 0.449 2215 K N 0.336 120.735 120.400 -0.001 0.000 2.097 2215 K HA -0.081 4.239 4.320 -0.001 0.000 0.205 2215 K C 1.638 178.240 176.600 0.005 0.000 1.050 2215 K CA 0.811 57.100 56.287 0.002 0.000 0.938 2215 K CB -0.254 32.249 32.500 0.004 0.000 0.718 2215 K HN 0.005 nan 8.250 nan 0.000 0.442 2216 L N 0.410 121.636 121.223 0.005 0.000 2.093 2216 L HA 0.035 4.375 4.340 -0.001 0.000 0.208 2216 L C 2.276 179.150 176.870 0.006 0.000 1.085 2216 L CA 1.895 56.739 54.840 0.007 0.000 0.755 2216 L CB -1.151 40.913 42.059 0.009 0.000 0.904 2216 L HN 0.270 nan 8.230 nan 0.000 0.435 2217 A N -0.801 122.021 122.820 0.003 0.000 1.898 2217 A HA -0.225 4.095 4.320 -0.001 0.000 0.216 2217 A C 2.314 179.899 177.584 0.002 0.000 1.181 2217 A CA 1.629 53.666 52.037 0.002 0.000 0.620 2217 A CB -0.496 18.502 19.000 -0.002 0.000 0.819 2217 A HN 0.380 nan 8.150 nan 0.000 0.442 2218 E N 0.333 120.534 120.200 0.002 0.000 2.058 2218 E HA -0.159 4.191 4.350 -0.001 0.000 0.194 2218 E C 1.697 178.300 176.600 0.006 0.000 0.997 2218 E CA 1.597 57.999 56.400 0.003 0.000 0.801 2218 E CB -0.389 29.313 29.700 0.002 0.000 0.746 2218 E HN 0.639 nan 8.360 nan 0.000 0.450 2219 I N -0.330 120.244 120.570 0.007 0.000 2.179 2219 I HA -0.234 3.935 4.170 -0.001 0.000 0.242 2219 I C 1.932 178.055 176.117 0.009 0.000 1.088 2219 I CA 0.758 62.064 61.300 0.010 0.000 1.357 2219 I CB -0.153 37.855 38.000 0.012 0.000 1.051 2219 I HN 0.161 nan 8.210 nan 0.000 0.409 2220 I N -0.361 120.214 120.570 0.008 0.000 2.406 2220 I HA -0.163 4.006 4.170 -0.001 0.000 0.249 2220 I C 2.296 178.417 176.117 0.006 0.000 1.122 2220 I CA 1.069 62.373 61.300 0.007 0.000 1.431 2220 I CB -0.288 37.716 38.000 0.006 0.000 1.087 2220 I HN -0.063 nan 8.210 nan 0.000 0.424 2221 V N 0.232 120.149 119.914 0.006 0.000 2.358 2221 V HA -0.259 3.861 4.120 -0.001 0.000 0.246 2221 V C 2.511 178.609 176.094 0.006 0.000 1.047 2221 V CA 1.919 64.222 62.300 0.005 0.000 1.035 2221 V CB -0.548 31.277 31.823 0.004 0.000 0.658 2221 V HN 0.403 nan 8.190 nan 0.000 0.452 2222 E N 0.846 121.050 120.200 0.007 0.000 2.077 2222 E HA -0.163 4.187 4.350 -0.001 0.000 0.193 2222 E C 2.134 178.740 176.600 0.010 0.000 0.989 2222 E CA 1.682 58.087 56.400 0.009 0.000 0.800 2222 E CB -0.493 29.212 29.700 0.010 0.000 0.746 2222 E HN 0.492 nan 8.360 nan 0.000 0.452 2223 A N 0.031 122.856 122.820 0.010 0.000 1.902 2223 A HA -0.137 4.183 4.320 -0.001 0.000 0.217 2223 A C 2.505 180.094 177.584 0.008 0.000 1.181 2223 A CA 1.731 53.773 52.037 0.009 0.000 0.623 2223 A CB -0.786 18.219 19.000 0.008 0.000 0.818 2223 A HN 0.205 nan 8.150 nan 0.000 0.443 2224 V N -0.329 119.589 119.914 0.007 0.000 2.307 2224 V HA -0.194 3.925 4.120 -0.001 0.000 0.245 2224 V C 2.764 178.862 176.094 0.007 0.000 1.045 2224 V CA 2.242 64.545 62.300 0.006 0.000 1.024 2224 V CB -0.852 30.974 31.823 0.005 0.000 0.651 2224 V HN 0.546 nan 8.190 nan 0.000 0.449 2225 S N 0.191 115.895 115.700 0.008 0.000 2.387 2225 S HA -0.220 4.250 4.470 -0.001 0.000 0.230 2225 S C 2.169 176.776 174.600 0.011 0.000 1.035 2225 S CA 1.512 59.717 58.200 0.009 0.000 1.014 2225 S CB -0.473 62.732 63.200 0.009 0.000 0.836 2225 S HN 0.659 nan 8.310 nan 0.000 0.466 2226 A N 1.113 123.941 122.820 0.013 0.000 1.855 2226 A HA -0.044 4.276 4.320 -0.001 0.000 0.215 2226 A C 2.402 179.996 177.584 0.016 0.000 1.191 2226 A CA 1.762 53.809 52.037 0.018 0.000 0.613 2226 A CB -0.822 18.189 19.000 0.019 0.000 0.829 2226 A HN 0.580 nan 8.150 nan 0.000 0.442 2227 V N -3.211 116.710 119.914 0.011 0.000 3.052 2227 V HA 0.041 4.160 4.120 -0.001 0.000 0.254 2227 V C 2.033 178.130 176.094 0.006 0.000 1.100 2227 V CA 1.363 63.668 62.300 0.009 0.000 1.112 2227 V CB -0.363 31.463 31.823 0.005 0.000 0.738 2227 V HN 0.194 nan 8.190 nan 0.000 0.469 2228 V N 0.552 120.469 119.914 0.006 0.000 2.809 2228 V HA -0.058 4.061 4.120 -0.001 0.000 0.256 2228 V C 1.571 177.667 176.094 0.003 0.000 1.080 2228 V CA 2.289 64.591 62.300 0.004 0.000 1.102 2228 V CB -0.537 31.288 31.823 0.004 0.000 0.705 2228 V HN 0.841 nan 8.190 nan 0.000 0.475 2229 D N -0.648 119.755 120.400 0.004 0.000 4.438 2229 D HA -0.218 4.421 4.640 -0.001 0.000 0.158 2229 D C 0.632 176.933 176.300 0.001 0.000 0.686 2229 D CA 1.928 55.930 54.000 0.002 0.000 1.183 2229 D CB -1.243 39.556 40.800 -0.002 0.000 0.623 2229 D HN 0.557 nan 8.370 nan 0.000 0.521 2230 D N 1.020 121.419 120.400 -0.001 0.000 2.393 2230 D HA 0.289 4.928 4.640 -0.001 0.000 0.246 2230 D C -0.157 176.143 176.300 0.000 0.000 1.275 2230 D CA 0.228 54.227 54.000 -0.001 0.000 0.979 2230 D CB 0.402 41.200 40.800 -0.003 0.000 1.101 2230 D HN 0.154 nan 8.370 nan 0.000 0.505 2231 E N -0.604 119.596 120.200 0.000 0.000 2.731 2231 E HA 0.596 4.946 4.350 -0.001 0.000 0.220 2231 E C -0.182 176.418 176.600 0.000 0.000 1.087 2231 E CA -0.503 55.897 56.400 0.001 0.000 1.020 2231 E CB 0.856 30.556 29.700 0.001 0.000 1.339 2231 E HN 0.502 nan 8.360 nan 0.000 0.444 2232 G N 0.589 109.390 108.800 0.000 0.000 2.328 2232 G HA2 0.353 4.313 3.960 -0.001 0.000 0.299 2232 G HA3 0.353 4.313 3.960 -0.001 0.000 0.299 2232 G C -1.738 173.162 174.900 0.000 0.000 1.435 2232 G CA -0.926 44.174 45.100 0.000 0.000 0.865 2232 G HN 0.025 nan 8.290 nan 0.000 0.601 2233 K N 0.303 120.703 120.400 0.000 0.000 2.581 2233 K HA 0.587 4.906 4.320 -0.001 0.000 0.249 2233 K C -1.662 174.938 176.600 0.000 0.000 0.966 2233 K CA -0.581 55.706 56.287 0.000 0.000 0.811 2233 K CB 2.059 34.559 32.500 -0.001 0.000 1.223 2233 K HN 0.879 nan 8.250 nan 0.000 0.438 2234 V N 3.032 122.947 119.914 0.001 0.000 2.547 2234 V HA 0.428 4.548 4.120 -0.001 0.000 0.299 2234 V C -1.122 174.972 176.094 -0.000 0.000 1.040 2234 V CA -0.516 61.784 62.300 0.001 0.000 0.913 2234 V CB 1.694 33.518 31.823 0.001 0.000 0.992 2234 V HN 0.779 nan 8.190 nan 0.000 0.449 2235 D N 4.541 124.940 120.400 -0.001 0.000 2.441 2235 D HA 0.332 4.972 4.640 -0.001 0.000 0.231 2235 D C 0.788 177.086 176.300 -0.003 0.000 1.073 2235 D CA -0.306 53.693 54.000 -0.002 0.000 0.850 2235 D CB 1.676 42.474 40.800 -0.003 0.000 1.062 2235 D HN 0.553 nan 8.370 nan 0.000 0.524 2236 K N 2.042 122.440 120.400 -0.003 0.000 2.280 2236 K HA -0.152 4.168 4.320 -0.001 0.000 0.202 2236 K C 0.882 177.478 176.600 -0.007 0.000 1.047 2236 K CA 0.825 57.109 56.287 -0.004 0.000 0.942 2236 K CB 0.248 32.747 32.500 -0.003 0.000 0.739 2236 K HN 0.355 nan 8.250 nan 0.000 0.457 2237 D N 0.763 121.158 120.400 -0.008 0.000 2.310 2237 D HA -0.072 4.568 4.640 -0.001 0.000 0.212 2237 D C 1.343 177.634 176.300 -0.015 0.000 0.965 2237 D CA 0.626 54.619 54.000 -0.012 0.000 0.879 2237 D CB 0.157 40.950 40.800 -0.012 0.000 0.921 2237 D HN 0.104 nan 8.370 nan 0.000 0.510 2238 L N -0.185 121.031 121.223 -0.011 0.000 2.492 2238 L HA 0.157 4.496 4.340 -0.001 0.000 0.223 2238 L C 0.355 177.218 176.870 -0.011 0.000 1.132 2238 L CA 0.248 55.081 54.840 -0.011 0.000 0.850 2238 L CB 0.133 42.189 42.059 -0.005 0.000 0.966 2238 L HN 0.019 nan 8.230 nan 0.000 0.454 2239 I N 0.568 121.131 120.570 -0.010 0.000 2.390 2239 I HA 0.180 4.350 4.170 -0.001 0.000 0.283 2239 I C -0.089 176.020 176.117 -0.015 0.000 1.016 2239 I CA -0.641 60.653 61.300 -0.009 0.000 1.151 2239 I CB 1.406 39.403 38.000 -0.004 0.000 1.293 2239 I HN -0.148 nan 8.210 nan 0.000 0.458 2240 K N 7.269 127.657 120.400 -0.021 0.000 2.172 2240 K HA 0.452 4.771 4.320 -0.001 0.000 0.276 2240 K C -0.786 175.800 176.600 -0.023 0.000 1.013 2240 K CA -0.239 56.031 56.287 -0.028 0.000 0.913 2240 K CB 0.775 33.248 32.500 -0.045 0.000 1.055 2240 K HN 0.396 nan 8.250 nan 0.000 0.461 2241 I N 3.932 124.490 120.570 -0.021 0.000 2.347 2241 I HA 0.239 4.409 4.170 -0.001 0.000 0.283 2241 I C -0.160 175.944 176.117 -0.022 0.000 1.058 2241 I CA -0.680 60.611 61.300 -0.015 0.000 1.202 2241 I CB 0.345 38.340 38.000 -0.009 0.000 1.386 2241 I HN 0.684 nan 8.210 nan 0.000 0.475 2242 E N 6.972 127.156 120.200 -0.026 0.000 2.214 2242 E HA 0.612 4.962 4.350 -0.001 0.000 0.274 2242 E C -0.784 175.806 176.600 -0.018 0.000 0.977 2242 E CA -0.595 55.785 56.400 -0.034 0.000 0.827 2242 E CB 1.405 31.069 29.700 -0.059 0.000 1.130 2242 E HN 0.563 nan 8.360 nan 0.000 0.394 2243 K N 1.623 122.011 120.400 -0.019 0.000 2.498 2243 K HA 0.688 5.007 4.320 -0.001 0.000 0.254 2243 K C -1.334 175.259 176.600 -0.012 0.000 0.933 2243 K CA -1.213 55.068 56.287 -0.010 0.000 0.806 2243 K CB 1.817 34.311 32.500 -0.011 0.000 1.301 2243 K HN 0.197 nan 8.250 nan 0.000 0.432 2244 K N 1.349 121.748 120.400 -0.001 0.000 2.581 2244 K HA 0.217 4.536 4.320 -0.001 0.000 0.249 2244 K C -1.282 175.320 176.600 0.003 0.000 0.966 2244 K CA -0.339 55.949 56.287 0.001 0.000 0.811 2244 K CB 2.181 34.690 32.500 0.015 0.000 1.223 2244 K HN 0.711 nan 8.250 nan 0.000 0.438 2245 S N 2.579 118.275 115.700 -0.007 0.000 2.568 2245 S HA 0.601 5.071 4.470 -0.001 0.000 0.282 2245 S C 0.135 174.738 174.600 0.004 0.000 1.338 2245 S CA 1.338 59.534 58.200 -0.006 0.000 1.045 2245 S CB -0.223 62.967 63.200 -0.018 0.000 0.873 2245 S HN 1.207 nan 8.310 nan 0.000 0.516 2246 G N 1.788 110.592 108.800 0.007 0.000 2.428 2246 G HA2 0.509 4.469 3.960 -0.001 0.000 0.681 2246 G HA3 0.509 4.469 3.960 -0.001 0.000 0.681 2246 G C -0.098 174.810 174.900 0.014 0.000 1.340 2246 G CA -0.039 45.067 45.100 0.011 0.000 0.915 2246 G HN 2.158 nan 8.290 nan 0.000 0.645 2247 A N -0.815 122.013 122.820 0.013 0.000 6.088 2247 A HA 0.395 4.714 4.320 -0.001 0.000 0.261 2247 A C 1.092 178.683 177.584 0.012 0.000 2.138 2247 A CA 1.914 53.958 52.037 0.012 0.000 0.708 2247 A CB -1.632 17.377 19.000 0.015 0.000 1.068 2247 A HN 2.717 nan 8.150 nan 0.000 0.364 2248 S N -2.557 113.150 115.700 0.012 0.000 2.745 2248 S HA 0.692 5.161 4.470 -0.001 0.000 0.306 2248 S C 1.124 175.732 174.600 0.014 0.000 1.137 2248 S CA 0.144 58.352 58.200 0.012 0.000 0.900 2248 S CB 1.369 64.575 63.200 0.010 0.000 1.176 2248 S HN 1.652 nan 8.310 nan 0.000 0.520 2249 I N 1.116 121.694 120.570 0.014 0.000 2.493 2249 I HA -0.086 4.084 4.170 -0.001 0.000 0.254 2249 I C 1.576 177.701 176.117 0.013 0.000 1.160 2249 I CA 1.600 62.908 61.300 0.014 0.000 1.445 2249 I CB -0.101 37.908 38.000 0.015 0.000 1.086 2249 I HN 0.795 nan 8.210 nan 0.000 0.433 2250 D N 0.756 121.162 120.400 0.011 0.000 2.264 2250 D HA -0.203 4.437 4.640 -0.001 0.000 0.208 2250 D C 1.594 177.900 176.300 0.009 0.000 0.966 2250 D CA 1.118 55.123 54.000 0.008 0.000 0.864 2250 D CB 0.022 40.826 40.800 0.006 0.000 0.933 2250 D HN 0.358 nan 8.370 nan 0.000 0.499 2251 D N -0.462 119.945 120.400 0.011 0.000 2.347 2251 D HA -0.032 4.608 4.640 -0.001 0.000 0.213 2251 D C 0.235 176.547 176.300 0.020 0.000 0.985 2251 D CA 0.385 54.393 54.000 0.013 0.000 0.879 2251 D CB -0.127 40.681 40.800 0.014 0.000 0.919 2251 D HN 0.148 nan 8.370 nan 0.000 0.526 2252 T N 1.564 116.130 114.554 0.021 0.000 2.933 2252 T HA 0.106 4.456 4.350 -0.001 0.000 0.306 2252 T C 0.291 175.007 174.700 0.027 0.000 1.045 2252 T CA 0.675 62.791 62.100 0.026 0.000 1.143 2252 T CB 1.038 69.919 68.868 0.021 0.000 1.003 2252 T HN 0.013 nan 8.240 nan 0.000 0.540 2253 E N 1.483 121.706 120.200 0.038 0.000 2.390 2253 E HA 0.531 4.880 4.350 -0.001 0.000 0.280 2253 E C -1.883 174.748 176.600 0.051 0.000 0.992 2253 E CA -0.813 55.610 56.400 0.038 0.000 0.790 2253 E CB 1.075 30.796 29.700 0.035 0.000 1.248 2253 E HN 0.356 nan 8.360 nan 0.000 0.447 2254 L N 3.336 124.584 121.223 0.042 0.000 2.312 2254 L HA 0.596 4.936 4.340 -0.001 0.000 0.281 2254 L C -1.079 175.827 176.870 0.061 0.000 1.070 2254 L CA -0.182 54.684 54.840 0.043 0.000 0.805 2254 L CB 0.791 42.867 42.059 0.028 0.000 1.174 2254 L HN 0.570 nan 8.230 nan 0.000 0.434 2255 I N 5.456 126.071 120.570 0.076 0.000 2.382 2255 I HA 0.301 4.471 4.170 -0.001 0.000 0.285 2255 I C -0.057 176.098 176.117 0.064 0.000 1.007 2255 I CA -0.461 60.901 61.300 0.102 0.000 1.142 2255 I CB 1.153 39.268 38.000 0.192 0.000 1.289 2255 I HN 0.326 nan 8.210 nan 0.000 0.453 2256 K N 5.779 126.210 120.400 0.052 0.000 2.081 2256 K HA 0.485 4.804 4.320 -0.001 0.000 0.230 2256 K C 0.455 177.077 176.600 0.035 0.000 1.199 2256 K CA -0.005 56.303 56.287 0.034 0.000 1.130 2256 K CB -0.284 32.230 32.500 0.024 0.000 1.386 2256 K HN 0.979 nan 8.250 nan 0.000 0.280 2257 G N -0.660 108.158 108.800 0.029 0.000 2.398 2257 G HA2 0.023 3.982 3.960 -0.001 0.000 0.251 2257 G HA3 0.023 3.982 3.960 -0.001 0.000 0.251 2257 G C -1.606 173.289 174.900 -0.008 0.000 1.277 2257 G CA -0.805 44.305 45.100 0.016 0.000 0.927 2257 G HN 0.085 nan 8.290 nan 0.000 0.477 2258 V N 0.753 120.647 119.914 -0.034 0.000 2.495 2258 V HA 0.705 4.825 4.120 -0.001 0.000 0.298 2258 V C -0.648 175.361 176.094 -0.142 0.000 1.031 2258 V CA -0.623 61.620 62.300 -0.094 