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 3nbn_1_E DATA FIRST_RESID 1924 DATA SEQUENCE QTDRTGETAL HLAARYSRSD AAKRLLEASA DANIQDNMGR TPLHAAVSAD DATA SEQUENCE AQGVFQILIR NRATDLDARM HDGTTPLILA ARLAVEGMLE DLINSHADVN DATA SEQUENCE AVDDLGKSAL HWAAAVNNVD AAVVLLKNGA NKDMQNNREE TPLFLAAREG DATA SEQUENCE SYETAKVLLD HFANRDITDH MDRLPRDIAQ ERMHHDIVRL LDEYNL 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 1924 Q HA 0.000 nan 4.340 nan 0.000 0.214 1924 Q C 0.000 176.002 176.000 0.003 0.000 1.003 1924 Q CA 0.000 55.813 55.803 0.016 0.000 1.022 1924 Q CB 0.000 28.748 28.738 0.017 0.000 1.108 1925 T N 1.726 116.276 114.554 -0.007 0.000 3.155 1925 T HA -0.098 4.252 4.350 0.000 0.000 0.264 1925 T C 0.718 175.411 174.700 -0.012 0.000 1.160 1925 T CA 1.120 63.212 62.100 -0.014 0.000 1.075 1925 T CB -0.466 68.387 68.868 -0.026 0.000 0.921 1925 T HN 0.869 nan 8.240 nan 0.000 0.533 1926 D N 0.700 121.094 120.400 -0.010 0.000 3.033 1926 D HA -0.346 4.294 4.640 0.000 0.000 0.214 1926 D C 1.078 177.372 176.300 -0.010 0.000 1.173 1926 D CA 1.781 55.776 54.000 -0.007 0.000 0.930 1926 D CB -1.081 39.718 40.800 -0.002 0.000 1.092 1926 D HN 0.382 nan 8.370 nan 0.000 0.384 1927 R N 0.425 120.917 120.500 -0.015 0.000 2.062 1927 R HA -0.007 4.333 4.340 0.000 0.000 0.231 1927 R C 2.246 178.534 176.300 -0.020 0.000 1.136 1927 R CA 2.927 59.018 56.100 -0.015 0.000 0.948 1927 R CB -0.827 29.464 30.300 -0.016 0.000 0.845 1927 R HN 0.623 nan 8.270 nan 0.000 0.430 1928 T N -5.056 109.479 114.554 -0.033 0.000 3.003 1928 T HA 0.321 4.671 4.350 0.000 0.000 0.261 1928 T C 1.133 175.793 174.700 -0.067 0.000 1.003 1928 T CA 0.236 62.307 62.100 -0.049 0.000 0.917 1928 T CB 0.684 69.514 68.868 -0.063 0.000 1.084 1928 T HN 0.412 nan 8.240 nan 0.000 0.522 1929 G N 1.266 110.035 108.800 -0.053 0.000 2.143 1929 G HA2 -0.231 3.729 3.960 0.000 0.000 0.249 1929 G HA3 -0.231 3.729 3.960 0.000 0.000 0.249 1929 G C -0.250 174.600 174.900 -0.083 0.000 0.981 1929 G CA 0.093 45.163 45.100 -0.049 0.000 0.665 1929 G HN 0.687 nan 8.290 nan 0.000 0.528 1930 E N 0.454 120.590 120.200 -0.107 0.000 2.301 1930 E HA 0.510 4.860 4.350 0.000 0.000 0.275 1930 E C 0.662 177.294 176.600 0.053 0.000 1.030 1930 E CA 0.173 56.489 56.400 -0.141 0.000 0.852 1930 E CB 0.868 30.480 29.700 -0.145 0.000 1.060 1930 E HN 0.156 nan 8.360 nan 0.000 0.401 1931 T N 1.389 116.122 114.554 0.299 0.000 2.862 1931 T HA 0.359 4.709 4.350 0.000 0.000 0.276 1931 T C 1.153 175.912 174.700 0.098 0.000 0.974 1931 T CA 0.189 62.404 62.100 0.191 0.000 0.966 1931 T CB 1.174 70.145 68.868 0.171 0.000 1.072 1931 T HN 0.532 nan 8.240 nan 0.000 0.538 1932 A N 1.991 124.832 