0.000 0.871 2258 V CB 1.409 33.150 31.823 -0.136 0.000 0.988 2258 V HN 0.911 nan 8.190 nan 0.000 0.432 2259 L N 7.462 128.563 121.223 -0.204 0.000 2.305 2259 L HA 0.836 5.176 4.340 -0.001 0.000 0.284 2259 L C -0.383 176.316 176.870 -0.286 0.000 1.013 2259 L CA -0.152 54.464 54.840 -0.373 0.000 0.819 2259 L CB 1.692 43.435 42.059 -0.528 0.000 1.227 2259 L HN 0.577 nan 8.230 nan 0.000 0.417 2260 V N 1.573 121.325 119.914 -0.270 0.000 2.769 2260 V HA 0.636 4.755 4.120 -0.001 0.000 0.312 2260 V C -0.491 175.522 176.094 -0.136 0.000 1.061 2260 V CA -0.522 61.674 62.300 -0.174 0.000 0.931 2260 V CB 1.834 33.571 31.823 -0.143 0.000 1.010 2260 V HN 0.823 nan 8.190 nan 0.000 0.433 2261 D N 1.128 121.475 120.400 -0.088 0.000 3.134 2261 D HA 0.340 4.980 4.640 -0.001 0.000 0.248 2261 D C -0.103 176.191 176.300 -0.009 0.000 1.273 2261 D CA -0.264 53.703 54.000 -0.054 0.000 0.904 2261 D CB 0.342 41.114 40.800 -0.047 0.000 1.089 2261 D HN 0.521 nan 8.370 nan 0.000 0.478 2262 K N 0.278 120.688 120.400 0.016 0.000 2.313 2262 K HA 0.534 4.854 4.320 -0.001 0.000 0.235 2262 K C 0.185 176.819 176.600 0.057 0.000 1.035 2262 K CA -0.853 55.465 56.287 0.052 0.000 0.868 2262 K CB 1.728 34.291 32.500 0.106 0.000 1.232 2262 K HN 0.311 nan 8.250 nan 0.000 0.459 2263 E N -0.104 120.126 120.200 0.050 0.000 2.378 2263 E HA 0.481 4.830 4.350 -0.001 0.000 0.265 2263 E C -0.748 175.865 176.600 0.023 0.000 0.932 2263 E CA -1.141 55.282 56.400 0.039 0.000 0.795 2263 E CB 1.118 30.835 29.700 0.028 0.000 1.296 2263 E HN 0.100 nan 8.360 nan 0.000 0.438 2264 R N 1.405 121.912 120.500 0.011 0.000 2.296 2264 R HA 0.074 4.414 4.340 -0.001 0.000 0.323 2264 R C 1.247 177.541 176.300 -0.011 0.000 1.067 2264 R CA 0.159 56.251 56.100 -0.014 0.000 0.946 2264 R CB 0.960 31.251 30.300 -0.016 0.000 0.991 2264 R HN 0.649 nan 8.270 nan 0.000 0.448 2265 V N 0.010 119.912 119.914 -0.020 0.000 2.688 2265 V HA -0.101 4.019 4.120 -0.001 0.000 0.256 2265 V C 0.905 176.995 176.094 -0.006 0.000 1.084 2265 V CA 1.209 63.503 62.300 -0.010 0.000 1.103 2265 V CB -0.252 31.564 31.823 -0.013 0.000 0.688 2265 V HN 0.526 nan 8.190 nan 0.000 0.480 2266 S N -0.905 114.790 115.700 -0.009 0.000 2.521 2266 S HA 0.774 5.244 4.470 -0.001 0.000 0.295 2266 S C 0.827 175.427 174.600 -0.001 0.000 1.098 2266 S CA -0.139 58.061 58.200 -0.000 0.000 0.999 2266 S CB 1.822 65.024 63.200 0.004 0.000 1.034 2266 S HN 0.734 nan 8.310 nan 0.000 0.483 2267 A N 3.474 126.297 122.820 0.005 0.000 2.121 2267 A HA -0.026 4.293 4.320 -0.001 0.000 0.218 2267 A C 1.782 179.369 177.584 0.006 0.000 1.154 2267 A CA 1.113 53.154 52.037 0.006 0.000 0.679 2267 A CB -0.438 18.567 19.000 0.007 0.000 0.795 2267 A HN 0.904 nan 8.150 nan 0.000 0.458 2268 Q N -0.905 118.900 119.800 0.008 0.000 2.389 2268 Q HA 0.143 4.483 4.340 -0.001 0.000 0.204 2268 Q C 0.297 176.289 176.000 -0.013 0.000 0.944 2268 Q CA 0.073 55.878 55.803 0.003 0.000 0.908 2268 Q CB -0.060 28.686 28.738 0.014 0.000 1.002 2268 Q HN 0.665 nan 8.270 nan 0.000 0.493 2269 M N 1.678 121.268 119.600 -0.017 0.000 2.242 2269 M HA 0.178 4.657 4.480 -0.001 0.000 0.344 2269 M C -2.111 174.178 176.300 -0.018 0.000 1.140 2269 M CA -1.920 53.365 55.300 -0.026 0.000 1.160 2269 M CB 0.171 32.751 32.600 -0.034 0.000 1.491 2269 M HN -0.179 nan 8.290 nan 0.000 0.459 2270 P HA 0.006 nan 4.420 nan 0.000 0.266 2270 P C -0.456 176.840 177.300 -0.007 0.000 1.193 2270 P CA 0.277 63.370 63.100 -0.012 0.000 0.770 2270 P CB 0.459 32.151 31.700 -0.014 0.000 0.836 2271 K N 1.271 121.671 120.400 0.001 0.000 2.393 2271 K HA 0.053 4.372 4.320 -0.001 0.000 0.193 2271 K C 0.384 176.995 176.600 0.019 0.000 1.026 2271 K CA 0.474 56.767 56.287 0.011 0.000 1.064 2271 K CB 0.124 32.631 32.500 0.012 0.000 0.833 2271 K HN 0.496 nan 8.250 nan 0.000 0.521 2272 K N -0.384 120.024 120.400 0.012 0.000 2.571 2272 K HA 0.336 4.656 4.320 -0.001 0.000 0.252 2272 K C -1.330 175.277 176.600 0.011 0.000 0.956 2272 K CA -0.787 55.511 56.287 0.017 0.000 0.822 2272 K CB 2.021 34.528 32.500 0.012 0.000 1.286 2272 K HN -0.275 nan 8.250 nan 0.000 0.439 2273 V N 2.099 122.024 119.914 0.017 0.000 2.577 2273 V HA 0.462 4.582 4.120 -0.001 0.000 0.303 2273 V C -0.206 175.900 176.094 0.020 0.000 1.042 2273 V CA -0.538 61.770 62.300 0.012 0.000 0.872 2273 V CB 1.848 33.675 31.823 0.006 0.000 0.998 2273 V HN 1.006 nan 8.190 nan 0.000 0.423 2274 T N -0.166 114.396 114.554 0.013 0.000 2.945 2274 T HA 0.566 4.916 4.350 -0.001 0.000 0.286 2274 T C 0.104 174.811 174.700 0.011 0.000 1.025 2274 T CA -0.257 61.851 62.100 0.013 0.000 1.039 2274 T CB 1.370 70.242 68.868 0.006 0.000 1.068 2274 T HN 0.773 nan 8.240 nan 0.000 0.497 2275 D N 0.057 120.464 120.400 0.011 0.000 2.689 2275 D HA -0.149 4.491 4.640 -0.001 0.000 0.237 2275 D C 0.270 176.579 176.300 0.016 0.000 1.148 2275 D CA 0.845 54.852 54.000 0.010 0.000 0.656 2275 D CB -1.257 39.546 40.800 0.006 0.000 1.050 2275 D HN 1.086 nan 8.370 nan 0.000 0.426 2276 A N 1.303 124.138 122.820 0.024 0.000 2.425 2276 A HA 0.409 4.729 4.320 -0.001 0.000 0.249 2276 A C 0.533 178.138 177.584 0.035 0.000 1.084 2276 A CA 0.061 52.116 52.037 0.031 0.000 0.781 2276 A CB 0.635 19.664 19.000 0.050 0.000 1.019 2276 A HN 0.150 nan 8.150 nan 0.000 0.490 2277 K N 2.721 123.139 120.400 0.030 0.000 2.354 2277 K HA 0.360 4.679 4.320 -0.001 0.000 0.257 2277 K C -1.223 175.403 176.600 0.043 0.000 1.062 2277 K CA -0.194 56.112 56.287 0.032 0.000 0.971 2277 K CB 0.830 33.341 32.500 0.020 0.000 1.305 2277 K HN 0.541 nan 8.250 nan 0.000 0.449 2278 I N 2.196 122.808 120.570 0.070 0.000 2.352 2278 I HA 0.183 4.353 4.170 -0.001 0.000 0.290 2278 I C 0.407 176.583 176.117 0.099 0.000 1.036 2278 I CA -0.130 61.239 61.300 0.115 0.000 1.336 2278 I CB 1.315 39.419 38.000 0.175 0.000 1.407 2278 I HN 0.453 nan 8.210 nan 0.000 0.497 2279 A N 7.637 130.514 122.820 0.095 0.000 2.330 2279 A HA 0.856 5.175 4.320 -0.001 0.000 0.327 2279 A C -0.764 176.895 177.584 0.124 0.000 1.155 2279 A CA -0.583 51.502 52.037 0.080 0.000 0.803 2279 A CB 0.693 19.718 19.000 0.042 0.000 1.208 2279 A HN 0.652 nan 8.150 nan 0.000 0.477 2280 L N 3.339 124.626 121.223 0.106 0.000 2.298 2280 L HA 0.488 4.827 4.340 -0.001 0.000 0.284 2280 L C -0.823 176.091 176.870 0.074 0.000 1.013 2280 L CA -0.189 54.720 54.840 0.114 0.000 0.824 2280 L CB 1.170 43.280 42.059 0.085 0.000 1.221 2280 L HN 0.576 nan 8.230 nan 0.000 0.418 2281 L N 3.100 124.369 121.223 0.078 0.000 2.334 2281 L HA 0.450 4.790 4.340 -0.001 0.000 0.276 2281 L C 0.734 177.635 176.870 0.052 0.000 1.014 2281 L CA -0.379 54.493 54.840 0.053 0.000 0.815 2281 L CB 2.117 44.203 42.059 0.045 0.000 1.268 2281 L HN 0.587 nan 8.230 nan 0.000 0.428 2282 N N 0.486 119.208 118.700 0.037 0.000 2.348 2282 N HA 0.017 4.757 4.740 -0.001 0.000 0.183 2282 N C 0.351 175.878 175.510 0.028 0.000 1.094 2282 N CA -0.049 53.020 53.050 0.032 0.000 0.885 2282 N CB 0.570 39.071 38.487 0.023 0.000 1.065 2282 N HN 0.753 nan 8.380 nan 0.000 0.472 2283 C N 0.799 120.115 119.300 0.026 0.000 2.470 2283 C HA 0.854 5.314 4.460 -0.001 0.000 0.350 2283 C C 1.038 176.044 174.990 0.026 0.000 1.341 2283 C CA -1.259 57.773 59.018 0.023 0.000 2.440 2283 C CB -0.005 27.748 27.740 0.021 0.000 2.295 2283 C HN 0.324 nan 8.230 nan 0.000 0.645 2284 A N 0.764 123.599 122.820 0.024 0.000 2.340 2284 A HA 0.631 4.951 4.320 -0.001 0.000 0.268 2284 A C -0.008 177.592 177.584 0.028 0.000 1.100 2284 A CA -0.641 51.412 52.037 0.026 0.000 0.803 2284 A CB -0.083 18.931 19.000 0.023 0.000 1.043 2284 A HN 0.859 nan 8.150 nan 0.000 0.488 2285 I N 2.245 122.833 120.570 0.030 0.000 2.243 2285 I HA 0.205 4.374 4.170 -0.001 0.000 0.289 2285 I C 0.115 176.258 176.117 0.043 0.000 1.140 2285 I CA 0.471 61.793 61.300 0.036 0.000 1.289 2285 I CB -0.555 37.468 38.000 0.038 0.000 1.498 2285 I HN 0.716 nan 8.210 nan 0.000 0.561 2286 E N 3.533 123.756 120.200 0.039 0.000 2.450 2286 E HA 0.493 4.842 4.350 -0.001 0.000 0.272 2286 E C -0.793 175.831 176.600 0.040 0.000 0.967 2286 E CA -1.120 55.304 56.400 0.040 0.000 0.818 2286 E CB 2.332 32.051 29.700 0.031 0.000 1.401 2286 E HN 0.123 nan 8.360 nan 0.000 0.450 2287 I N 2.310 122.905 120.570 0.041 0.000 2.406 2287 I HA 0.079 4.249 4.170 -0.001 0.000 0.293 2287 I C 0.507 176.643 176.117 0.031 0.000 1.101 2287 I CA 0.175 61.499 61.300 0.041 0.000 1.334 2287 I CB -0.522 37.506 38.000 0.046 0.000 1.421 2287 I HN 0.398 nan 8.210 nan 0.000 0.513 2288 K N 4.902 125.320 120.400 0.029 0.000 2.319 2288 K HA 0.083 4.403 4.320 -0.001 0.000 0.265 2288 K C -0.065 176.549 176.600 0.022 0.000 1.000 2288 K CA -0.198 56.103 56.287 0.023 0.000 0.943 2288 K CB 0.845 33.358 32.500 0.021 0.000 0.950 2288 K HN 0.460 nan 8.250 nan 0.000 0.485 2289 E N 1.420 121.630 120.200 0.016 0.000 2.207 2289 E HA 0.171 4.521 4.350 -0.001 0.000 0.270 2289 E C -1.056 175.552 176.600 0.013 0.000 0.927 2289 E CA -0.591 55.817 56.400 0.013 0.000 0.799 2289 E CB 1.359 31.064 29.700 0.007 0.000 1.172 2289 E HN 0.638 nan 8.360 nan 0.000 0.404 2290 T N 1.099 115.661 114.554 0.013 0.000 2.813 2290 T HA 0.178 4.528 4.350 -0.001 0.000 0.297 2290 T C 0.746 175.451 174.700 0.008 0.000 1.036 2290 T CA -0.378 61.729 62.100 0.012 0.000 1.044 2290 T CB 0.760 69.636 68.868 0.013 0.000 0.993 2290 T HN 0.417 nan 8.240 nan 0.000 0.535 2291 E N 0.332 120.536 120.200 0.008 0.000 2.047 2291 E HA 0.045 4.394 4.350 -0.001 0.000 0.191 2291 E C 1.238 177.841 176.600 0.005 0.000 0.987 2291 E CA 1.031 57.434 56.400 0.006 0.000 0.799 2291 E CB -0.585 29.119 29.700 0.006 0.000 0.752 2291 E HN 0.780 nan 8.360 nan 0.000 0.449 2292 T N 1.312 115.870 114.554 0.006 0.000 2.930 2292 T HA -0.005 4.344 4.350 -0.001 0.000 0.306 2292 T C -0.424 174.278 174.700 0.004 0.000 1.045 2292 T CA -0.692 61.411 62.100 0.005 0.000 1.134 2292 T CB 0.209 69.081 68.868 0.006 0.000 0.961 2292 T HN -0.121 nan 8.240 nan 0.000 0.545 2293 D N 2.825 123.226 120.400 0.001 0.000 2.425 2293 D HA 0.493 5.133 4.640 -0.001 0.000 0.247 2293 D C -0.244 176.055 176.300 -0.002 0.000 1.147 2293 D CA 0.458 54.457 54.000 -0.001 0.000 0.879 2293 D CB 0.869 41.668 40.800 -0.003 0.000 1.179 2293 D HN 0.758 nan 8.370 nan 0.000 0.456 2294 A N 2.639 125.456 122.820 -0.006 0.000 2.547 2294 A HA 0.584 4.904 4.320 -0.001 0.000 0.297 2294 A C -0.849 176.722 177.584 -0.022 0.000 1.056 2294 A CA -0.774 51.258 52.037 -0.008 0.000 0.688 2294 A CB 1.604 20.605 19.000 0.002 0.000 1.282 2294 A HN 0.463 nan 8.150 nan 0.000 0.400 2295 E N 0.925 121.105 120.200 -0.033 0.000 2.314 2295 E HA 0.503 4.852 4.350 -0.001 0.000 0.272 2295 E C -1.428 175.119 176.600 -0.089 0.000 0.884 2295 E CA -0.850 55.513 56.400 -0.061 0.000 0.753 2295 E CB 2.311 31.980 29.700 -0.051 0.000 1.213 2295 E HN 0.498 nan 8.360 nan 0.000 0.432 2296 I N 2.197 122.666 120.570 -0.169 0.000 2.428 2296 I HA 0.153 4.323 4.170 -0.001 0.000 0.289 2296 I C 0.041 176.037 176.117 -0.202 0.000 1.019 2296 I CA -0.184 60.945 61.300 -0.285 0.000 1.351 2296 I CB 0.419 38.010 38.000 -0.683 0.000 1.412 2296 I HN 0.188 nan 8.210 nan 0.000 0.513 2297 R N 6.727 127.149 120.500 -0.130 0.000 2.310 2297 R HA 0.431 4.771 4.340 -0.001 0.000 0.316 2297 R C -0.994 175.294 176.300 -0.021 0.000 1.004 2297 R CA -0.765 55.298 56.100 -0.061 0.000 0.900 2297 R CB 0.858 31.146 30.300 -0.020 0.000 1.152 2297 R HN 0.409 nan 8.270 nan 0.000 0.513 2298 I N 3.046 123.595 120.570 -0.036 0.000 2.416 2298 I HA 0.058 4.228 4.170 -0.001 0.000 0.288 2298 I C 1.642 177.780 176.117 0.035 0.000 1.051 2298 I CA 0.322 61.637 61.300 0.025 0.000 1.375 2298 I CB 1.102 39.106 38.000 0.008 0.000 1.407 2298 I HN 0.519 nan 8.210 nan 0.000 0.516 2299 T N 0.021 114.611 114.554 0.059 0.000 3.040 2299 T HA 0.221 4.570 4.350 -0.001 0.000 0.266 2299 T C 0.261 174.985 174.700 0.040 0.000 1.005 2299 T CA -0.227 61.898 62.100 0.042 0.000 0.906 2299 T CB 0.565 69.458 68.868 0.042 0.000 1.082 2299 T HN 0.576 nan 8.240 nan 0.000 0.531 2300 D N 0.844 121.275 120.400 0.051 0.000 2.886 2300 D HA 0.257 4.897 4.640 -0.001 0.000 0.216 2300 D C -2.301 174.029 176.300 0.050 0.000 1.256 2300 D CA -1.689 52.337 54.000 0.043 0.000 0.844 2300 D CB 2.911 43.735 40.800 0.039 0.000 1.669 2300 D HN -0.241 nan 8.370 nan 0.000 0.513 2301 P HA -0.097 nan 4.420 nan 0.000 0.219 2301 P C 1.042 178.367 177.300 0.041 0.000 1.146 2301 P CA 0.837 63.958 63.100 0.036 0.000 0.808 2301 P CB 0.300 32.014 31.700 0.024 0.000 0.779 2302 A N 0.523 123.364 122.820 0.035 0.000 1.930 2302 A HA -0.156 4.163 4.320 -0.001 0.000 0.217 2302 A C 2.394 180.002 177.584 0.040 0.000 1.175 2302 A CA 1.710 53.765 52.037 0.030 0.000 0.627 2302 A CB -1.070 17.940 19.000 0.017 0.000 0.815 2302 A HN 0.159 nan 8.150 nan 0.000 0.443 2303 K N -0.684 119.754 120.400 0.062 0.000 2.103 2303 K HA -0.073 4.247 4.320 -0.001 0.000 0.204 2303 K C 1.842 178.580 176.600 0.229 0.000 1.052 2303 K CA 1.121 57.472 56.287 0.107 0.000 0.945 2303 K CB -0.258 32.323 32.500 0.135 0.000 0.722 2303 K HN 0.305 nan 8.250 nan 0.000 0.443 2304 L N 1.092 122.422 121.223 0.178 0.000 2.043 2304 L HA -0.206 4.134 4.340 -0.001 0.000 0.212 2304 L C 2.028 179.002 176.870 0.173 0.000 1.075 2304 L CA 1.761 56.706 54.840 0.175 0.000 0.752 2304 L CB -0.304 41.806 42.059 0.085 0.000 0.891 2304 L HN 0.282 nan 8.230 nan 0.000 0.432 2305 M N -1.158 118.508 119.600 0.109 0.000 2.254 2305 M HA -0.119 4.361 4.480 -0.001 0.000 0.265 2305 M C 2.129 178.463 176.300 0.056 0.000 1.066 2305 M CA 1.201 56.545 55.300 0.074 0.000 1.123 2305 M CB -1.036 31.590 32.600 0.043 0.000 1.388 2305 M HN 0.352 nan 8.290 nan 0.000 0.425 2306 E N -0.148 120.068 120.200 0.026 0.000 2.097 2306 E HA -0.199 4.151 4.350 -0.001 0.000 0.196 2306 E C 1.865 178.379 176.600 -0.143 0.000 1.000 2306 E CA 1.397 57.743 56.400 -0.090 0.000 0.804 2306 E CB -0.203 29.388 29.700 -0.182 0.000 0.740 2306 E HN 0.400 nan 8.360 nan 0.000 0.454 2307 F N 0.420 120.377 119.950 0.010 0.000 2.163 2307 F HA -0.067 4.460 4.527 -0.000 0.000 0.297 2307 F C 2.217 178.027 175.800 0.017 0.000 1.094 2307 F CA 0.644 58.651 58.000 0.012 0.000 1.290 2307 F CB -0.177 38.829 39.000 0.010 0.000 1.017 2307 F HN -0.047 nan 8.300 nan 0.000 0.483 2308 I N 0.191 120.883 120.570 0.205 0.000 2.194 2308 I HA -0.321 3.849 4.170 -0.001 0.000 0.246 2308 I C 2.054 178.227 176.117 0.094 0.000 1.093 2308 I CA 1.672 63.046 61.300 0.124 0.000 1.355 2308 I CB -0.458 37.596 38.000 0.089 0.000 1.046 2308 I HN 0.220 nan 8.210 nan 0.000 0.413 2309 E N -0.160 120.081 120.200 0.068 0.000 2.274 2309 E HA -0.242 4.108 4.350 -0.001 0.000 0.194 2309 E C 2.024 178.647 176.600 0.038 0.000 0.996 2309 E CA 0.544 56.973 56.400 0.049 0.000 0.840 2309 E CB 0.020 29.734 29.700 0.022 0.000 0.772 2309 E HN 0.370 nan 8.360 nan 0.000 0.491 2310 Q N 1.151 120.968 119.800 0.030 0.000 2.137 2310 Q HA -0.147 4.193 4.340 -0.001 0.000 0.198 2310 Q C 1.432 177.464 176.000 0.054 0.000 0.960 2310 Q CA 1.329 57.142 55.803 0.017 0.000 0.847 2310 Q CB 0.203 28.933 28.738 -0.015 0.000 0.915 2310 Q HN 0.084 nan 8.270 nan 0.000 0.448 2311 E N 0.172 120.426 120.200 0.091 0.000 2.150 2311 E HA -0.134 4.215 4.350 -0.001 0.000 0.193 2311 E C 1.669 178.338 176.600 0.114 0.000 0.985 2311 E CA 1.141 57.600 56.400 0.097 0.000 0.814 2311 E CB 0.067 29.828 29.700 0.103 0.000 0.752 2311 E HN 0.472 nan 8.360 nan 0.000 0.466 2312 E N 0.427 120.704 120.200 0.128 0.000 2.051 2312 E HA -0.208 4.142 4.350 -0.001 0.000 0.192 2312 E C 1.963 178.622 176.600 0.098 0.000 0.991 2312 E CA 1.046 57.572 56.400 0.210 0.000 0.799 2312 E CB -0.058 29.761 29.700 0.198 0.000 0.748 2312 E HN 0.078 nan 8.360 nan 0.000 0.449 2313 K N 0.835 121.246 120.400 0.017 0.000 2.057 2313 K HA -0.171 4.149 4.320 -0.001 0.000 0.207 2313 K C 2.234 178.790 176.600 -0.075 0.000 1.049 2313 K CA 1.197 57.446 56.287 -0.065 0.000 0.931 2313 K CB -0.063 32.414 32.500 -0.039 0.000 0.714 2313 K HN 0.078 nan 8.250 nan 0.000 0.440 2314 M N 0.767 120.359 119.600 -0.012 0.000 2.067 2314 M HA -0.187 4.292 4.480 -0.001 0.000 0.260 2314 M C 1.878 178.174 176.300 -0.007 0.000 1.069 2314 M CA 1.622 56.921 55.300 -0.001 0.000 1.117 2314 M CB -0.071 32.550 32.600 0.034 0.000 1.334 2314 M HN 0.182 nan 8.290 nan 0.000 0.407 2315 L N -0.010 121.237 121.223 0.041 0.000 2.083 2315 L HA -0.218 4.122 4.340 -0.001 0.000 0.209 2315 L C 2.690 179.547 176.870 -0.022 0.000 1.083 2315 L CA 1.055 55.951 54.840 0.093 0.000 0.752 2315 L CB -0.920 41.289 42.059 0.251 0.000 0.899 2315 L HN 0.380 nan 8.230 nan 0.000 0.433 2316 K N 0.402 120.589 120.400 -0.354 0.000 2.097 2316 K HA -0.208 4.111 4.320 -0.001 0.000 0.206 2316 K C 1.401 177.827 176.600 -0.290 0.000 1.049 2316 K CA 1.734 57.599 56.287 -0.704 0.000 0.933 2316 K CB -0.092 31.849 32.500 -0.933 0.000 0.717 2316 K HN 0.277 nan 8.250 nan 0.000 0.442 2317 D N 0.291 120.587 120.400 -0.173 0.000 2.183 2317 D HA -0.094 4.546 4.640 -0.001 0.000 0.203 2317 D C 1.959 178.223 176.300 -0.060 0.000 0.969 2317 D CA 0.688 54.629 54.000 -0.098 0.000 0.842 2317 D CB 0.051 40.811 40.800 -0.067 0.000 0.957 2317 D HN 0.175 nan 8.370 nan 0.000 0.484 2318 M N 0.211 119.786 119.600 -0.042 0.000 2.132 2318 M HA -0.079 4.401 4.480 -0.001 0.000 0.263 2318 M C 2.251 178.545 176.300 -0.010 0.000 1.065 2318 M CA 0.708 56.001 55.300 -0.011 0.000 1.122 2318 M CB -0.734 31.874 32.600 0.013 0.000 1.365 2318 M HN -0.084 nan 8.290 nan 0.000 0.411 2319 V N 0.298 120.202 119.914 -0.017 0.000 2.453 2319 V HA -0.137 3.982 4.120 -0.001 0.000 0.247 2319 V C 2.668 178.744 176.094 -0.031 0.000 1.048 2319 V CA 1.546 63.841 62.300 -0.009 0.000 1.049 2319 V CB -1.233 30.602 31.823 0.020 0.000 0.672 2319 V HN 0.459 nan 8.190 nan 0.000 0.457 2320 A N -0.016 122.768 122.820 -0.058 0.000 1.972 2320 A HA -0.232 4.087 4.320 -0.001 0.000 0.219 2320 A C 2.168 179.732 177.584 -0.034 0.000 1.169 2320 A CA 1.974 53.979 52.037 -0.054 0.000 0.635 2320 A CB -0.394 18.561 19.000 -0.075 0.000 0.810 2320 A HN 0.550 nan 8.150 nan 0.000 0.446 2321 E N 0.293 120.476 120.200 -0.028 0.000 2.072 2321 E HA -0.088 4.262 4.350 -0.001 0.000 0.190 2321 E C 1.683 178.277 176.600 -0.010 0.000 0.982 2321 E CA 1.195 57.585 56.400 -0.016 0.000 0.803 2321 E CB -0.358 29.335 29.700 -0.012 0.000 0.755 2321 E HN 0.635 nan 8.360 nan 0.000 0.453 2322 I N 0.296 120.861 120.570 -0.008 0.000 2.179 2322 I HA -0.253 3.917 4.170 -0.001 0.000 0.242 2322 I C 2.299 178.412 176.117 -0.007 0.000 1.088 2322 I CA 1.267 62.565 61.300 -0.004 0.000 1.357 2322 I CB -0.250 37.747 38.000 -0.004 0.000 1.051 2322 I HN 0.068 nan 8.210 nan 0.000 0.409 2323 K N 1.579 121.971 120.400 -0.013 0.000 2.097 2323 K HA -0.108 4.212 4.320 -0.001 0.000 0.206 2323 K C 2.035 178.628 176.600 -0.012 0.000 1.049 2323 K CA 1.629 57.907 56.287 -0.014 0.000 0.933 2323 K CB -0.356 32.132 32.500 -0.020 0.000 0.717 2323 K HN 0.276 nan 8.250 nan 0.000 0.442 2324 A N -0.169 122.644 122.820 -0.013 0.000 1.933 2324 A HA -0.119 4.201 4.320 -0.001 0.000 0.218 2324 A C 2.183 179.764 177.584 -0.005 0.000 1.175 2324 A CA 2.061 54.092 52.037 -0.010 0.000 0.628 2324 A CB -0.717 18.276 19.000 -0.012 0.000 0.814 2324 A HN 0.353 nan 8.150 nan 0.000 0.444 2325 S N -1.793 113.906 115.700 -0.003 0.000 2.423 2325 S HA 0.233 4.703 4.470 -0.001 0.000 0.231 2325 S C 1.533 176.135 174.600 0.004 0.000 1.014 2325 S CA 1.256 59.458 58.200 0.002 0.000 0.965 2325 S CB -0.121 63.082 63.200 0.006 0.000 0.785 2325 S HN 1.682 nan 8.310 nan 0.000 0.495 2326 G N 0.580 109.381 108.800 0.001 0.000 2.168 2326 G HA2 -0.072 3.888 3.960 -0.001 0.000 0.197 2326 G HA3 -0.072 3.888 3.960 -0.001 0.000 0.197 2326 G C 0.086 174.987 174.900 0.003 0.000 0.997 2326 G CA -0.179 44.922 45.100 0.002 0.000 0.658 2326 G HN 0.804 nan 8.290 nan 0.000 0.513 2327 A N 0.261 123.082 122.820 0.003 0.000 2.407 2327 A HA 0.638 4.958 4.320 -0.001 0.000 0.248 2327 A C 0.938 178.517 177.584 -0.007 0.000 1.082 2327 A CA 0.942 52.981 52.037 0.003 0.000 0.785 2327 A CB 0.251 19.254 19.000 0.005 0.000 1.020 2327 A HN 1.296 nan 8.150 nan 0.000 0.489 2328 N N -0.633 118.060 118.700 -0.011 0.000 2.036 2328 N HA 0.202 4.941 4.740 -0.001 0.000 0.228 2328 N C -0.958 174.525 175.510 -0.045 0.000 1.368 2328 N CA 0.053 53.089 53.050 -0.024 0.000 0.846 2328 N CB 0.483 38.962 38.487 -0.015 0.000 1.145 2328 N HN 0.268 nan 8.380 nan 0.000 0.502 2329 V N 1.518 121.403 119.914 -0.049 0.000 2.656 2329 V HA 0.561 4.681 4.120 -0.001 0.000 0.307 2329 V C -1.146 174.859 176.094 -0.148 0.000 1.051 2329 V CA -0.770 61.457 62.300 -0.122 0.000 0.893 2329 V CB 2.402 34.197 31.823 -0.047 0.000 0.999 2329 V HN 0.230 nan 8.190 nan 0.000 0.426 2330 L N 5.460 126.496 121.223 -0.312 0.000 2.441 2330 L HA 0.614 4.954 4.340 -0.001 0.000 0.270 2330 L C -1.927 174.707 176.870 -0.394 0.000 0.973 2330 L CA -0.104 54.604 54.840 -0.220 0.000 0.842 2330 L CB 1.601 43.591 42.059 -0.115 0.000 1.239 2330 L HN 0.598 nan 8.230 nan 0.000 0.406 2331 F N 4.391 124.345 119.950 0.006 0.000 2.402 2331 F HA 0.360 4.887 4.527 -0.001 0.000 0.355 2331 F C 0.397 176.200 175.800 0.005 0.000 1.123 2331 F CA -0.479 57.524 58.000 0.004 0.000 1.021 2331 F CB 1.490 40.490 39.000 -0.001 0.000 1.160 2331 F HN 0.437 nan 8.300 nan 0.000 0.451 2332 C N 5.191 124.578 119.300 0.145 0.000 2.281 2332 C HA 0.220 4.680 4.460 -0.001 0.000 0.325 2332 C C 1.626 176.669 174.990 0.088 0.000 1.282 2332 C CA -0.473 58.599 59.018 0.091 0.000 1.640 2332 C CB 0.646 28.416 27.740 0.050 0.000 2.288 2332 C HN 0.960 nan 8.230 nan 0.000 0.507 2333 Q N 3.532 123.374 119.800 0.070 0.000 2.170 2333 Q HA -0.063 4.277 4.340 -0.001 0.000 0.203 2333 Q C 0.751 176.774 176.000 0.038 0.000 0.976 2333 Q CA 1.632 57.464 55.803 0.049 0.000 0.858 2333 Q CB 0.188 28.946 28.738 0.034 0.000 0.907 2333 Q HN 0.761 nan 8.270 nan 0.000 0.433 2334 K N -1.159 119.262 120.400 0.036 0.000 2.632 2334 K HA 0.446 4.765 4.320 -0.001 0.000 0.267 2334 K C 0.319 176.937 176.600 0.030 0.000 1.028 2334 K CA -0.202 56.102 56.287 0.028 0.000 1.045 2334 K CB 0.190 32.704 32.500 0.024 0.000 1.400 2334 K HN 0.112 nan 8.250 nan 0.000 0.522 2335 G N 0.261 109.076 108.800 0.024 0.000 2.599 2335 G HA2 0.435 4.395 3.960 -0.001 0.000 0.264 2335 G HA3 0.435 4.395 3.960 -0.001 0.000 0.264 2335 G C -0.528 174.386 174.900 0.023 0.000 1.200 2335 G CA -0.527 44.586 45.100 0.022 0.000 0.896 2335 G HN 0.367 nan 8.290 nan 0.000 0.536 2336 I N 0.245 120.828 120.570 0.021 0.000 2.499 2336 I HA 0.169 4.339 4.170 -0.001 0.000 0.288 2336 I C -0.494 175.637 176.117 0.022 0.000 1.048 2336 I CA -0.788 60.526 61.300 0.023 0.000 1.062 2336 I CB 2.157 40.167 38.000 0.017 0.000 1.238 2336 I HN 0.429 nan 8.210 nan 0.000 0.426 2337 D N 5.315 125.734 120.400 0.031 0.000 2.443 2337 D HA -0.074 4.566 4.640 -0.001 0.000 0.239 2337 D C 0.755 177.066 176.300 0.018 0.000 1.136 2337 D CA 0.062 54.079 54.000 0.028 0.000 0.879 2337 D CB 1.331 42.157 40.800 0.043 0.000 1.195 2337 D HN 0.638 nan 8.370 nan 0.000 0.443 2338 D N 3.565 123.967 120.400 0.002 0.000 2.158 2338 D HA -0.257 4.383 4.640 -0.001 0.000 0.197 2338 D C 1.955 178.234 176.300 -0.036 0.000 0.995 2338 D CA 0.776 54.767 54.000 -0.015 0.000 0.846 2338 D CB -0.372 40.413 40.800 -0.024 0.000 0.941 2338 D HN 0.362 nan 8.370 nan 0.000 0.456 2339 L N 0.561 121.755 121.223 -0.048 0.000 2.072 2339 L HA 0.147 4.487 4.340 -0.001 0.000 0.205 2339 L C 2.377 179.161 176.870 -0.144 0.000 1.079 2339 L CA 1.861 56.620 54.840 -0.135 0.000 0.752 2339 L CB -0.990 41.018 42.059 -0.084 0.000 0.906 2339 L HN 0.103 nan 8.230 nan 0.000 0.436 2340 A N -1.132 121.716 122.820 0.048 0.000 1.972 2340 A HA -0.243 4.076 4.320 -0.001 0.000 0.219 2340 A C 2.165 179.805 177.584 0.093 0.000 1.169 2340 A CA 1.727 53.864 52.037 0.166 0.000 0.635 2340 A CB -0.519 18.562 19.000 0.136 0.000 0.810 2340 A HN 0.667 nan 8.150 nan 0.000 0.446 2341 Q N -1.653 118.168 119.800 0.034 0.000 2.119 2341 Q HA -0.216 4.124 4.340 -0.001 0.000 0.201 2341 Q C 2.045 178.055 176.000 0.016 0.000 0.972 2341 Q CA 1.680 57.494 55.803 0.020 0.000 0.847 2341 Q CB -0.317 28.427 28.738 0.010 0.000 0.903 2341 Q HN 0.933 nan 8.270 nan 0.000 0.433 2342 H N -0.390 118.611 119.070 -0.115 0.000 2.353 2342 H HA -0.172 4.383 4.556 -0.001 0.000 0.300 2342 H C 1.356 176.631 175.328 -0.087 0.000 1.090 2342 H CA 1.715 57.673 56.048 -0.151 0.000 1.327 2342 H CB -0.079 29.518 29.762 -0.275 0.000 1.383 2342 H HN 0.224 nan 8.280 nan 0.000 0.508 2343 Y N 0.179 120.455 120.300 -0.039 0.000 2.224 2343 Y HA -0.133 4.416 4.550 -0.001 0.000 0.289 2343 Y C 2.566 178.404 175.900 -0.104 0.000 1.146 2343 Y CA 1.040 59.087 58.100 -0.089 0.000 1.182 2343 Y CB -0.645 37.813 38.460 -0.004 0.000 0.983 2343 Y HN 0.218 nan 8.280 nan 0.000 0.524 2344 L N -1.035 120.236 121.223 0.079 0.000 2.046 2344 L HA -0.226 4.114 4.340 -0.001 0.000 0.208 2344 L C 2.641 179.490 176.870 -0.035 0.000 1.077 2344 L CA 1.238 56.087 54.840 0.014 0.000 0.747 2344 L CB -0.831 41.229 42.059 0.003 0.000 0.896 2344 L HN 0.183 nan 8.230 nan 0.000 0.432 2345 A N -0.122 122.656 122.820 -0.069 0.000 1.930 2345 A HA -0.245 4.074 4.320 -0.001 0.000 0.217 2345 A C 2.368 179.881 177.584 -0.119 0.000 1.175 2345 A CA 1.822 53.803 52.037 -0.092 0.000 0.627 2345 A CB -0.425 18.518 19.000 -0.096 0.000 0.815 2345 A HN 0.328 nan 8.150 nan 0.000 0.443 2346 K N -0.425 119.867 120.400 -0.180 0.000 2.147 2346 K HA -0.142 4.177 4.320 -0.001 0.000 0.205 2346 K C 1.032 177.597 176.600 -0.059 0.000 1.049 2346 K CA 1.485 