122.820 0.034 0.000 1.940 1932 A HA 0.008 4.328 4.320 0.000 0.000 0.219 1932 A C 2.272 179.853 177.584 -0.005 0.000 1.176 1932 A CA 1.167 53.204 52.037 0.001 0.000 0.631 1932 A CB -0.872 18.124 19.000 -0.007 0.000 0.814 1932 A HN 0.713 nan 8.150 nan 0.000 0.446 1933 L N -1.015 120.195 121.223 -0.022 0.000 1.973 1933 L HA -0.163 4.177 4.340 0.000 0.000 0.208 1933 L C 2.352 179.206 176.870 -0.026 0.000 1.073 1933 L CA 2.573 57.381 54.840 -0.055 0.000 0.746 1933 L CB -1.501 40.486 42.059 -0.120 0.000 0.891 1933 L HN 0.590 nan 8.230 nan 0.000 0.433 1934 H N -0.397 118.671 119.070 -0.003 0.000 2.337 1934 H HA -0.301 4.255 4.556 0.000 0.000 0.288 1934 H C 2.284 177.605 175.328 -0.011 0.000 1.117 1934 H CA 2.285 58.334 56.048 0.001 0.000 1.205 1934 H CB -0.169 29.588 29.762 -0.008 0.000 1.353 1934 H HN 0.273 nan 8.280 nan 0.000 0.480 1935 L N -0.401 120.870 121.223 0.081 0.000 1.961 1935 L HA -0.217 4.124 4.340 0.000 0.000 0.210 1935 L C 2.895 179.756 176.870 -0.015 0.000 1.072 1935 L CA 1.007 55.811 54.840 -0.060 0.000 0.749 1935 L CB -0.733 41.230 42.059 -0.160 0.000 0.889 1935 L HN 0.382 nan 8.230 nan 0.000 0.432 1936 A N -0.186 122.638 122.820 0.006 0.000 2.032 1936 A HA -0.232 4.088 4.320 0.000 0.000 0.221 1936 A C 2.433 180.073 177.584 0.093 0.000 1.165 1936 A CA 1.907 53.978 52.037 0.057 0.000 0.645 1936 A CB -0.675 18.344 19.000 0.032 0.000 0.807 1936 A HN 0.507 nan 8.150 nan 0.000 0.453 1937 A N -0.510 122.360 122.820 0.083 0.000 1.841 1937 A HA -0.127 4.193 4.320 0.000 0.000 0.214 1937 A C 2.254 179.915 177.584 0.128 0.000 1.195 1937 A CA 1.591 53.686 52.037 0.097 0.000 0.611 1937 A CB -0.509 18.545 19.000 0.090 0.000 0.835 1937 A HN 0.502 nan 8.150 nan 0.000 0.443 1938 R N -2.216 118.379 120.500 0.158 0.000 2.096 1938 R HA -0.137 4.203 4.340 0.000 0.000 0.235 1938 R C 1.426 177.905 176.300 0.297 0.000 1.127 1938 R CA 1.468 57.689 56.100 0.203 0.000 0.968 1938 R CB -0.261 30.172 30.300 0.222 0.000 0.861 1938 R HN 0.586 nan 8.270 nan 0.000 0.440 1939 Y N -0.287 120.028 120.300 0.025 0.000 2.490 1939 Y HA 0.123 4.673 4.550 0.000 0.000 0.281 1939 Y C 1.104 177.013 175.900 0.016 0.000 1.174 1939 Y CA 0.169 58.279 58.100 0.018 0.000 1.295 1939 Y CB 0.237 38.708 38.460 0.018 0.000 1.062 1939 Y HN -0.006 nan 8.280 nan 0.000 0.522 1940 S N 0.413 116.201 115.700 0.147 0.000 3.635 1940 S HA -0.194 4.276 4.470 0.000 0.000 0.328 1940 S C -0.042 174.604 174.600 0.077 0.000 1.135 1940 S CA 0.084 58.334 58.200 0.083 0.000 0.942 1940 S CB -0.998 62.225 63.200 0.038 0.000 0.930 1940 S HN 0.418 nan 8.310 nan 0.000 0.512 1941 R N 1.664 122.223 120.500 0.099 0.000 2.429 1941 R HA 0.186 4.527 4.340 0.000 