57.687 56.287 -0.143 0.000 0.936 2346 K CB 0.004 32.420 32.500 -0.140 0.000 0.722 2346 K HN 0.335 nan 8.250 nan 0.000 0.446 2347 E N -0.719 119.457 120.200 -0.039 0.000 2.479 2347 E HA 0.058 4.408 4.350 -0.001 0.000 0.193 2347 E C 0.687 177.271 176.600 -0.028 0.000 1.049 2347 E CA 0.665 57.050 56.400 -0.026 0.000 0.870 2347 E CB 0.828 30.517 29.700 -0.018 0.000 0.944 2347 E HN 0.538 nan 8.360 nan 0.000 0.492 2348 G N 1.925 110.703 108.800 -0.036 0.000 2.147 2348 G HA2 -0.286 3.673 3.960 -0.001 0.000 0.244 2348 G HA3 -0.286 3.673 3.960 -0.001 0.000 0.244 2348 G C 0.229 175.108 174.900 -0.034 0.000 1.005 2348 G CA 0.100 45.180 45.100 -0.032 0.000 0.713 2348 G HN 0.271 nan 8.290 nan 0.000 0.515 2349 I N 1.137 121.683 120.570 -0.040 0.000 2.325 2349 I HA 0.403 4.573 4.170 -0.001 0.000 0.291 2349 I C 1.073 177.151 176.117 -0.066 0.000 1.019 2349 I CA -1.054 60.217 61.300 -0.049 0.000 1.302 2349 I CB 1.491 39.465 38.000 -0.043 0.000 1.401 2349 I HN 0.153 nan 8.210 nan 0.000 0.485 2350 V N 3.906 123.769 119.914 -0.085 0.000 2.546 2350 V HA 0.905 5.025 4.120 -0.001 0.000 0.284 2350 V C 0.094 176.071 176.094 -0.195 0.000 1.050 2350 V CA -0.254 61.979 62.300 -0.112 0.000 0.981 2350 V CB 1.101 32.865 31.823 -0.098 0.000 0.990 2350 V HN 0.834 nan 8.190 nan 0.000 0.474 2351 A N 3.533 126.238 122.820 -0.191 0.000 2.549 2351 A HA 1.015 5.335 4.320 -0.001 0.000 0.297 2351 A C -0.400 177.067 177.584 -0.196 0.000 1.061 2351 A CA -0.288 51.606 52.037 -0.238 0.000 0.690 2351 A CB 1.819 20.739 19.000 -0.133 0.000 1.287 2351 A HN 2.381 nan 8.150 nan 0.000 0.402 2352 A N 1.390 124.078 122.820 -0.220 0.000 2.449 2352 A HA 0.847 5.167 4.320 -0.001 0.000 0.302 2352 A C -0.302 177.296 177.584 0.022 0.000 1.048 2352 A CA -0.607 51.398 52.037 -0.053 0.000 0.708 2352 A CB 1.156 20.183 19.000 0.045 0.000 1.274 2352 A HN 1.403 nan 8.150 nan 0.000 0.410 2353 R N 1.390 121.912 120.500 0.037 0.000 2.832 2353 R HA 0.795 5.134 4.340 -0.001 0.000 0.271 2353 R C -0.470 175.861 176.300 0.052 0.000 0.996 2353 R CA -0.768 55.359 56.100 0.044 0.000 0.977 2353 R CB 0.801 31.116 30.300 0.025 0.000 1.168 2353 R HN 0.577 nan 8.270 nan 0.000 0.482 2354 R N -0.134 120.394 120.500 0.048 0.000 3.532 2354 R HA -0.097 4.243 4.340 -0.001 0.000 0.284 2354 R C -0.773 175.554 176.300 0.043 0.000 1.140 2354 R CA 0.602 56.725 56.100 0.038 0.000 0.768 2354 R CB -2.349 27.967 30.300 0.027 0.000 1.252 2354 R HN 0.548 nan 8.270 nan 0.000 0.454 2355 V N 1.497 121.449 119.914 0.064 0.000 2.572 2355 V HA 0.063 4.182 4.120 -0.001 0.000 0.291 2355 V C 1.426 177.531 176.094 0.018 0.000 1.039 2355 V CA -0.112 62.222 62.300 0.057 0.000 1.055 2355 V CB 1.333 33.216 31.823 0.101 0.000 0.969 2355 V HN 0.137 nan 8.190 nan 0.000 0.482 2356 K N 4.155 124.553 120.400 -0.004 0.000 2.448 2356 K HA 0.029 4.348 4.320 -0.001 0.000 0.278 2356 K C 1.388 177.975 176.600 -0.022 0.000 1.009 2356 K CA -0.241 56.037 56.287 -0.014 0.000 0.995 2356 K CB 0.356 32.841 32.500 -0.025 0.000 0.917 2356 K HN 0.609 nan 8.250 nan 0.000 0.481 2357 K N 2.141 122.532 120.400 -0.014 0.000 2.074 2357 K HA -0.197 4.122 4.320 -0.001 0.000 0.209 2357 K C 1.767 178.350 176.600 -0.028 0.000 1.048 2357 K CA 1.959 58.236 56.287 -0.016 0.000 0.926 2357 K CB -0.231 32.264 32.500 -0.009 0.000 0.713 2357 K HN 0.683 nan 8.250 nan 0.000 0.444 2358 S N 1.039 116.721 115.700 -0.031 0.000 2.359 2358 S HA -0.164 4.306 4.470 -0.001 0.000 0.224 2358 S C 1.379 175.942 174.600 -0.061 0.000 1.035 2358 S CA 1.799 59.975 58.200 -0.040 0.000 1.018 2358 S CB -0.218 62.961 63.200 -0.036 0.000 0.876 2358 S HN 0.303 nan 8.310 nan 0.000 0.448 2359 D N 0.835 121.189 120.400 -0.076 0.000 2.144 2359 D HA -0.044 4.595 4.640 -0.001 0.000 0.199 2359 D C 2.001 178.208 176.300 -0.155 0.000 0.984 2359 D CA 0.923 54.849 54.000 -0.123 0.000 0.834 2359 D CB -0.252 40.470 40.800 -0.130 0.000 0.955 2359 D HN 0.384 nan 8.370 nan 0.000 0.465 2360 M N 0.451 119.987 119.600 -0.107 0.000 2.159 2360 M HA -0.082 4.398 4.480 -0.001 0.000 0.263 2360 M C 1.902 178.156 176.300 -0.077 0.000 1.063 2360 M CA 1.193 56.438 55.300 -0.091 0.000 1.110 2360 M CB -0.776 31.804 32.600 -0.033 0.000 1.374 2360 M HN 0.111 nan 8.290 nan 0.000 0.411 2361 E N 0.089 120.252 120.200 -0.061 0.000 2.072 2361 E HA -0.135 4.214 4.350 -0.001 0.000 0.190 2361 E C 2.062 178.628 176.600 -0.056 0.000 0.982 2361 E CA 0.838 57.211 56.400 -0.046 0.000 0.803 2361 E CB -0.007 29.672 29.700 -0.034 0.000 0.755 2361 E HN 0.500 nan 8.360 nan 0.000 0.453 2362 K N 0.648 121.004 120.400 -0.075 0.000 2.097 2362 K HA -0.096 4.223 4.320 -0.001 0.000 0.206 2362 K C 2.200 178.746 176.600 -0.091 0.000 1.049 2362 K CA 0.809 57.050 56.287 -0.077 0.000 0.933 2362 K CB -0.088 32.358 32.500 -0.090 0.000 0.717 2362 K HN 0.111 nan 8.250 nan 0.000 0.442 2363 L N 0.506 121.648 121.223 -0.135 0.000 2.083 2363 L HA -0.182 4.158 4.340 -0.001 0.000 0.209 2363 L C 2.585 179.412 176.870 -0.072 0.000 1.083 2363 L CA 1.082 55.833 54.840 -0.149 0.000 0.752 2363 L CB -0.547 41.348 42.059 -0.273 0.000 0.899 2363 L HN 0.198 nan 8.230 nan 0.000 0.433 2364 A N -0.269 122.520 122.820 -0.052 0.000 1.898 2364 A HA -0.166 4.153 4.320 -0.001 0.000 0.216 2364 A C 2.340 179.917 177.584 -0.012 0.000 1.181 2364 A CA 1.319 53.344 52.037 -0.020 0.000 0.620 2364 A CB -0.241 18.750 19.000 -0.015 0.000 0.819 2364 A HN 0.186 nan 8.150 nan 0.000 0.442 2365 K N -0.006 120.382 120.400 -0.020 0.000 2.002 2365 K HA -0.064 4.256 4.320 -0.001 0.000 0.209 2365 K C 2.342 178.941 176.600 -0.002 0.000 1.048 2365 K CA 1.443 57.724 56.287 -0.011 0.000 0.930 2365 K CB -0.876 31.614 32.500 -0.016 0.000 0.714 2365 K HN 0.435 nan 8.250 nan 0.000 0.438 2366 A N 1.269 124.083 122.820 -0.011 0.000 1.841 2366 A HA -0.146 4.173 4.320 -0.001 0.000 0.214 2366 A C 2.380 179.972 177.584 0.014 0.000 1.195 2366 A CA 2.728 54.764 52.037 -0.001 0.000 0.611 2366 A CB -1.074 17.916 19.000 -0.016 0.000 0.835 2366 A HN 0.517 nan 8.150 nan 0.000 0.443 2367 T N -4.480 110.079 114.554 0.010 0.000 3.043 2367 T HA 0.369 4.718 4.350 -0.001 0.000 0.263 2367 T C 1.490 176.209 174.700 0.032 0.000 1.094 2367 T CA 1.251 63.366 62.100 0.025 0.000 1.127 2367 T CB -0.067 68.821 68.868 0.032 0.000 0.905 2367 T HN 1.833 nan 8.240 nan 0.000 0.490 2368 G N 1.466 110.281 108.800 0.025 0.000 2.143 2368 G HA2 -0.022 3.938 3.960 -0.001 0.000 0.249 2368 G HA3 -0.022 3.938 3.960 -0.001 0.000 0.249 2368 G C 0.280 175.196 174.900 0.025 0.000 0.981 2368 G CA -0.004 45.112 45.100 0.026 0.000 0.665 2368 G HN 1.185 nan 8.290 nan 0.000 0.528 2369 A N -0.284 122.553 122.820 0.027 0.000 2.445 2369 A HA 0.560 4.880 4.320 -0.001 0.000 0.242 2369 A C 0.428 178.027 177.584 0.026 0.000 1.075 2369 A CA 0.673 52.731 52.037 0.035 0.000 0.777 2369 A CB 0.391 19.422 19.000 0.052 0.000 1.013 2369 A HN 0.884 nan 8.150 nan 0.000 0.493 2370 N N 1.487 120.205 118.700 0.030 0.000 2.417 2370 N HA 0.375 5.114 4.740 -0.001 0.000 0.274 2370 N C -1.008 174.518 175.510 0.027 0.000 0.987 2370 N CA -0.420 52.643 53.050 0.023 0.000 0.912 2370 N CB 1.375 39.873 38.487 0.020 0.000 1.177 2370 N HN 0.283 nan 8.380 nan 0.000 0.490 2371 V N 4.817 124.744 119.914 0.022 0.000 2.485 2371 V HA 0.177 4.297 4.120 -0.001 0.000 0.287 2371 V C 0.335 176.442 176.094 0.022 0.000 1.022 2371 V CA -0.071 62.244 62.300 0.025 0.000 1.067 2371 V CB -0.116 31.716 31.823 0.016 0.000 0.967 2371 V HN 0.516 nan 8.190 nan 0.000 0.479 2372 I N 4.127 124.713 120.570 0.027 0.000 2.404 2372 I HA 0.423 4.592 4.170 -0.001 0.000 0.293 2372 I C 1.027 177.157 176.117 0.022 0.000 0.992 2372 I CA -0.369 60.944 61.300 0.022 0.000 1.149 2372 I CB 1.406 39.419 38.000 0.022 0.000 1.315 2372 I HN 0.626 nan 8.210 nan 0.000 0.446 2373 A N 5.383 128.214 122.820 0.017 0.000 1.872 2373 A HA 0.312 4.632 4.320 -0.001 0.000 0.214 2373 A C 1.111 178.706 177.584 0.017 0.000 1.187 2373 A CA 1.119 53.166 52.037 0.016 0.000 0.614 2373 A CB -0.038 18.969 19.000 0.013 0.000 0.826 2373 A HN 0.734 nan 8.150 nan 0.000 0.442 2374 A N -0.906 121.923 122.820 0.015 0.000 2.317 2374 A HA 0.654 4.973 4.320 -0.001 0.000 0.327 2374 A C 0.768 178.361 177.584 0.015 0.000 1.178 2374 A CA -0.600 51.446 52.037 0.015 0.000 0.817 2374 A CB 0.421 19.428 19.000 0.012 0.000 1.189 2374 A HN 0.306 nan 8.150 nan 0.000 0.489 2375 I N 1.899 122.478 120.570 0.015 0.000 2.264 2375 I HA -0.311 3.858 4.170 -0.001 0.000 0.248 2375 I C 2.753 178.876 176.117 0.010 0.000 1.111 2375 I CA 1.798 63.106 61.300 0.014 0.000 1.382 2375 I CB -0.207 37.802 38.000 0.014 0.000 1.060 2375 I HN 0.760 nan 8.210 nan 0.000 0.418 2376 A N 0.658 123.483 122.820 0.009 0.000 1.972 2376 A HA -0.128 4.191 4.320 -0.001 0.000 0.219 2376 A C 2.422 180.009 177.584 0.006 0.000 1.169 2376 A CA 1.722 53.762 52.037 0.006 0.000 0.635 2376 A CB -0.656 18.347 19.000 0.006 0.000 0.810 2376 A HN 0.447 nan 8.150 nan 0.000 0.446 2377 A N -0.701 122.124 122.820 0.009 0.000 2.206 2377 A HA 0.341 4.660 4.320 -0.001 0.000 0.211 2377 A C 0.915 178.505 177.584 0.010 0.000 1.158 2377 A CA -0.124 51.918 52.037 0.009 0.000 0.761 2377 A CB -0.494 18.512 19.000 0.010 0.000 0.801 2377 A HN 0.457 nan 8.150 nan 0.000 0.473 2378 L N 1.525 122.754 121.223 0.010 0.000 2.490 2378 L HA 0.194 4.533 4.340 -0.001 0.000 0.274 2378 L C 0.719 177.594 176.870 0.009 0.000 1.201 2378 L CA 0.167 55.014 54.840 0.011 0.000 0.869 2378 L CB 0.563 42.628 42.059 0.011 0.000 1.123 2378 L HN 0.470 nan 8.230 nan 0.000 0.484 2379 S N 1.315 117.021 115.700 0.010 0.000 2.651 2379 S HA 0.611 5.081 4.470 -0.001 0.000 0.279 2379 S C 0.438 175.044 174.600 0.011 0.000 1.148 2379 S CA -0.283 57.922 58.200 0.009 0.000 0.837 2379 S CB 1.651 64.856 63.200 0.008 0.000 1.138 2379 S HN 0.598 nan 8.310 nan 0.000 0.478 2380 A N 0.589 123.415 122.820 0.009 0.000 1.978 2380 A HA -0.067 4.252 4.320 -0.001 0.000 0.220 2380 A C 1.947 179.539 177.584 0.014 0.000 1.170 2380 A CA 1.332 53.375 52.037 0.011 0.000 0.636 2380 A CB -0.844 18.161 19.000 0.009 0.000 0.810 2380 A HN 0.730 nan 8.150 nan 0.000 0.448 2381 Q N 0.120 119.928 119.800 0.013 0.000 2.436 2381 Q HA -0.090 4.249 4.340 -0.001 0.000 0.209 2381 Q C 0.388 176.398 176.000 0.017 0.000 0.965 2381 Q CA 0.937 56.748 55.803 0.014 0.000 0.910 2381 Q CB -0.189 28.556 28.738 0.011 0.000 0.980 2381 Q HN 0.658 nan 8.270 nan 0.000 0.491 2382 D N -0.183 120.228 120.400 0.018 0.000 2.339 2382 D HA 0.083 4.723 4.640 -0.001 0.000 0.217 2382 D C 0.407 176.724 176.300 0.028 0.000 1.050 2382 D CA 0.104 54.117 54.000 0.022 0.000 0.856 2382 D CB 0.606 41.419 40.800 0.021 0.000 0.922 2382 D HN 0.197 nan 8.370 nan 0.000 0.518 2383 L N 0.778 122.017 121.223 0.028 0.000 2.371 2383 L HA 0.430 4.770 4.340 -0.001 0.000 0.272 2383 L C 1.121 178.013 176.870 0.036 0.000 1.124 2383 L CA -0.530 54.330 54.840 0.034 0.000 0.816 2383 L CB 1.392 43.468 42.059 0.029 0.000 1.129 2383 L HN -0.138 nan 8.230 nan 0.000 0.448 2384 G N 1.121 109.948 108.800 0.045 0.000 2.471 2384 G HA2 0.481 4.440 3.960 -0.001 0.000 0.332 2384 G HA3 0.481 4.440 3.960 -0.001 0.000 0.332 2384 G C -1.247 173.681 174.900 0.046 0.000 1.176 2384 G CA -0.459 44.667 45.100 0.044 0.000 0.949 2384 G HN 0.520 nan 8.290 nan 0.000 0.488 2385 D N -0.178 120.246 120.400 0.041 0.000 2.248 2385 D HA 0.620 5.260 4.640 -0.001 0.000 0.246 2385 D C -0.286 176.034 176.300 0.033 0.000 1.027 2385 D CA 0.042 54.063 54.000 0.034 0.000 0.853 2385 D CB 2.137 42.952 40.800 0.026 0.000 1.243 2385 D HN 0.580 nan 8.370 nan 0.000 0.462 2386 A N 0.426 123.267 122.820 0.035 0.000 2.486 2386 A HA 0.628 4.948 4.320 -0.001 0.000 0.300 2386 A C 0.927 178.527 177.584 0.026 0.000 1.048 2386 A CA -0.420 51.638 52.037 0.035 0.000 0.696 2386 A CB 1.718 20.755 19.000 0.062 0.000 1.278 2386 A HN 0.500 nan 8.150 nan 0.000 0.405 2387 G N 0.224 109.033 108.800 0.016 0.000 2.404 2387 G HA2 0.291 4.251 3.960 -0.001 0.000 0.215 2387 G HA3 0.291 4.251 3.960 -0.001 0.000 0.215 2387 G C 0.306 175.218 174.900 0.021 0.000 1.174 2387 G CA 1.680 46.786 45.100 0.009 0.000 0.780 2387 G HN 1.158 nan 8.290 nan 0.000 0.537 2388 L N -0.046 121.199 121.223 0.036 0.000 2.493 2388 L HA 0.647 4.987 4.340 -0.001 0.000 0.265 2388 L C -1.354 175.563 176.870 0.079 0.000 0.954 2388 L CA -0.807 54.060 54.840 0.046 0.000 0.844 2388 L CB 2.579 44.658 42.059 0.033 0.000 1.302 2388 L HN -0.121 nan 8.230 nan 0.000 0.405 2389 V N 4.429 124.393 119.914 0.084 0.000 2.376 2389 V HA 0.638 4.758 4.120 -0.001 0.000 0.287 2389 V C -0.538 175.619 176.094 0.106 0.000 1.015 2389 V CA -0.441 61.932 62.300 0.122 0.000 0.834 2389 V CB 1.420 33.320 31.823 0.128 0.000 1.001 2389 V HN 0.829 nan 8.190 nan 0.000 0.428 2390 E N 3.154 123.441 120.200 0.145 0.000 2.308 2390 E HA 0.388 4.738 4.350 -0.001 0.000 0.275 2390 E C -1.019 175.687 176.600 0.177 0.000 0.890 2390 E CA -0.655 55.817 56.400 0.119 0.000 0.754 2390 E CB 2.193 31.937 29.700 0.073 0.000 1.207 2390 E HN 0.751 nan 8.360 nan 0.000 0.426 2391 E N 4.331 124.604 120.200 0.123 0.000 2.152 2391 E HA 0.237 4.586 4.350 -0.001 0.000 0.285 2391 E C -0.907 175.769 176.600 0.127 0.000 1.043 2391 E CA -0.205 56.275 56.400 0.133 0.000 0.839 2391 E CB 0.678 30.424 29.700 0.078 0.000 1.069 2391 E HN 0.351 nan 8.360 nan 0.000 0.399 2392 R N 3.702 124.321 120.500 0.199 0.000 2.686 2392 R HA 0.396 4.736 4.340 -0.001 0.000 0.283 2392 R C -0.818 175.578 176.300 0.162 0.000 0.978 2392 R CA -0.908 55.281 56.100 0.148 0.000 0.897 2392 R CB 2.021 32.381 30.300 0.101 0.000 1.192 2392 R HN 0.333 nan 8.270 nan 0.000 0.457 2393 K N 2.682 123.138 120.400 0.093 0.000 2.367 2393 K HA 0.406 4.726 4.320 -0.001 0.000 0.263 2393 K C -0.885 175.758 176.600 0.072 0.000 1.000 2393 K CA -0.490 55.845 56.287 0.080 0.000 0.891 2393 K CB 1.216 33.745 32.500 0.049 0.000 1.117 2393 K HN 0.290 nan 8.250 nan 0.000 0.443 2394 I N 1.689 122.314 120.570 0.092 0.000 2.382 2394 I HA 0.083 4.253 4.170 -0.001 0.000 0.286 2394 I C 0.574 176.723 176.117 0.054 0.000 1.002 2394 I CA -0.053 61.293 61.300 0.076 0.000 1.135 2394 I CB 1.907 39.978 38.000 0.118 0.000 1.288 2394 I HN 0.667 nan 8.210 nan 0.000 0.448 2395 S N 4.432 120.153 115.700 0.036 0.000 3.672 2395 S HA -0.181 4.289 4.470 -0.001 0.000 0.319 2395 S C 1.263 175.876 174.600 0.022 0.000 1.151 2395 S CA 1.370 59.585 58.200 0.025 0.000 0.911 2395 S CB -1.248 61.966 63.200 0.023 0.000 0.939 2395 S HN 1.697 nan 8.310 nan 0.000 0.524 2396 G N -0.019 108.796 108.800 0.024 0.000 2.383 2396 G HA2 -0.261 3.699 3.960 -0.001 0.000 0.229 2396 G HA3 -0.261 3.699 3.960 -0.001 0.000 0.229 2396 G C -0.294 174.621 174.900 0.026 0.000 1.089 2396 G CA 0.290 45.403 45.100 0.021 0.000 0.640 2396 G HN 0.688 nan 8.290 nan 0.000 0.510 2397 D N 1.268 121.685 120.400 0.029 0.000 2.345 2397 D HA 0.471 5.110 4.640 -0.001 0.000 0.247 2397 D C 0.446 176.773 176.300 0.045 0.000 1.108 2397 D CA 0.646 54.664 54.000 0.029 0.000 0.894 2397 D CB 1.573 42.386 40.800 0.021 0.000 1.203 2397 D HN 0.259 nan 8.370 nan 0.000 0.430 2398 S N 2.051 117.775 115.700 0.041 0.000 2.523 2398 S HA 0.482 4.951 4.470 -0.001 0.000 0.275 2398 S C -0.132 174.498 174.600 0.050 0.000 1.281 2398 S CA -0.728 57.505 58.200 0.056 0.000 1.050 2398 S CB 0.047 63.274 63.200 0.046 0.000 0.937 2398 S HN 0.405 nan 8.310 nan 0.000 0.492 2399 M N 4.536 124.183 119.600 0.078 0.000 2.421 2399 M HA 0.524 5.003 4.480 -0.001 0.000 0.287 2399 M C -1.867 174.471 176.300 0.064 0.000 1.183 2399 M CA -0.642 54.666 55.300 0.013 0.000 0.916 2399 M CB 1.085 33.637 32.600 -0.079 0.000 1.701 2399 M HN 0.419 nan 8.290 nan 0.000 0.470 2400 I N 2.920 123.493 120.570 0.006 0.000 2.336 2400 I HA 0.421 4.591 4.170 -0.001 0.000 0.292 2400 I C -1.169 174.928 176.117 -0.033 0.000 0.991 2400 I CA -0.391 60.975 61.300 0.110 0.000 1.227 2400 I CB 1.112 39.231 38.000 0.199 0.000 1.366 2400 I HN 0.503 nan 8.210 nan 0.000 0.466 2401 F N 5.827 125.814 119.950 0.063 0.000 2.391 2401 F HA 0.352 4.879 4.527 -0.001 0.000 0.359 2401 F C 0.136 175.970 175.800 0.056 0.000 1.122 2401 F CA -0.648 57.378 58.000 0.042 0.000 1.120 2401 F CB 1.292 40.308 39.000 0.027 0.000 1.142 2401 F HN 0.031 nan 8.300 nan 0.000 0.483 2402 V N 4.380 124.386 119.914 0.152 0.000 2.293 2402 V HA 0.352 4.472 4.120 -0.001 0.000 0.275 2402 V C -0.307 175.845 176.094 0.098 0.000 1.021 2402 V CA -0.559 61.812 62.300 0.118 0.000 0.815 2402 V CB 0.485 32.347 31.823 0.066 0.000 1.025 2402 V HN 0.824 nan 8.190 nan 0.000 0.448 2403 E N 3.044 123.308 120.200 0.107 0.000 2.433 2403 E HA 0.644 4.994 4.350 -0.001 0.000 0.273 2403 E C -0.690 175.938 176.600 0.048 0.000 0.950 2403 E CA -0.872 55.578 56.400 0.083 0.000 0.796 2403 E CB 1.618 31.384 29.700 0.110 0.000 1.330 2403 E HN 0.194 nan 8.360 nan 0.000 0.455 2404 E N -0.957 119.260 120.200 0.028 0.000 2.553 2404 E HA -0.161 4.189 4.350 -0.001 0.000 0.264 2404 E C -0.490 176.104 176.600 -0.010 0.000 1.068 2404 E CA 0.678 57.081 56.400 0.005 0.000 0.774 2404 E CB -2.479 27.224 29.700 0.004 0.000 1.349 2404 E HN 0.593 nan 8.360 nan 0.000 0.404 2405 C N 0.472 119.768 119.300 -0.007 0.000 2.705 2405 C HA 0.071 4.530 4.460 -0.001 0.000 0.382 2405 C C 2.362 177.308 174.990 -0.073 0.000 1.322 2405 C CA -0.065 58.942 59.018 -0.018 0.000 2.290 2405 C CB 0.422 28.164 27.740 0.002 0.000 2.650 2405 C HN 0.408 nan 8.230 nan 0.000 0.695 2406 K N 0.303 120.642 120.400 -0.102 0.000 1.969 2406 K HA -0.106 4.213 4.320 -0.001 0.000 0.216 2406 K C 0.416 176.718 176.600 -0.497 0.000 1.048 2406 K CA 1.469 57.591 56.287 -0.274 0.000 0.948 2406 K CB -0.114 32.276 32.500 -0.184 0.000 0.726 2406 K HN 0.670 nan 8.250 nan 0.000 0.442 2407 H N 0.249 119.324 119.070 0.010 0.000 2.448 2407 H HA 0.225 4.781 4.556 -0.001 0.000 0.237 2407 H C -2.505 172.827 175.328 0.006 0.000 1.391 2407 H CA -2.013 54.039 56.048 0.007 0.000 1.477 2407 H CB 0.612 30.378 29.762 0.006 0.000 1.520 2407 H HN 0.189 nan 8.280 nan 0.000 0.502 2408 P HA 0.069 nan 4.420 nan 0.000 0.271 2408 P C 0.681 178.009 177.300 0.047 0.000 1.226 2408 P CA -0.405 62.722 63.100 0.045 0.000 0.765 2408 P CB 1.672 33.386 31.700 0.023 0.000 0.835 2409 K N 0.937 121.357 120.400 0.034 0.000 2.358 2409 K HA 0.376 4.695 4.320 -0.001 0.000 0.197 2409 K C 0.596 177.202 176.600 0.010 0.000 1.025 2409 K CA 0.002 56.303 56.287 0.023 0.000 1.104 2409 K CB 0.741 33.252 32.500 0.019 0.000 0.855 2409 K HN 0.551 nan 8.250 nan 0.000 0.531 2410 A N 0.898 123.721 122.820 0.005 0.000 2.486 2410 A HA 0.620 4.940 4.320 -0.001 0.000 0.300 2410 A C -0.558 177.023 177.584 -0.005 0.000 1.048 2410 A CA -0.714 51.319 52.037 -0.006 0.000 0.696 2410 A CB 1.515 20.503 19.000 -0.019 0.000 1.278 2410 A HN -0.063 nan 8.150 nan 0.000 0.405 2411 V N -1.214 118.696 119.914 -0.006 0.000 3.102 2411 V HA 0.979 5.099 4.120 -0.001 0.000 0.312 2411 V C -0.433 175.655 176.094 -0.011 0.000 1.135 2411 V CA -0.622 61.677 62.300 -0.002 0.000 1.022 2411 V CB 1.639 33.467 31.823 0.008 0.000 1.056 2411 V HN 0.900 nan 8.190 nan 0.000 0.436 2412 T N 3.329 117.880 114.554 -0.005 0.000 2.886 2412 T HA 0.580 4.930 4.350 -0.001 0.000 0.292 2412 T C -0.632 174.072 174.700 0.006 0.000 1.012 2412 T CA -0.259 61.830 62.100 -0.017 0.000 0.982 2412 T CB 1.515 70.353 68.868 -0.051 0.000 1.018 2412 T HN 0.982 nan 8.240 nan 0.000 0.451 2413 M N 4.256 123.857 119.600 0.001 0.000 2.066 2413 M HA 0.540 5.020 4.480 -0.001 0.000 0.340 2413 M C -1.502 174.807 176.300 0.014 0.000 1.053 2413 M CA -1.103 54.206 55.300 0.015 0.000 0.983 2413 M CB 0.572 33.178 32.600 0.010 0.000 1.520 2413 M HN 0.476 nan 8.290 nan 0.000 0.428 2414 L N 7.577 128.823 121.223 0.039 0.000 2.255 2414 L HA 0.524 4.864 4.340 -0.001 0.000 0.289 2414 L C -1.232 175.663 176.870 0.041 0.000 1.046 2414 L CA 0.064 54.932 54.840 0.047 0.000 0.816 2414 L CB 0.513 42.639 42.059 0.110 0.000 1.197 2414 L HN 0.673 nan 8.230 nan 0.000 0.427 2415 I N 5.883 126.468 120.570 0.025 0.000 2.331 2415 I HA 0.438 4.607 4.170 -0.001 0.000 0.292 2415 I C 0.136 176.266 176.117 0.022 0.000 0.998 2415 I CA -0.587 60.726 61.300 0.021 0.000 1.267 2415 I CB 0.583 38.591 38.000 0.013 0.000 1.386 2415 I HN 0.526 nan 8.210 nan 0.000 0.476 2416 R N 4.121 124.635 120.500 0.023 0.000 2.873 2416 R HA 0.900 5.239 4.340 -0.001 0.000 0.264 2416 R C -0.272 176.038 176.300 0.017 0.000 1.026 2416 R CA -1.042 55.071 56.100 0.021 0.000 1.002 2416 R CB 1.943 32.258 30.300 0.025 0.000 1.174 2416 R HN 0.864 nan 8.270 nan 0.000 0.488 2417 G N -1.034 107.775 108.800 0.015 0.000 2.340 2417 G HA2 -0.002 3.958 3.960 -0.001 0.000 0.298 2417 G HA3 -0.002 3.958 3.960 -0.001 0.000 0.298 2417 G C -0.074 174.834 174.900 0.013 0.000 1.498 2417 G CA -0.250 44.859 45.100 0.014 0.000 0.847 2417 G HN 0.377 nan 8.290 nan 0.000 0.594 2418 T N -0.551 114.012 114.554 0.015 0.000 3.035 2418 T HA 0.316 4.665 4.350 -0.001 0.000 0.268 2418 T C 0.777 175.485 174.700 0.014 0.000 1.109 2418 T CA 2.113 64.221 62.100 0.014 0.000 1.119 2418 T CB -0.235 68.642 68.868 0.016 0.000 0.900 2418 T HN 0.699 nan 8.240 nan 0.000 0.503 2419 T N 0.192 114.756 114.554 0.016 0.000 2.894 2419 T HA 0.298 4.647 4.350 -0.001 0.000 0.309 2419 T C 0.284 174.980 174.700 -0.007 0.000 1.208 2419 T CA -0.682 61.426 62.100 0.013 0.000 1.016 2419 T CB 2.160 71.053 68.868 0.043 0.000 1.192 2419 T HN -0.079 nan 8.240 nan 0.000 0.491 2420 E N 0.706 120.870 120.200 -0.061 0.000 2.085 2420 E HA -0.194 4.155 4.350 -0.001 0.000 0.194 2420 E C 1.566 178.084 176.600 -0.137 0.000 0.994 2420 E CA 1.837 58.157 56.400 -0.133 0.000 0.801 2420 E CB -0.059 29.500 29.700 -0.234 0.000 0.743 2420 E HN 0.608 nan 8.360 nan 0.000 0.453 2421 H N -0.887 118.186 119.070 0.005 0.000 2.495 2421 H HA 0.019 4.575 4.556 -0.001 0.000 0.287 2421 H C 2.035 177.366 175.328 0.005 0.000 1.033 2421 H CA 1.146 57.197 56.048 0.004 0.000 1.307 2421 H CB 0.113 29.877 29.762 0.004 0.000 1.401 2421 H HN 0.113 nan 8.280 nan 0.000 0.555 2422 V N 1.969 121.948 119.914 0.108 0.000 2.283 2422 V HA -0.201 3.919 4.120 -0.001 0.000 0.243 2422 V C 2.655 178.775 176.094 0.043 0.000 1.039 2422 V CA 1.671 64.010 62.300 0.065 0.000 1.016 2422 V CB -0.519 31.332 31.823 0.046 0.000 0.650 2422 V HN 0.401 nan 8.190 nan 0.000 0.449 2423 I N -1.080 119.506 120.570 0.026 0.000 2.756 2423 I HA -0.149 4.020 4.170 -0.001 0.000 0.262 2423 I C 2.239 178.365 176.117 0.015 0.000 1.225 2423 I CA 1.855 63.164 61.300 0.015 0.000 1.472 2423 I CB -0.499 37.503 38.000 0.003 0.000 1.094 2423 I HN 0.421 nan 8.210 nan 0.000 0.454 2424 E N 1.800 122.013 120.200 0.022 0.000 2.046 2424 E HA -0.272 4.078 4.350 -0.001 0.000 0.190 2424 E C 2.232 178.857 176.600 0.042 0.000 0.982 2424 E CA 1.062 57.482 56.400 0.033 0.000 0.800 2424 E CB -0.144 29.593 29.700 0.061 0.000 0.756 2424 E HN 0.542 nan 8.360 nan 0.000 0.449 2425 E N 0.596 120.828 120.200 0.054 0.000 2.153 2425 E HA -0.148 4.202 4.350 -0.001 0.000 0.194 2425 E C 2.092 178.710 176.600 0.029 0.000 0.988 2425 E CA 1.036 57.460 56.400 0.041 0.000 0.811 2425 E CB 0.104 29.829 29.700 0.043 0.000 0.746 2425 E HN 0.215 nan 8.360 nan 0.000 0.466 2426 V N 1.374 121.305 119.914 0.027 0.000 2.358 2426 V HA -0.212 3.908 4.120 -0.001 0.000 0.246 2426 V C 2.666 178.770 176.094 0.017 0.000 1.047 2426 V CA 1.630 63.942 62.300 0.021 0.000 1.035 2426 V CB -0.928 30.907 31.823 0.020 0.000 0.658 2426 V HN 0.359 nan 8.190 nan 0.000 0.452 2427 A N 0.508 123.337 122.820 0.015 0.000 1.908 2427 A HA -0.302 4.018 4.320 -0.001 0.000 0.218 2427 A C 2.310 179.900 177.584 0.011 0.000 1.181 2427 A CA 2.434 54.477 52.037 0.010 0.000 0.627 2427 A CB -0.552 18.452 19.000 0.007 0.000 0.818 2427 A HN 0.469 nan 8.150 nan 0.000 0.445 2428 R N 0.035 120.544 120.500 0.014 0.000 2.075 2428 R HA 0.011 4.351 4.340 -0.001 0.000 0.232 2428 R C 2.174 178.482 176.300 0.012 0.000 1.126 2428 R CA 1.885 57.993 56.100 0.013 0.000 0.963 2428 R CB -0.892 29.417 30.300 0.016 0.000 0.858 2428 R HN 0.393 nan 8.270 nan 0.000 0.435 2429 A N 0.135 122.964 122.820 0.015 0.000 1.883 2429 A HA -0.140 4.180 4.320 -0.001 0.000 0.217 2429 A C 2.225 179.817 177.584 0.013 0.000 1.186 2429 A CA 2.074 54.120 52.037 0.016 0.000 0.624 2429 A CB -0.970 18.042 19.000 0.019 0.000 0.822 2429 A HN 0.330 nan 8.150 nan 0.000 0.444 2430 V N -2.436 117.486 119.914 0.012 0.000 2.871 2430 V HA -0.118 4.002 4.120 -0.001 0.000 0.256 2430 V C 1.913 178.011 176.094 0.007 0.000 1.082 2430 V CA 2.018 64.324 62.300 0.010 0.000 1.105 2430 V CB -0.661 31.168 31.823 0.009 0.000 0.713 2430 V HN 0.549 nan 8.190 nan 0.000 0.473 2431 D N 1.518 121.922 120.400 0.007 0.000 2.104 2431 D HA -0.263 4.377 4.640 -0.001 0.000 0.194 2431 D C 1.625 177.928 176.300 0.005 0.000 0.994 2431 D CA 2.298 56.301 54.000 0.004 0.000 0.830 2431 D CB -0.068 40.734 40.800 0.004 0.000 0.959 2431 D HN 0.601 nan 8.370 nan 0.000 0.452 2432 D N 0.108 120.512 120.400 0.007 0.000 2.144 2432 D HA -0.060 4.579 4.640 -0.001 0.000 0.200 2432 D C 2.039 178.344 176.300 0.007 0.000 0.978 2432 D CA 1.367 55.371 54.000 0.007 0.000 0.833 2432 D CB -0.262 40.543 40.800 0.008 0.000 0.961 2432 D HN 0.254 nan 8.370 nan 0.000 0.470 2433 A N 0.386 123.211 122.820 0.008 0.000 1.908 2433 A HA -0.166 4.153 4.320 -0.001 0.000 0.218 2433 A C 2.364 179.952 177.584 0.006 0.000 1.181 2433 A CA 1.183 53.224 52.037 0.008 0.000 0.627 2433 A CB -0.840 18.165 19.000 0.009 0.000 0.818 2433 A HN 0.152 nan 8.150 nan 0.000 0.445 2434 V N -0.116 119.802 119.914 0.005 0.000 2.295 2434 V HA -0.197 3.923 4.120 -0.001 