0.000 0.302 1941 R C 1.636 177.968 176.300 0.053 0.000 1.268 1941 R CA 0.554 56.699 56.100 0.074 0.000 1.090 1941 R CB 0.203 30.553 30.300 0.083 0.000 1.102 1941 R HN 0.577 nan 8.270 nan 0.000 0.522 1942 S N 1.022 116.748 115.700 0.043 0.000 2.423 1942 S HA -0.148 4.322 4.470 0.000 0.000 0.231 1942 S C 1.205 175.819 174.600 0.023 0.000 1.014 1942 S CA 1.240 59.461 58.200 0.036 0.000 0.965 1942 S CB 0.077 63.298 63.200 0.034 0.000 0.785 1942 S HN 0.621 nan 8.310 nan 0.000 0.495 1943 D N 1.121 121.534 120.400 0.021 0.000 2.392 1943 D HA 0.309 4.949 4.640 0.000 0.000 0.206 1943 D C 1.882 178.189 176.300 0.013 0.000 1.046 1943 D CA 0.681 54.689 54.000 0.013 0.000 0.865 1943 D CB -0.422 40.385 40.800 0.010 0.000 0.969 1943 D HN 0.442 nan 8.370 nan 0.000 0.509 1944 A N 1.515 124.347 122.820 0.020 0.000 1.908 1944 A HA -0.007 4.313 4.320 0.000 0.000 0.218 1944 A C 2.460 180.050 177.584 0.011 0.000 1.181 1944 A CA 2.500 54.547 52.037 0.018 0.000 0.627 1944 A CB -0.952 18.065 19.000 0.028 0.000 0.818 1944 A HN 0.359 nan 8.150 nan 0.000 0.445 1945 A N -0.646 122.182 122.820 0.013 0.000 1.902 1945 A HA -0.163 4.157 4.320 0.000 0.000 0.217 1945 A C 2.112 179.693 177.584 -0.005 0.000 1.181 1945 A CA 1.971 54.011 52.037 0.004 0.000 0.623 1945 A CB -0.450 18.556 19.000 0.009 0.000 0.818 1945 A HN 0.544 nan 8.150 nan 0.000 0.443 1946 K N -0.196 120.202 120.400 -0.002 0.000 2.020 1946 K HA -0.215 4.106 4.320 0.000 0.000 0.212 1946 K C 2.371 178.966 176.600 -0.008 0.000 1.050 1946 K CA 1.774 58.057 56.287 -0.007 0.000 0.929 1946 K CB -0.184 32.313 32.500 -0.005 0.000 0.714 1946 K HN 0.565 nan 8.250 nan 0.000 0.443 1947 R N 0.687 121.184 120.500 -0.005 0.000 2.120 1947 R HA -0.127 4.213 4.340 0.000 0.000 0.234 1947 R C 2.109 178.404 176.300 -0.008 0.000 1.123 1947 R CA 1.092 57.189 56.100 -0.006 0.000 0.975 1947 R CB -0.843 29.456 30.300 -0.003 0.000 0.866 1947 R HN 0.264 nan 8.270 nan 0.000 0.446 1948 L N 0.697 121.914 121.223 -0.010 0.000 2.362 1948 L HA -0.035 4.306 4.340 0.000 0.000 0.219 1948 L C 2.201 179.060 176.870 -0.019 0.000 1.134 1948 L CA 0.784 55.616 54.840 -0.014 0.000 0.807 1948 L CB -0.345 41.704 42.059 -0.016 0.000 0.927 1948 L HN 0.191 nan 8.230 nan 0.000 0.447 1949 L N -0.664 120.548 121.223 -0.019 0.000 2.354 1949 L HA -0.015 4.325 4.340 0.000 0.000 0.212 1949 L C 2.515 179.374 176.870 -0.018 0.000 1.091 1949 L CA 0.800 55.627 54.840 -0.022 0.000 0.828 1949 L CB -0.498 41.546 42.059 -0.025 0.000 0.973 1949 L HN 0.242 nan 8.230 nan 0.000 0.461 1950 E N 1.089 121.281 120.200 -0.014 0.000 2.038 1950 E HA -0.127 4.223 4.350 0.000 0.000 0.195 1950 E C 1.156 177.750 176.600 -0.011 0.000 