0.000 0.246 2434 V C 2.830 178.926 176.094 0.004 0.000 1.049 2434 V CA 2.010 64.313 62.300 0.004 0.000 1.024 2434 V CB -1.494 30.331 31.823 0.003 0.000 0.648 2434 V HN 0.618 nan 8.190 nan 0.000 0.447 2435 G N 0.458 109.260 108.800 0.004 0.000 2.446 2435 G HA2 -0.230 3.730 3.960 -0.001 0.000 0.217 2435 G HA3 -0.230 3.730 3.960 -0.001 0.000 0.217 2435 G C 1.724 176.626 174.900 0.004 0.000 1.168 2435 G CA 1.664 46.766 45.100 0.003 0.000 0.771 2435 G HN 0.594 nan 8.290 nan 0.000 0.551 2436 V N -1.443 118.474 119.914 0.005 0.000 2.591 2436 V HA -0.009 4.111 4.120 -0.001 0.000 0.249 2436 V C 2.652 178.749 176.094 0.005 0.000 1.053 2436 V CA 1.366 63.669 62.300 0.005 0.000 1.068 2436 V CB -0.483 31.344 31.823 0.007 0.000 0.689 2436 V HN 0.132 nan 8.190 nan 0.000 0.462 2437 V N 1.991 121.908 119.914 0.005 0.000 2.453 2437 V HA -0.024 4.096 4.120 -0.001 0.000 0.247 2437 V C 2.904 179.000 176.094 0.004 0.000 1.048 2437 V CA 2.137 64.440 62.300 0.005 0.000 1.049 2437 V CB -1.297 30.529 31.823 0.005 0.000 0.672 2437 V HN 0.625 nan 8.190 nan 0.000 0.457 2438 G N -1.115 107.687 108.800 0.004 0.000 2.422 2438 G HA2 -0.252 3.707 3.960 -0.001 0.000 0.218 2438 G HA3 -0.252 3.707 3.960 -0.001 0.000 0.218 2438 G C 1.722 176.624 174.900 0.003 0.000 1.146 2438 G CA 1.291 46.393 45.100 0.003 0.000 0.769 2438 G HN 0.536 nan 8.290 nan 0.000 0.547 2439 C N 0.542 119.844 119.300 0.003 0.000 2.429 2439 C HA -0.024 4.435 4.460 -0.001 0.000 0.277 2439 C C 3.208 178.200 174.990 0.004 0.000 1.262 2439 C CA 1.505 60.525 59.018 0.003 0.000 1.733 2439 C CB -1.037 26.705 27.740 0.004 0.000 2.010 2439 C HN 0.426 nan 8.230 nan 0.000 0.483 2440 T N 1.099 115.655 114.554 0.004 0.000 2.881 2440 T HA -0.042 4.307 4.350 -0.001 0.000 0.270 2440 T C 1.566 176.268 174.700 0.003 0.000 1.068 2440 T CA 1.203 63.306 62.100 0.004 0.000 1.131 2440 T CB -0.212 68.659 68.868 0.004 0.000 0.871 2440 T HN 0.515 nan 8.240 nan 0.000 0.479 2441 I N 0.460 121.032 120.570 0.003 0.000 2.480 2441 I HA -0.016 4.153 4.170 -0.001 0.000 0.251 2441 I C 2.518 178.636 176.117 0.002 0.000 1.124 2441 I CA 0.939 62.241 61.300 0.003 0.000 1.444 2441 I CB -0.211 37.791 38.000 0.003 0.000 1.098 2441 I HN 0.226 nan 8.210 nan 0.000 0.428 2442 E N 0.133 120.334 120.200 0.002 0.000 2.110 2442 E HA -0.176 4.174 4.350 -0.001 0.000 0.193 2442 E C 0.532 177.133 176.600 0.002 0.000 0.988 2442 E CA 0.828 57.230 56.400 0.002 0.000 0.804 2442 E CB 0.166 29.867 29.700 0.002 0.000 0.745 2442 E HN 0.257 nan 8.360 nan 0.000 0.458 2443 D N -1.046 119.355 120.400 0.002 0.000 2.620 2443 D HA 0.126 4.765 4.640 -0.001 0.000 0.252 2443 D C -0.196 176.106 176.300 0.003 0.000 1.207 2443 D CA -0.364 53.638 54.000 0.002 0.000 0.884 2443 D CB 1.597 42.398 40.800 0.002 0.000 1.262 2443 D HN 0.055 nan 8.370 nan 0.000 0.552 2444 G N 3.397 112.198 108.800 0.002 0.000 3.374 2444 G HA2 0.085 4.045 3.960 -0.001 0.000 0.252 2444 G HA3 0.085 4.045 3.960 -0.001 0.000 0.252 2444 G C 0.404 175.306 174.900 0.003 0.000 1.326 2444 G CA -0.141 44.961 45.100 0.003 0.000 1.133 2444 G HN 0.293 nan 8.290 nan 0.000 0.528 2445 R N -0.459 120.044 120.500 0.004 0.000 2.621 2445 R HA 0.621 4.961 4.340 -0.001 0.000 0.292 2445 R C -0.760 175.543 176.300 0.006 0.000 0.969 2445 R CA -0.789 55.314 56.100 0.005 0.000 0.887 2445 R CB 2.044 32.346 30.300 0.005 0.000 1.180 2445 R HN 0.265 nan 8.270 nan 0.000 0.450 2446 I N -1.050 119.524 120.570 0.007 0.000 3.002 2446 I HA 0.775 4.944 4.170 -0.001 0.000 0.310 2446 I C -0.537 175.587 176.117 0.012 0.000 1.087 2446 I CA -1.188 60.118 61.300 0.009 0.000 1.017 2446 I CB 2.083 40.088 38.000 0.009 0.000 1.226 2446 I HN 0.359 nan 8.210 nan 0.000 0.443 2447 V N -0.142 119.781 119.914 0.015 0.000 2.962 2447 V HA 0.820 4.940 4.120 -0.001 0.000 0.313 2447 V C 0.059 176.168 176.094 0.024 0.000 1.099 2447 V CA -0.466 61.846 62.300 0.021 0.000 0.971 2447 V CB 1.124 32.959 31.823 0.020 0.000 1.028 2447 V HN 1.139 nan 8.190 nan 0.000 0.430 2448 S N 2.182 117.902 115.700 0.033 0.000 2.562 2448 S HA 0.650 5.120 4.470 -0.001 0.000 0.281 2448 S C 0.589 175.208 174.600 0.033 0.000 1.333 2448 S CA 0.160 58.383 58.200 0.037 0.000 1.052 2448 S CB 0.869 64.100 63.200 0.052 0.000 0.884 2448 S HN 1.772 nan 8.310 nan 0.000 0.506 2449 G N 0.571 109.390 108.800 0.032 0.000 2.630 2449 G HA2 0.532 4.492 3.960 -0.001 0.000 0.223 2449 G HA3 0.532 4.492 3.960 -0.001 0.000 0.223 2449 G C 0.930 175.847 174.900 0.027 0.000 1.434 2449 G CA -0.541 44.576 45.100 0.027 0.000 1.057 2449 G HN 2.040 nan 8.290 nan 0.000 0.570 2450 G N -1.914 106.902 108.800 0.026 0.000 2.225 2450 G HA2 0.232 4.191 3.960 -0.001 0.000 0.267 2450 G HA3 0.232 4.191 3.960 -0.001 0.000 0.267 2450 G C 1.478 176.375 174.900 -0.006 0.000 1.024 2450 G CA 1.214 46.327 45.100 0.020 0.000 0.784 2450 G HN 2.457 nan 8.290 nan 0.000 0.507 2451 G N -1.401 107.386 108.800 -0.021 0.000 2.162 2451 G HA2 -0.140 3.820 3.960 -0.001 0.000 0.260 2451 G HA3 -0.140 3.820 3.960 -0.001 0.000 0.260 2451 G C 1.510 176.358 174.900 -0.086 0.000 0.976 2451 G CA 1.692 46.761 45.100 -0.053 0.000 0.655 2451 G HN 1.957 nan 8.290 nan 0.000 0.533 2452 S N 0.119 115.787 115.700 -0.053 0.000 2.370 2452 S HA -0.184 4.286 4.470 -0.001 0.000 0.226 2452 S C 2.801 177.316 174.600 -0.142 0.000 1.033 2452 S CA 2.847 61.002 58.200 -0.076 0.000 1.011 2452 S CB -0.592 62.659 63.200 0.086 0.000 0.852 2452 S HN 1.399 nan 8.310 nan 0.000 0.457 2453 T N 0.025 114.546 114.554 -0.054 0.000 2.614 2453 T HA -0.096 4.254 4.350 -0.001 0.000 0.263 2453 T C 1.568 176.214 174.700 -0.089 0.000 1.055 2453 T CA 1.625 63.700 62.100 -0.041 0.000 1.162 2453 T CB -1.065 67.793 68.868 -0.017 0.000 0.863 2453 T HN 0.417 nan 8.240 nan 0.000 0.414 2454 E N 0.935 121.080 120.200 -0.092 0.000 2.187 2454 E HA -0.076 4.273 4.350 -0.001 0.000 0.199 2454 E C 2.239 178.758 176.600 -0.135 0.000 1.004 2454 E CA 0.967 57.306 56.400 -0.102 0.000 0.813 2454 E CB -0.704 28.937 29.700 -0.099 0.000 0.736 2454 E HN 0.436 nan 8.360 nan 0.000 0.468 2455 V N 0.433 120.213 119.914 -0.223 0.000 2.453 2455 V HA -0.200 3.920 4.120 -0.001 0.000 0.247 2455 V C 2.262 178.169 176.094 -0.311 0.000 1.048 2455 V CA 1.758 63.876 62.300 -0.304 0.000 1.049 2455 V CB -0.365 31.176 31.823 -0.471 0.000 0.672 2455 V HN 0.217 nan 8.190 nan 0.000 0.457 2456 E N 0.784 120.772 120.200 -0.354 0.000 2.077 2456 E HA -0.196 4.154 4.350 -0.001 0.000 0.193 2456 E C 2.017 178.628 176.600 0.019 0.000 0.989 2456 E CA 1.572 57.972 56.400 0.000 0.000 0.800 2456 E CB -0.419 29.366 29.700 0.142 0.000 0.746 2456 E HN 0.553 nan 8.360 nan 0.000 0.452 2457 L N -0.009 121.204 121.223 -0.017 0.000 2.046 2457 L HA -0.146 4.194 4.340 -0.001 0.000 0.208 2457 L C 2.665 179.554 176.870 0.031 0.000 1.077 2457 L CA 1.354 56.203 54.840 0.015 0.000 0.747 2457 L CB -0.669 41.393 42.059 0.007 0.000 0.896 2457 L HN 0.195 nan 8.230 nan 0.000 0.432 2458 S N -0.313 115.383 115.700 -0.006 0.000 2.356 2458 S HA -0.200 4.270 4.470 -0.001 0.000 0.223 2458 S C 2.126 176.749 174.600 0.038 0.000 1.032 2458 S CA 1.259 59.464 58.200 0.008 0.000 1.005 2458 S CB -0.016 63.167 63.200 -0.027 0.000 0.867 2458 S HN 0.212 nan 8.310 nan 0.000 0.449 2459 M N 0.890 120.512 119.600 0.037 0.000 2.117 2459 M HA 0.032 4.512 4.480 -0.001 0.000 0.262 2459 M C 1.997 178.343 176.300 0.076 0.000 1.065 2459 M CA 1.467 56.805 55.300 0.064 0.000 1.114 2459 M CB -0.997 31.660 32.600 0.096 0.000 1.361 2459 M HN 0.239 nan 8.290 nan 0.000 0.408 2460 K N -0.008 120.439 120.400 0.079 0.000 2.211 2460 K HA 0.193 4.513 4.320 -0.001 0.000 0.201 2460 K C 2.066 178.737 176.600 0.117 0.000 1.052 2460 K CA 0.568 56.906 56.287 0.085 0.000 0.973 2460 K CB -0.225 32.313 32.500 0.064 0.000 0.766 2460 K HN 0.352 nan 8.250 nan 0.000 0.466 2461 L N 0.349 121.644 121.223 0.120 0.000 2.240 2461 L HA -0.011 4.329 4.340 -0.001 0.000 0.211 2461 L C 2.299 179.294 176.870 0.209 0.000 1.106 2461 L CA 0.748 55.702 54.840 0.189 0.000 0.793 2461 L CB -0.195 41.979 42.059 0.192 0.000 0.927 2461 L HN 0.076 nan 8.230 nan 0.000 0.446 2462 R N 0.037 120.620 120.500 0.140 0.000 2.148 2462 R HA -0.116 4.224 4.340 -0.001 0.000 0.223 2462 R C 1.977 178.334 176.300 0.095 0.000 1.088 2462 R CA 0.979 57.143 56.100 0.107 0.000 0.985 2462 R CB -0.051 30.294 30.300 0.075 0.000 0.880 2462 R HN 0.446 nan 8.270 nan 0.000 0.451 2463 E N -0.499 119.767 120.200 0.109 0.000 2.112 2463 E HA -0.172 4.178 4.350 -0.001 0.000 0.190 2463 E C 1.437 178.106 176.600 0.116 0.000 0.979 2463 E CA 0.676 57.132 56.400 0.094 0.000 0.814 2463 E CB -0.052 29.702 29.700 0.090 0.000 0.762 2463 E HN 0.280 nan 8.360 nan 0.000 0.460 2464 Y N 1.593 121.910 120.300 0.027 0.000 2.224 2464 Y HA -0.207 4.342 4.550 -0.001 0.000 0.289 2464 Y C 2.180 178.091 175.900 0.019 0.000 1.146 2464 Y CA 1.256 59.368 58.100 0.020 0.000 1.182 2464 Y CB -0.383 38.088 38.460 0.017 0.000 0.983 2464 Y HN -0.013 nan 8.280 nan 0.000 0.524 2465 A N 0.242 123.066 122.820 0.006 0.000 1.940 2465 A HA -0.180 4.139 4.320 -0.001 0.000 0.219 2465 A C 2.119 179.649 177.584 -0.090 0.000 1.176 2465 A CA 1.860 53.864 52.037 -0.055 0.000 0.631 2465 A CB -0.532 18.496 19.000 0.047 0.000 0.814 2465 A HN 0.523 nan 8.150 nan 0.000 0.446 2466 E N -0.498 119.672 120.200 -0.051 0.000 2.072 2466 E HA -0.128 4.222 4.350 -0.001 0.000 0.191 2466 E C 2.186 178.740 176.600 -0.077 0.000 0.985 2466 E CA 1.172 57.546 56.400 -0.043 0.000 0.801 2466 E CB -0.696 28.998 29.700 -0.010 0.000 0.750 2466 E HN 0.590 nan 8.360 nan 0.000 0.452 2467 G N 1.298 110.028 108.800 -0.117 0.000 2.422 2467 G HA2 -0.168 3.791 3.960 -0.001 0.000 0.218 2467 G HA3 -0.168 3.791 3.960 -0.001 0.000 0.218 2467 G C 1.584 176.375 174.900 -0.182 0.000 1.140 2467 G CA 0.248 45.267 45.100 -0.135 0.000 0.775 2467 G HN 0.110 nan 8.290 nan 0.000 0.545 2468 I N 0.210 120.617 120.570 -0.270 0.000 2.233 2468 I HA 0.025 4.195 4.170 -0.001 0.000 0.243 2468 I C 1.678 177.718 176.117 -0.129 0.000 1.093 2468 I CA 1.028 62.182 61.300 -0.243 0.000 1.380 2468 I CB -1.118 36.695 38.000 -0.311 0.000 1.067 2468 I HN 0.300 nan 8.210 nan 0.000 0.413 2469 S N -1.114 114.525 115.700 -0.101 0.000 3.513 2469 S HA -0.107 4.363 4.470 -0.001 0.000 0.636 2469 S C 0.749 175.322 174.600 -0.046 0.000 2.452 2469 S CA 1.349 59.513 58.200 -0.059 0.000 2.644 2469 S CB -1.365 61.805 63.200 -0.050 0.000 0.331 2469 S HN 1.422 nan 8.310 nan 0.000 1.787 2470 G N 1.120 109.902 108.800 -0.031 0.000 2.578 2470 G HA2 -0.326 3.634 3.960 -0.001 0.000 0.275 2470 G HA3 -0.326 3.634 3.960 -0.001 0.000 0.275 2470 G C 0.341 175.233 174.900 -0.014 0.000 1.271 2470 G CA 1.638 46.725 45.100 -0.022 0.000 0.941 2470 G HN 1.879 nan 8.290 nan 0.000 0.564 2471 R N 0.401 120.895 120.500 -0.009 0.000 2.236 2471 R HA 0.228 4.568 4.340 -0.001 0.000 0.208 2471 R C 2.004 178.303 176.300 -0.000 0.000 1.036 2471 R CA 1.645 57.745 56.100 0.000 0.000 1.001 2471 R CB -0.202 30.102 30.300 0.006 0.000 0.896 2471 R HN 0.665 nan 8.270 nan 0.000 0.464 2472 E N 1.570 121.762 120.200 -0.013 0.000 2.204 2472 E HA -0.220 4.130 4.350 -0.001 0.000 0.194 2472 E C 1.810 178.406 176.600 -0.008 0.000 0.989 2472 E CA 1.437 57.826 56.400 -0.017 0.000 0.824 2472 E CB 0.063 29.741 29.700 -0.037 0.000 0.756 2472 E HN 0.596 nan 8.360 nan 0.000 0.477 2473 Q N 0.684 120.474 119.800 -0.017 0.000 2.230 2473 Q HA -0.135 4.205 4.340 -0.001 0.000 0.202 2473 Q C 1.985 178.008 176.000 0.038 0.000 0.963 2473 Q CA 0.951 56.748 55.803 -0.009 0.000 0.866 2473 Q CB -0.306 28.418 28.738 -0.024 0.000 0.931 2473 Q HN 0.207 nan 8.270 nan 0.000 0.452 2474 L N 0.346 121.594 121.223 0.041 0.000 2.109 2474 L HA 0.178 4.518 4.340 -0.001 0.000 0.207 2474 L C 2.245 179.183 176.870 0.114 0.000 1.086 2474 L CA 1.796 56.675 54.840 0.065 0.000 0.760 2474 L CB -0.986 41.099 42.059 0.045 0.000 0.910 2474 L HN 0.302 nan 8.230 nan 0.000 0.437 2475 A N -1.152 121.732 122.820 0.107 0.000 1.898 2475 A HA -0.126 4.194 4.320 -0.001 0.000 0.216 2475 A C 2.232 180.026 177.584 0.349 0.000 1.181 2475 A CA 1.942 54.086 52.037 0.177 0.000 0.620 2475 A CB -1.004 18.013 19.000 0.027 0.000 0.819 2475 A HN 0.265 nan 8.150 nan 0.000 0.442 2476 V N -0.176 119.875 119.914 0.228 0.000 2.358 2476 V HA -0.207 3.912 4.120 -0.001 0.000 0.246 2476 V C 2.619 178.872 176.094 0.265 0.000 1.047 2476 V CA 2.152 64.604 62.300 0.254 0.000 1.035 2476 V CB -0.775 31.157 31.823 0.181 0.000 0.658 2476 V HN 0.620 nan 8.190 nan 0.000 0.452 2477 R N 0.082 120.693 120.500 0.184 0.000 2.096 2477 R HA -0.129 4.211 4.340 -0.001 0.000 0.235 2477 R C 2.258 178.644 176.300 0.144 0.000 1.127 2477 R CA 1.545 57.730 56.100 0.142 0.000 0.968 2477 R CB -0.345 30.011 30.300 0.093 0.000 0.861 2477 R HN 0.503 nan 8.270 nan 0.000 0.440 2478 A N 0.032 122.962 122.820 0.183 0.000 1.929 2478 A HA -0.142 4.178 4.320 -0.001 0.000 0.216 2478 A C 1.895 179.549 177.584 0.117 0.000 1.176 2478 A CA 0.821 52.956 52.037 0.164 0.000 0.628 2478 A CB -0.634 18.504 19.000 0.231 0.000 0.816 2478 A HN 0.479 nan 8.150 nan 0.000 0.444 2479 F N 1.151 121.115 119.950 0.023 0.000 2.095 2479 F HA -0.152 4.375 4.527 -0.001 0.000 0.298 2479 F C 2.528 178.259 175.800 -0.116 0.000 1.104 2479 F CA 1.493 59.376 58.000 -0.195 0.000 1.232 2479 F CB -0.363 38.572 39.000 -0.109 0.000 0.987 2479 F HN 0.249 nan 8.300 nan 0.000 0.475 2480 A N -0.438 122.467 122.820 0.142 0.000 1.902 2480 A HA -0.241 4.079 4.320 -0.001 0.000 0.217 2480 A C 1.982 179.533 177.584 -0.056 0.000 1.181 2480 A CA 1.951 54.015 52.037 0.046 0.000 0.623 2480 A CB -1.174 17.897 19.000 0.118 0.000 0.818 2480 A HN 0.498 nan 8.150 nan 0.000 0.443 2481 D N 0.021 120.401 120.400 -0.032 0.000 2.123 2481 D HA -0.072 4.567 4.640 -0.001 0.000 0.196 2481 D C 2.044 178.280 176.300 -0.107 0.000 0.992 2481 D CA 1.618 55.589 54.000 -0.049 0.000 0.833 2481 D CB -0.248 40.545 40.800 -0.012 0.000 0.954 2481 D HN 0.333 nan 8.370 nan 0.000 0.455 2482 A N -0.116 122.596 122.820 -0.179 0.000 1.898 2482 A HA -0.087 4.233 4.320 -0.001 0.000 0.216 2482 A C 2.146 179.572 177.584 -0.263 0.000 1.181 2482 A CA 0.900 52.794 52.037 -0.237 0.000 0.620 2482 A CB -0.669 18.121 19.000 -0.349 0.000 0.819 2482 A HN 0.300 nan 8.150 nan 0.000 0.442 2483 L N 0.218 121.243 121.223 -0.330 0.000 2.191 2483 L HA -0.125 4.215 4.340 -0.001 0.000 0.212 2483 L C 2.140 178.911 176.870 -0.166 0.000 1.103 2483 L CA 1.723 56.398 54.840 -0.274 0.000 0.769 2483 L CB -0.799 41.086 42.059 -0.290 0.000 0.908 2483 L HN 0.482 nan 8.230 nan 0.000 0.438 2484 E N -1.374 118.745 120.200 -0.135 0.000 2.333 2484 E HA -0.179 4.171 4.350 -0.001 0.000 0.198 2484 E C 2.263 178.809 176.600 -0.090 0.000 1.007 2484 E CA 0.728 57.069 56.400 -0.098 0.000 0.845 2484 E CB -0.158 29.498 29.700 -0.074 0.000 0.766 2484 E HN 0.291 nan 8.360 nan 0.000 0.507 2485 V N 1.134 120.987 119.914 -0.101 0.000 2.720 2485 V HA -0.213 3.907 4.120 -0.001 0.000 0.256 2485 V C 1.718 177.765 176.094 -0.078 0.000 1.082 2485 V CA 1.089 63.338 62.300 -0.085 0.000 1.101 2485 V CB -0.206 31.563 31.823 -0.091 0.000 0.693 2485 V HN 0.258 nan 8.190 nan 0.000 0.479 2486 I N 0.602 121.121 120.570 -0.086 0.000 2.162 2486 I HA -0.035 4.135 4.170 -0.001 0.000 0.238 2486 I C 0.222 176.300 176.117 -0.065 0.000 1.076 2486 I CA 1.469 62.724 61.300 -0.074 0.000 1.353 2486 I CB -2.840 35.114 38.000 -0.078 0.000 1.063 2486 I HN 0.311 nan 8.210 nan 0.000 0.408 2487 P HA -0.171 nan 4.420 nan 0.000 0.216 2487 P C 1.798 179.066 177.300 -0.053 0.000 1.154 2487 P CA 1.754 64.818 63.100 -0.060 0.000 0.865 2487 P CB -0.159 31.500 31.700 -0.068 0.000 0.789 2488 R N -1.466 119.001 120.500 -0.054 0.000 2.075 2488 R HA -0.023 4.316 4.340 -0.001 0.000 0.232 2488 R C 2.033 178.304 176.300 -0.048 0.000 1.126 2488 R CA 1.719 57.790 56.100 -0.048 0.000 0.963 2488 R CB -1.006 29.265 30.300 -0.048 0.000 0.858 2488 R HN 0.199 nan 8.270 nan 0.000 0.435 2489 T N 1.083 115.605 114.554 -0.052 0.000 3.051 2489 T HA 0.131 4.481 4.350 -0.001 0.000 0.255 2489 T C 1.807 176.474 174.700 -0.055 0.000 1.085 2489 T CA 0.139 62.208 62.100 -0.052 0.000 1.109 2489 T CB 0.142 68.979 68.868 -0.052 0.000 0.921 2489 T HN 0.063 nan 8.240 nan 0.000 0.488 2490 L N 0.953 122.142 121.223 -0.057 0.000 2.043 2490 L HA -0.172 4.168 4.340 -0.001 0.000 0.212 2490 L C 2.824 179.649 176.870 -0.074 0.000 1.075 2490 L CA 1.641 56.443 54.840 -0.064 0.000 0.752 2490 L CB -0.443 41.582 42.059 -0.056 0.000 0.891 2490 L HN 0.258 nan 8.230 nan 0.000 0.432 2491 A N -1.252 121.530 122.820 -0.063 0.000 2.030 2491 A HA -0.120 4.200 4.320 -0.001 0.000 0.215 2491 A C 2.186 179.735 177.584 -0.058 0.000 1.164 2491 A CA 0.705 52.704 52.037 -0.063 0.000 0.697 2491 A CB -0.261 18.709 19.000 -0.049 0.000 0.827 2491 A HN 0.417 nan 8.150 nan 0.000 0.457 2492 E N 0.627 120.796 120.200 -0.051 0.000 2.070 2492 E HA -0.260 4.089 4.350 -0.001 0.000 0.197 2492 E C 1.372 177.943 176.600 -0.050 0.000 1.004 2492 E CA 1.625 57.998 56.400 -0.046 0.000 0.805 2492 E CB -0.130 29.544 29.700 -0.042 0.000 0.744 2492 E HN 0.540 nan 8.360 nan 0.000 0.451 2493 N N -0.038 118.627 118.700 -0.058 0.000 2.396 2493 N HA -0.073 4.667 4.740 -0.001 0.000 0.180 2493 N C 1.361 176.826 175.510 -0.074 0.000 1.028 2493 N CA 1.020 54.033 53.050 -0.061 0.000 0.893 2493 N CB -0.143 38.306 38.487 -0.064 0.000 0.967 2493 N HN 0.227 nan 8.380 nan 0.000 0.440 2494 A N 0.063 122.831 122.820 -0.088 0.000 2.119 2494 A HA 0.299 4.619 4.320 -0.001 0.000 0.216 2494 A C 1.467 179.009 177.584 -0.069 0.000 1.152 2494 A CA 1.054 53.030 52.037 -0.101 0.000 0.708 2494 A CB -0.384 18.540 19.000 -0.127 0.000 0.805 2494 A HN 0.306 nan 8.150 nan 0.000 0.460 2495 G N -1.333 107.435 108.800 -0.054 0.000 2.142 2495 G HA2 -0.179 3.780 3.960 -0.001 0.000 0.225 2495 G HA3 -0.179 3.780 3.960 -0.001 0.000 0.225 2495 G C -0.050 174.829 174.900 -0.034 0.000 1.015 2495 G CA 0.279 45.355 45.100 -0.039 0.000 0.716 2495 G HN 0.437 nan 8.290 nan 0.000 0.508 2496 L N -0.148 121.053 121.223 -0.038 0.000 2.387 2496 L HA 0.547 4.887 4.340 -0.001 0.000 0.266 2496 L C 0.357 177.211 176.870 -0.026 0.000 1.059 2496 L CA -1.095 53.726 54.840 -0.031 0.000 0.801 2496 L CB 0.912 42.950 42.059 -0.035 0.000 1.223 2496 L HN 0.099 nan 8.230 nan 0.000 0.456 2497 D N 0.721 121.109 120.400 -0.020 0.000 2.338 2497 D HA 0.199 4.838 4.640 -0.001 0.000 0.255 2497 D C 0.740 177.029 176.300 -0.019 0.000 1.237 2497 D CA -0.007 53.983 54.000 -0.017 0.000 0.883 2497 D CB 1.850 42.642 40.800 -0.012 0.000 1.087 2497 D HN 0.588 nan 8.370 nan 0.000 0.485 2498 A N 5.216 128.023 122.820 -0.021 0.000 1.978 2498 A HA -0.179 4.141 4.320 -0.001 0.000 0.220 2498 A C 2.064 179.637 177.584 -0.018 0.000 1.170 2498 A CA 0.891 52.914 52.037 -0.023 0.000 0.636 2498 A CB -0.328 18.658 19.000 -0.025 0.000 0.810 2498 A HN 0.700 nan 8.150 nan 0.000 0.448 2499 I N -0.534 120.027 120.570 -0.014 0.000 2.235 2499 I HA -0.153 4.017 4.170 -0.001 0.000 0.241 2499 I C 2.434 178.547 176.117 -0.008 0.000 1.085 2499 I CA 1.680 62.974 61.300 -0.011 0.000 1.378 2499 I CB -1.464 36.531 38.000 -0.008 0.000 1.076 2499 I HN 0.572 nan 8.210 nan 0.000 0.415 2500 E N 1.555 121.751 120.200 -0.007 0.000 2.051 2500 E HA -0.218 4.131 4.350 -0.001 0.000 0.192 2500 E C 2.336 178.934 176.600 -0.003 0.000 0.991 2500 E CA 1.637 58.035 56.400 -0.004 0.000 0.799 2500 E CB -0.094 29.604 29.700 -0.004 0.000 0.748 2500 E HN 0.591 nan 8.360 nan 0.000 0.449 2501 I N -0.891 119.674 120.570 -0.007 0.000 2.439 2501 I HA -0.129 4.041 4.170 -0.001 0.000 0.251 2501 I C 2.389 178.501 176.117 -0.007 0.000 1.139 2501 I CA 0.592 61.889 61.300 -0.006 0.000 1.438 2501 I CB -0.272 37.721 38.000 -0.013 0.000 1.085 2501 I HN 0.120 nan 8.210 nan 0.000 0.427 2502 L N 1.231 122.448 121.223 -0.011 0.000 2.046 2502 L HA -0.080 4.260 4.340 -0.001 0.000 0.208 2502 L C 2.342 179.210 176.870 -0.004 0.000 1.077 2502 L CA 1.772 56.604 54.840 -0.012 0.000 0.747 2502 L CB -0.478 41.572 42.059 -0.015 0.000 0.896 2502 L HN 0.119 nan 8.230 nan 0.000 0.432 2503 V N -0.521 119.393 119.914 0.000 0.000 2.302 2503 V HA -0.209 3.911 4.120 -0.001 0.000 0.243 2503 V C 2.521 178.622 176.094 0.012 0.000 1.036 2503 V CA 1.885 64.189 62.300 0.006 0.000 1.020 2503 V CB -0.568 31.258 31.823 0.005 0.000 0.657 2503 V HN 0.401 nan 8.190 nan 0.000 0.453 2504 K N -0.257 120.150 120.400 0.011 0.000 2.103 2504 K HA -0.063 4.257 4.320 -0.001 0.000 0.204 2504 K C 2.046 178.661 176.600 0.025 0.000 1.052 2504 K CA 1.104 57.401 56.287 0.016 0.000 0.945 2504 K CB -0.223 32.284 32.500 0.012 0.000 0.722 2504 K HN 0.300 nan 8.250 nan 0.000 0.443 2505 V N 1.307 121.235 119.914 0.022 0.000 2.379 2505 V HA -0.181 3.939 4.120 -0.001 0.000 0.245 2505 V C 2.381 178.508 176.094 0.054 0.000 1.044 2505 V CA 1.433 63.753 62.300 0.034 0.000 1.036 2505 V CB -0.445 31.387 31.823 0.015 0.000 0.664 2505 V HN 0.297 nan 8.190 nan 0.000 0.453 2506 R N 0.544 121.064 120.500 0.034 0.000 2.083 2506 R HA -0.212 4.128 4.340 -0.001 0.000 0.237 2506 R C 2.265 178.611 176.300 0.077 0.000 1.137 2506 R CA 1.970 58.098 56.100 0.046 0.000 0.951 2506 R CB -0.471 29.842 30.300 0.021 0.000 0.851 2506 R HN 0.474 nan 8.270 nan 0.000 0.434 2507 A N 0.536 123.388 122.820 0.052 0.000 1.898 2507 A HA -0.053 4.267 4.320 -0.001 0.000 0.216 2507 A C 2.360 179.973 177.584 0.048 0.000 1.181 2507 A CA 1.573 53.637 52.037 0.044 0.000 0.620 2507 A CB -0.741 18.276 19.000 0.028 0.000 0.819 2507 A HN 0.561 nan 8.150 nan 0.000 0.442 2508 A N -0.939 121.913 122.820 0.053 0.000 1.902 2508 A HA -0.167 4.153 4.320 -0.001 0.000 0.217 2508 A C 2.025 179.642 177.584 0.055 0.000 1.181 2508 A CA 2.114 54.179 52.037 0.047 0.000 0.623 2508 A CB -0.850 18.178 19.000 0.048 0.000 0.818 2508 A HN 0.780 nan 8.150 nan 0.000 0.443 2509 H N -0.267 118.806 119.070 0.006 0.000 2.299 2509 H HA 0.091 4.647 4.556 -0.000 0.000 0.302 2509 H C 2.210 177.542 175.328 0.007 0.000 1.078 2509 H CA 1.985 58.037 56.048 0.006 0.000 1.323 2509 H CB -0.263 29.502 29.762 0.005 0.000 1.381 2509 H HN 0.371 nan 8.280 nan 0.000 0.498 2510 A N -0.594 122.279 122.820 0.088 0.000 1.940 2510 A HA -0.196 4.124 4.320 -0.001 0.000 0.219 2510 A C 2.577 180.144 177.584 -0.028 0.000 1.176 2510 A CA 2.078 54.138 52.037 0.038 0.000 0.631 2510 A CB -1.061 17.985 19.000 0.077 0.000 0.814 2510 A HN 0.521 nan 8.150 nan 0.000 0.446 2511 S N -0.616 115.071 115.700 -0.021 0.000 2.371 2511 S HA -0.077 4.393 4.470 -0.001 0.000 0.219 2511 S C 1.834 176.406 174.600 -0.046 0.000 1.040 2511 S CA 1.036 59.222 58.200 -0.023 0.000 0.958 2511 S CB -0.379 62.818 63.200 -0.006 0.000 0.860 2511 S HN 0.602 nan 8.310 nan 0.000 0.487 2512 N N 1.055 119.723 118.700 -0.055 0.000 2.409 2512 N HA 0.241 4.981 4.740 -0.001 0.000 0.179 2512 N C 1.053 176.505 175.510 -0.098 0.000 1.032 2512 N CA 0.975 53.991 53.050 -0.058 0.000 0.898 2512 N CB 0.160 38.626 38.487 -0.034 0.000 0.971 2512 N HN 0.609 nan 8.380 nan 0.000 0.441 2513 G N 0.603 109.290 108.800 -0.189 0.000 2.342 2513 G HA2 -0.222 3.737 3.960 -0.001 0.000 0.220 2513 G HA3 -0.222 3.737 3.960 -0.001 0.000 0.220 2513 G C 0.151 174.800 174.900 -0.418 0.000 1.243 2513 G CA 0.140 45.088 45.100 -0.253 0.000 1.083 2513 G HN 0.271 nan 8.290 nan 0.000 0.500 2514 N N 0.141 118.702 118.700 -0.232 0.000 2.436 2514 N HA -0.008 4.731 4.740 -0.001 0.000 0.178 2514 N C 1.622 177.149 175.510 0.028 0.000 1.026 2514 N CA 1.428 54.436 53.050 -0.070 0.000 0.880 2514 N CB -0.140 38.363 38.487 0.027 0.000 1.061 2514 N HN 0.837 nan 8.380 nan 0.000 0.434 2515 K N -0.223 120.176 120.400 -0.003 0.000 2.387 2515 K HA 0.324 4.644 4.320 -0.001 0.000 0.198 2515 K C -0.152 176.451 176.600 0.005 0.000 1.022 2515 K CA -0.158 56.135 56.287 0.012 0.000 1.128 2515 K CB 0.039 32.542 32.500 0.005 0.000 0.853 2515 K HN 0.035 nan 8.250 nan 0.000 0.523 2516 C N 1.214 120.509 119.300 -0.008 0.000 2.955 2516 C HA 0.690 5.150 4.460 -0.001 0.000 0.229 2516 C C 0.382 175.374 174.990 0.003 0.000 1.842 2516 C CA -0.489 58.525 59.018 -0.008 0.000 1.539 2516 C CB -0.683 27.040 27.740 -0.027 0.000 2.869 2516 C HN 0.654 nan 8.230 nan 0.000 0.503 2517 A N 0.042 122.885 122.820 0.039 0.000 5.810 2517 A HA 0.946 5.266 4.320 -0.001 0.000 0.151 2517 A C 0.148 177.779 177.584 0.080 0.000 0.903 2517 A CA 0.404 52.483 52.037 0.070 0.000 1.207 2517 A CB -0.378 18.683 19.000 0.102 0.000 2.339 2517 A HN 1.963 nan 8.150 nan 0.000 1.102 2518 G N -1.856 107.006 108.800 0.103 0.000 2.787 2518 G HA2 0.367 4.326 3.960 -0.001 0.000 0.685 2518 G HA3 0.367 4.326 3.960 -0.001 0.000 0.685 2518 G C -0.756 174.172 174.900 0.047 0.000 1.437 2518 G CA -0.011 45.129 45.100 0.066 0.000 0.872 2518 G HN 2.036 nan 8.290 nan 0.000 0.566 2519 L N 0.697 121.938 121.223 0.030 0.000 2.289 2519 L HA 0.743 5.082 4.340 -0.001 0.000 0.285 2519 L C 0.200 177.092 176.870 0.037 0.000 1.049 2519 L CA -0.997 53.858 54.840 0.024 0.000 0.804 2519 L CB 1.537 43.598 42.059 0.003 0.000 1.195 2519 L HN 0.747 nan 8.230 nan 0.000 0.428 2520 N N 3.002 121.733 118.700 0.051 0.000 2.501 2520 N HA 0.222 4.961 4.740 -0.001 0.000 0.245 2520 N C 0.808 176.356 175.510 0.064 0.000 0.974 2520 N CA -0.270 52.836 53.050 0.094 0.000 0.941 2520 N CB 1.198 39.755 38.487 0.117 0.000 1.122 2520 N HN 0.510 nan 8.380 nan 0.000 0.507 2521 V N 1.623 121.538 119.914 0.001 0.000 2.913 2521 V HA -0.012 4.108 4.120 -0.001 0.000 0.260 2521 V C 1.404 177.405 176.094 -0.154 0.000 1.098 2521 V CA 1.234 63.464 62.300 -0.116 0.000 1.121 