1.000 1950 E CA 0.766 57.159 56.400 -0.012 0.000 0.803 1950 E CB -0.529 29.165 29.700 -0.009 0.000 0.750 1950 E HN 0.316 nan 8.360 nan 0.000 0.448 1951 A N 1.776 124.589 122.820 -0.010 0.000 2.566 1951 A HA 0.026 4.346 4.320 0.000 0.000 0.245 1951 A C 0.829 178.406 177.584 -0.013 0.000 1.056 1951 A CA 0.266 52.297 52.037 -0.010 0.000 0.757 1951 A CB -0.042 18.952 19.000 -0.010 0.000 0.979 1951 A HN 0.097 nan 8.150 nan 0.000 0.508 1952 S N 2.131 117.824 115.700 -0.011 0.000 3.150 1952 S HA 0.191 4.661 4.470 0.000 0.000 0.252 1952 S C 0.950 175.541 174.600 -0.014 0.000 1.061 1952 S CA 0.406 58.598 58.200 -0.012 0.000 1.201 1952 S CB -1.019 62.175 63.200 -0.010 0.000 0.905 1952 S HN 1.031 nan 8.310 nan 0.000 0.498 1953 A N 1.790 124.600 122.820 -0.017 0.000 2.492 1953 A HA 0.189 4.510 4.320 0.000 0.000 0.254 1953 A C 0.265 177.834 177.584 -0.026 0.000 1.091 1953 A CA -0.485 51.540 52.037 -0.019 0.000 0.768 1953 A CB 0.111 19.098 19.000 -0.022 0.000 1.028 1953 A HN 0.315 nan 8.150 nan 0.000 0.498 1954 D N 2.312 122.698 120.400 -0.024 0.000 2.417 1954 D HA 0.336 4.976 4.640 0.000 0.000 0.250 1954 D C 0.796 177.067 176.300 -0.048 0.000 1.166 1954 D CA 0.946 54.930 54.000 -0.027 0.000 0.881 1954 D CB 0.913 41.705 40.800 -0.014 0.000 1.164 1954 D HN 0.498 nan 8.370 nan 0.000 0.467 1955 A N 4.240 127.028 122.820 -0.054 0.000 2.415 1955 A HA 0.100 4.420 4.320 0.000 0.000 0.248 1955 A C 0.688 178.223 177.584 -0.082 0.000 1.299 1955 A CA -0.243 51.745 52.037 -0.082 0.000 0.899 1955 A CB -0.059 18.899 19.000 -0.069 0.000 0.997 1955 A HN 0.617 nan 8.150 nan 0.000 0.506 1956 N N 0.734 119.403 118.700 -0.051 0.000 2.433 1956 N HA 0.178 4.919 4.740 0.000 0.000 0.270 1956 N C -0.606 174.911 175.510 0.013 0.000 1.354 1956 N CA -0.192 52.846 53.050 -0.019 0.000 0.889 1956 N CB 0.744 39.230 38.487 -0.002 0.000 1.285 1956 N HN 0.224 nan 8.380 nan 0.000 0.503 1957 I N 1.666 122.231 120.570 -0.008 0.000 2.692 1957 I HA 0.020 4.191 4.170 0.000 0.000 0.284 1957 I C 0.918 177.158 176.117 0.205 0.000 1.159 1957 I CA 0.303 61.645 61.300 0.071 0.000 1.423 1957 I CB 0.324 38.361 38.000 0.063 0.000 1.380 1957 I HN -0.056 nan 8.210 nan 0.000 0.580 1958 Q N 4.389 124.301 119.800 0.186 0.000 2.271 1958 Q HA 0.267 4.607 4.340 0.000 0.000 0.258 1958 Q C -0.557 175.489 176.000 0.078 0.000 0.936 1958 Q CA -0.847 55.047 55.803 0.151 0.000 0.909 1958 Q CB 2.044 30.829 28.738 0.078 0.000 1.253 1958 Q HN 0.566 nan 8.270 nan 0.000 0.440 1959 D N 1.172 121.503 120.400 -0.115 0.000 2.478 1959 D HA 0.037 4.678 4.640 0.000 0.000 0.269 1959 D C 0.522 176.750 176.300 -0.120 0.000 1.232 1959 D CA -0.575 53.290 54.000 -0.225 0.000 1.059 