2521 V CB -1.200 30.488 31.823 -0.227 0.000 0.714 2521 V HN 0.473 nan 8.190 nan 0.000 0.487 2522 F N 2.525 122.473 119.950 -0.003 0.000 2.259 2522 F HA -0.042 4.485 4.527 -0.000 0.000 0.298 2522 F C 2.675 178.474 175.800 -0.001 0.000 1.088 2522 F CA 1.850 59.849 58.000 -0.002 0.000 1.358 2522 F CB -0.367 38.632 39.000 -0.001 0.000 1.040 2522 F HN 0.380 nan 8.300 nan 0.000 0.505 2523 T N -4.039 110.617 114.554 0.171 0.000 3.022 2523 T HA 0.361 4.711 4.350 -0.001 0.000 0.250 2523 T C 1.547 176.276 174.700 0.049 0.000 1.060 2523 T CA 0.422 62.578 62.100 0.093 0.000 1.013 2523 T CB 0.268 69.182 68.868 0.077 0.000 0.982 2523 T HN 0.355 nan 8.240 nan 0.000 0.508 2524 G N 1.084 109.903 108.800 0.033 0.000 2.225 2524 G HA2 0.230 4.190 3.960 -0.001 0.000 0.264 2524 G HA3 0.230 4.190 3.960 -0.001 0.000 0.264 2524 G C 0.099 175.006 174.900 0.010 0.000 1.060 2524 G CA -0.182 44.922 45.100 0.006 0.000 0.833 2524 G HN 1.435 nan 8.290 nan 0.000 0.498 2525 A N -1.841 120.991 122.820 0.021 0.000 2.608 2525 A HA 0.869 5.189 4.320 -0.001 0.000 0.292 2525 A C 0.032 177.632 177.584 0.027 0.000 1.066 2525 A CA 0.149 52.199 52.037 0.020 0.000 0.676 2525 A CB 1.350 20.363 19.000 0.022 0.000 1.277 2525 A HN 1.779 nan 8.150 nan 0.000 0.413 2526 V N 1.618 121.546 119.914 0.024 0.000 2.673 2526 V HA 0.394 4.514 4.120 -0.001 0.000 0.303 2526 V C 0.010 176.124 176.094 0.032 0.000 1.046 2526 V CA 0.965 63.282 62.300 0.029 0.000 1.126 2526 V CB 0.479 32.319 31.823 0.029 0.000 0.934 2526 V HN 0.917 nan 8.190 nan 0.000 0.487 2527 E N 3.805 124.027 120.200 0.038 0.000 2.359 2527 E HA 0.388 4.738 4.350 -0.001 0.000 0.223 2527 E C -1.405 175.215 176.600 0.034 0.000 0.877 2527 E CA -0.679 55.742 56.400 0.035 0.000 0.887 2527 E CB 0.726 30.450 29.700 0.041 0.000 1.890 2527 E HN 0.704 nan 8.360 nan 0.000 0.419 2528 D N 1.262 121.679 120.400 0.028 0.000 2.472 2528 D HA 0.180 4.820 4.640 -0.001 0.000 0.234 2528 D C 0.840 177.156 176.300 0.027 0.000 1.088 2528 D CA -0.279 53.736 54.000 0.025 0.000 0.882 2528 D CB 0.646 41.455 40.800 0.015 0.000 1.037 2528 D HN 0.188 nan 8.370 nan 0.000 0.520 2529 M N 1.659 121.281 119.600 0.036 0.000 2.159 2529 M HA -0.143 4.337 4.480 -0.001 0.000 0.263 2529 M C 2.321 178.636 176.300 0.025 0.000 1.063 2529 M CA 0.784 56.106 55.300 0.037 0.000 1.110 2529 M CB -1.142 31.485 32.600 0.045 0.000 1.374 2529 M HN 0.530 nan 8.290 nan 0.000 0.411 2530 C N 0.641 119.954 119.300 0.022 0.000 2.432 2530 C HA -0.169 4.290 4.460 -0.001 0.000 0.277 2530 C C 2.705 177.700 174.990 0.007 0.000 1.249 2530 C CA 1.406 60.433 59.018 0.014 0.000 1.725 2530 C CB -0.921 26.827 27.740 0.014 0.000 2.028 2530 C HN 0.636 nan 8.230 nan 0.000 0.477 2531 E N 0.030 120.234 120.200 0.007 0.000 2.110 2531 E HA -0.173 4.176 4.350 -0.001 0.000 0.193 2531 E C 1.378 177.976 176.600 -0.003 0.000 0.988 2531 E CA 1.164 57.565 56.400 0.001 0.000 0.804 2531 E CB -0.182 29.519 29.700 0.002 0.000 0.745 2531 E HN 0.654 nan 8.360 nan 0.000 0.458 2532 N N -0.373 118.327 118.700 -0.001 0.000 2.398 2532 N HA 0.004 4.743 4.740 -0.001 0.000 0.188 2532 N C 0.759 176.257 175.510 -0.019 0.000 1.122 2532 N CA 0.905 53.948 53.050 -0.012 0.000 0.866 2532 N CB 0.979 39.463 38.487 -0.005 0.000 0.970 2532 N HN 0.332 nan 8.380 nan 0.000 0.462 2533 G N 0.469 109.264 108.800 -0.009 0.000 2.153 2533 G HA2 -0.263 3.697 3.960 -0.001 0.000 0.252 2533 G HA3 -0.263 3.697 3.960 -0.001 0.000 0.252 2533 G C 0.048 174.947 174.900 -0.002 0.000 0.994 2533 G CA 0.097 45.191 45.100 -0.009 0.000 0.698 2533 G HN 0.204 nan 8.290 nan 0.000 0.521 2534 V N 1.493 121.413 119.914 0.010 0.000 2.222 2534 V HA 0.495 4.615 4.120 -0.001 0.000 0.253 2534 V C 0.767 176.878 176.094 0.029 0.000 1.210 2534 V CA 0.161 62.477 62.300 0.028 0.000 1.079 2534 V CB 0.413 32.267 31.823 0.052 0.000 1.265 2534 V HN 1.065 nan 8.190 nan 0.000 0.494 2535 V N 1.482 121.409 119.914 0.021 0.000 3.007 2535 V HA 0.894 5.014 4.120 -0.001 0.000 0.311 2535 V C -0.716 175.388 176.094 0.017 0.000 1.120 2535 V CA -0.758 61.553 62.300 0.019 0.000 0.980 2535 V CB 2.560 34.392 31.823 0.015 0.000 1.033 2535 V HN 0.637 nan 8.190 nan 0.000 0.429 2536 E N 1.915 122.124 120.200 0.016 0.000 2.369 2536 E HA 0.660 5.009 4.350 -0.001 0.000 0.270 2536 E C -3.241 173.365 176.600 0.010 0.000 0.909 2536 E CA -2.406 54.001 56.400 0.013 0.000 0.775 2536 E CB 2.153 31.860 29.700 0.012 0.000 1.270 2536 E HN 0.467 nan 8.360 nan 0.000 0.445 2537 P HA -0.007 nan 4.420 nan 0.000 0.268 2537 P C 0.865 178.169 177.300 0.006 0.000 1.205 2537 P CA -0.349 62.755 63.100 0.007 0.000 0.771 2537 P CB 0.478 32.181 31.700 0.006 0.000 0.858 2538 L N 4.534 125.760 121.223 0.006 0.000 2.042 2538 L HA -0.194 4.145 4.340 -0.001 0.000 0.210 2538 L C 2.199 179.072 176.870 0.005 0.000 1.076 2538 L CA 1.895 56.738 54.840 0.006 0.000 0.749 2538 L CB -0.697 41.365 42.059 0.006 0.000 0.893 2538 L HN 0.272 nan 8.230 nan 0.000 0.432 2539 R N -1.198 119.304 120.500 0.004 0.000 2.117 2539 R HA -0.164 4.176 4.340 -0.001 0.000 0.243 2539 R C 2.117 178.419 176.300 0.003 0.000 1.143 2539 R CA 1.613 57.715 56.100 0.004 0.000 0.968 2539 R CB -0.723 29.579 30.300 0.003 0.000 0.863 2539 R HN 0.346 nan 8.270 nan 0.000 0.444 2540 V N 1.324 121.239 119.914 0.003 0.000 2.261 2540 V HA -0.240 3.879 4.120 -0.001 0.000 0.246 2540 V C 2.225 178.319 176.094 0.000 0.000 1.047 2540 V CA 1.685 63.986 62.300 0.002 0.000 1.015 2540 V CB -0.299 31.526 31.823 0.002 0.000 0.642 2540 V HN 0.217 nan 8.190 nan 0.000 0.446 2541 K N -0.342 120.058 120.400 0.000 0.000 2.167 2541 K HA -0.010 4.310 4.320 -0.001 0.000 0.203 2541 K C 2.175 178.775 176.600 0.001 0.000 1.052 2541 K CA 1.266 57.551 56.287 -0.003 0.000 0.956 2541 K CB -0.562 31.936 32.500 -0.003 0.000 0.735 2541 K HN 0.482 nan 8.250 nan 0.000 0.451 2542 T N 1.256 115.813 114.554 0.004 0.000 2.812 2542 T HA -0.128 4.222 4.350 -0.001 0.000 0.264 2542 T C 1.900 176.606 174.700 0.010 0.000 1.042 2542 T CA 1.214 63.318 62.100 0.007 0.000 1.140 2542 T CB -0.005 68.866 68.868 0.005 0.000 0.870 2542 T HN 0.129 nan 8.240 nan 0.000 0.445 2543 Q N 1.253 121.057 119.800 0.007 0.000 2.123 2543 Q HA 0.158 4.498 4.340 -0.001 0.000 0.199 2543 Q C 2.269 178.274 176.000 0.009 0.000 0.966 2543 Q CA 1.503 57.311 55.803 0.008 0.000 0.845 2543 Q CB -0.619 28.122 28.738 0.006 0.000 0.907 2543 Q HN 0.476 nan 8.270 nan 0.000 0.439 2544 A N 0.505 123.327 122.820 0.003 0.000 1.858 2544 A HA -0.159 4.160 4.320 -0.001 0.000 0.216 2544 A C 1.934 179.517 177.584 -0.000 0.000 1.190 2544 A CA 1.614 53.649 52.037 -0.003 0.000 0.617 2544 A CB -0.712 18.282 19.000 -0.011 0.000 0.827 2544 A HN 0.443 nan 8.150 nan 0.000 0.443 2545 I N -0.121 120.454 120.570 0.008 0.000 2.252 2545 I HA -0.223 3.947 4.170 -0.001 0.000 0.245 2545 I C 2.649 178.807 176.117 0.068 0.000 1.102 2545 I CA 1.770 63.087 61.300 0.030 0.000 1.385 2545 I CB -1.482 36.548 38.000 0.050 0.000 1.064 2545 I HN 0.594 nan 8.210 nan 0.000 0.414 2546 Q N 0.881 120.712 119.800 0.051 0.000 2.002 2546 Q HA -0.205 4.135 4.340 -0.001 0.000 0.204 2546 Q C 2.385 178.414 176.000 0.048 0.000 0.988 2546 Q CA 2.725 58.557 55.803 0.049 0.000 0.843 2546 Q CB 0.091 28.846 28.738 0.027 0.000 0.908 2546 Q HN 0.360 nan 8.270 nan 0.000 0.420 2547 S N 0.286 116.006 115.700 0.032 0.000 2.368 2547 S HA -0.102 4.368 4.470 -0.001 0.000 0.224 2547 S C 1.937 176.556 174.600 0.032 0.000 1.029 2547 S CA 0.884 59.100 58.200 0.028 0.000 0.988 2547 S CB -0.339 62.871 63.200 0.017 0.000 0.838 2547 S HN 0.571 nan 8.310 nan 0.000 0.462 2548 A N 1.672 124.507 122.820 0.025 0.000 1.877 2548 A HA 0.078 4.398 4.320 -0.001 0.000 0.216 2548 A C 2.359 179.967 177.584 0.040 0.000 1.186 2548 A CA 1.756 53.801 52.037 0.013 0.000 0.620 2548 A CB -1.127 17.862 19.000 -0.018 0.000 0.822 2548 A HN 0.516 nan 8.150 nan 0.000 0.443 2549 A N -0.589 122.284 122.820 0.089 0.000 1.930 2549 A HA -0.118 4.202 4.320 -0.001 0.000 0.217 2549 A C 1.976 179.652 177.584 0.153 0.000 1.175 2549 A CA 2.110 54.256 52.037 0.183 0.000 0.627 2549 A CB -0.419 18.775 19.000 0.323 0.000 0.815 2549 A HN 0.543 nan 8.150 nan 0.000 0.443 2550 E N -0.152 120.109 120.200 0.101 0.000 2.072 2550 E HA -0.112 4.238 4.350 -0.001 0.000 0.190 2550 E C 2.221 178.863 176.600 0.070 0.000 0.982 2550 E CA 1.449 57.896 56.400 0.079 0.000 0.803 2550 E CB -0.341 29.390 29.700 0.053 0.000 0.755 2550 E HN 0.461 nan 8.360 nan 0.000 0.453 2551 S N -1.278 114.456 115.700 0.057 0.000 2.383 2551 S HA -0.112 4.358 4.470 -0.001 0.000 0.227 2551 S C 1.885 176.518 174.600 0.054 0.000 1.026 2551 S CA 1.658 59.885 58.200 0.044 0.000 0.981 2551 S CB -0.543 62.675 63.200 0.029 0.000 0.818 2551 S HN 0.407 nan 8.310 nan 0.000 0.472 2552 T N 1.732 116.328 114.554 0.071 0.000 2.652 2552 T HA -0.124 4.225 4.350 -0.001 0.000 0.267 2552 T C 1.761 176.541 174.700 0.133 0.000 1.039 2552 T CA 1.649 63.806 62.100 0.094 0.000 1.153 2552 T CB -0.482 68.451 68.868 0.107 0.000 0.863 2552 T HN 0.587 nan 8.240 nan 0.000 0.428 2553 E N 0.583 120.883 120.200 0.166 0.000 2.085 2553 E HA -0.172 4.177 4.350 -0.001 0.000 0.194 2553 E C 2.253 178.899 176.600 0.077 0.000 0.994 2553 E CA 1.071 57.556 56.400 0.142 0.000 0.801 2553 E CB -0.234 29.550 29.700 0.141 0.000 0.743 2553 E HN 0.458 nan 8.360 nan 0.000 0.453 2554 M N 0.239 119.878 119.600 0.064 0.000 2.082 2554 M HA -0.243 4.237 4.480 -0.001 0.000 0.258 2554 M C 1.952 178.273 176.300 0.035 0.000 1.069 2554 M CA 1.424 56.750 55.300 0.043 0.000 1.102 2554 M CB -0.051 32.572 32.600 0.037 0.000 1.336 2554 M HN 0.178 nan 8.290 nan 0.000 0.404 2555 L N 0.392 121.637 121.223 0.036 0.000 2.083 2555 L HA -0.155 4.185 4.340 -0.001 0.000 0.209 2555 L C 2.144 179.025 176.870 0.019 0.000 1.083 2555 L CA 1.657 56.511 54.840 0.022 0.000 0.752 2555 L CB -0.920 41.149 42.059 0.017 0.000 0.899 2555 L HN 0.402 nan 8.230 nan 0.000 0.433 2556 L N -1.584 119.659 121.223 0.034 0.000 2.395 2556 L HA -0.099 4.241 4.340 -0.001 0.000 0.218 2556 L C 2.490 179.364 176.870 0.008 0.000 1.130 2556 L CA 0.429 55.280 54.840 0.019 0.000 0.826 2556 L CB -0.361 41.714 42.059 0.028 0.000 0.941 2556 L HN 0.206 nan 8.230 nan 0.000 0.451 2557 R N 0.015 120.526 120.500 0.018 0.000 2.115 2557 R HA -0.026 4.314 4.340 -0.001 0.000 0.230 2557 R C 0.274 176.583 176.300 0.016 0.000 1.111 2557 R CA 0.619 56.729 56.100 0.017 0.000 0.976 2557 R CB -0.150 30.164 30.300 0.023 0.000 0.870 2557 R HN 0.140 nan 8.270 nan 0.000 0.445 2558 I N 2.166 122.745 120.570 0.015 0.000 2.496 2558 I HA -0.063 4.107 4.170 -0.001 0.000 0.285 2558 I C 0.657 176.783 176.117 0.015 0.000 1.080 2558 I CA 0.239 61.550 61.300 0.018 0.000 1.404 2558 I CB 1.158 39.169 38.000 0.019 0.000 1.403 2558 I HN 0.140 nan 8.210 nan 0.000 0.539 2559 D N 2.277 122.689 120.400 0.020 0.000 2.469 2559 D HA 0.175 4.815 4.640 -0.001 0.000 0.213 2559 D C -0.310 176.011 176.300 0.035 0.000 1.135 2559 D CA -0.006 54.006 54.000 0.019 0.000 0.834 2559 D CB 0.320 41.128 40.800 0.013 0.000 1.009 2559 D HN 0.358 nan 8.370 nan 0.000 0.507 2560 D N -0.283 120.144 120.400 0.044 0.000 2.812 2560 D HA 0.218 4.857 4.640 -0.001 0.000 0.210 2560 D C -1.672 174.667 176.300 0.064 0.000 1.260 2560 D CA -0.512 53.521 54.000 0.056 0.000 0.817 2560 D CB 2.194 43.017 40.800 0.040 0.000 1.694 2560 D HN -0.183 nan 8.370 nan 0.000 0.530 2561 V N 4.071 124.042 119.914 0.094 0.000 2.384 2561 V HA 0.544 4.663 4.120 -0.001 0.000 0.287 2561 V C 0.045 176.187 176.094 0.079 0.000 1.020 2561 V CA -0.588 61.772 62.300 0.100 0.000 0.850 2561 V CB 1.216 33.138 31.823 0.166 0.000 0.987 2561 V HN 0.415 nan 8.190 nan 0.000 0.436 2562 I N 4.509 125.113 120.570 0.056 0.000 2.355 2562 I HA 0.671 4.841 4.170 -0.001 0.000 0.288 2562 I C 0.431 176.571 176.117 0.038 0.000 0.999 2562 I CA -0.106 61.218 61.300 0.040 0.000 1.163 2562 I CB 1.747 39.764 38.000 0.028 0.000 1.316 2562 I HN 0.652 nan 8.210 nan 0.000 0.454 2563 A N 5.116 127.957 122.820 0.035 0.000 2.276 2563 A HA 0.884 5.203 4.320 -0.001 0.000 0.316 2563 A C 0.168 177.763 177.584 0.018 0.000 1.229 2563 A CA -0.568 51.486 52.037 0.029 0.000 0.851 2563 A CB 0.693 19.713 19.000 0.034 0.000 1.165 2563 A HN 0.780 nan 8.150 nan 0.000 0.513 2564 A N 1.973 124.802 122.820 0.015 0.000 2.371 2564 A HA 0.474 4.794 4.320 -0.001 0.000 0.257 2564 A C 0.593 178.182 177.584 0.008 0.000 1.089 2564 A CA -0.156 51.887 52.037 0.010 0.000 0.794 2564 A CB 0.086 19.092 19.000 0.010 0.000 1.029 2564 A HN 0.951 nan 8.150 nan 0.000 0.488 2565 E N 0.000 120.203 120.200 0.005 0.000 2.725 2565 E HA 0.000 4.350 4.350 -0.001 0.000 0.291 2565 E CA 0.000 56.402 56.400 0.003 0.000 0.976 2565 E CB 0.000 29.701 29.700 0.002 0.000 0.812 2565 E HN 0.000 nan 8.360 nan 0.000 0.440