1959 D CB 0.447 40.946 40.800 -0.502 0.000 1.104 1959 D HN 0.221 nan 8.370 nan 0.000 0.566 1960 N N -0.604 118.055 118.700 -0.069 0.000 2.443 1960 N HA -0.080 4.660 4.740 0.000 0.000 0.184 1960 N C 1.281 176.833 175.510 0.070 0.000 1.037 1960 N CA 0.682 53.762 53.050 0.050 0.000 0.896 1960 N CB -0.233 38.272 38.487 0.031 0.000 0.959 1960 N HN 0.366 nan 8.380 nan 0.000 0.442 1961 M N -0.620 118.898 119.600 -0.136 0.000 2.506 1961 M HA 0.155 4.635 4.480 0.000 0.000 0.260 1961 M C 0.779 176.607 176.300 -0.787 0.000 1.104 1961 M CA 0.191 55.349 55.300 -0.237 0.000 1.112 1961 M CB -1.032 31.452 32.600 -0.192 0.000 1.401 1961 M HN 0.196 nan 8.290 nan 0.000 0.473 1962 G N 2.894 111.182 108.800 -0.853 0.000 2.341 1962 G HA2 -0.229 3.731 3.960 0.000 0.000 0.278 1962 G HA3 -0.229 3.731 3.960 0.000 0.000 0.278 1962 G C -0.172 174.483 174.900 -0.409 0.000 1.111 1962 G CA -0.013 44.570 45.100 -0.862 0.000 0.982 1962 G HN 0.584 nan 8.290 nan 0.000 0.502 1963 R N -0.644 119.720 120.500 -0.227 0.000 2.561 1963 R HA 0.745 5.085 4.340 0.000 0.000 0.297 1963 R C -0.011 176.501 176.300 0.354 0.000 0.969 1963 R CA -0.368 55.703 56.100 -0.048 0.000 0.879 1963 R CB 1.478 31.645 30.300 -0.223 0.000 1.178 1963 R HN 0.417 nan 8.270 nan 0.000 0.445 1964 T N 1.426 116.275 114.554 0.491 0.000 2.898 1964 T HA 0.165 4.515 4.350 0.000 0.000 0.301 1964 T C -1.559 173.269 174.700 0.214 0.000 1.049 1964 T CA -1.560 60.714 62.100 0.290 0.000 1.095 1964 T CB 0.817 69.748 68.868 0.104 0.000 0.976 1964 T HN 0.361 nan 8.240 nan 0.000 0.539 1965 P HA -0.150 nan 4.420 nan 0.000 0.218 1965 P C 1.681 179.012 177.300 0.052 0.000 1.154 1965 P CA 0.789 63.836 63.100 -0.089 0.000 0.872 1965 P CB -0.093 31.444 31.700 -0.272 0.000 0.790 1966 L N -0.996 120.231 121.223 0.008 0.000 2.021 1966 L HA -0.260 4.080 4.340 0.000 0.000 0.215 1966 L C 2.190 179.089 176.870 0.048 0.000 1.074 1966 L CA 2.075 56.931 54.840 0.025 0.000 0.760 1966 L CB -1.402 40.627 42.059 -0.050 0.000 0.889 1966 L HN 0.076 nan 8.230 nan 0.000 0.433 1967 H N -0.981 118.126 119.070 0.063 0.000 2.352 1967 H HA -0.125 4.431 4.556 0.000 0.000 0.299 1967 H C 2.185 177.530 175.328 0.029 0.000 1.097 1967 H CA 1.432 57.499 56.048 0.032 0.000 1.311 1967 H CB -0.162 29.615 29.762 0.024 0.000 1.377 1967 H HN 0.580 nan 8.280 nan 0.000 0.504 1968 A N 0.881 123.826 122.820 0.209 0.000 1.873 1968 A HA -0.126 4.194 4.320 0.000 0.000 0.215 1968 A C 2.550 180.192 177.584 0.097 0.000 1.186 1968 A CA 1.440 53.565 52.037 0.145 0.000 0.616 1968 A CB -1.151 17.965 19.000 0.193 0.000 0.823 1968 A HN 0.476 nan 8.150 nan 0.000 0.442 1969 A N -0.413 122.468 122.820 0.101 0.000 1.873 1969 A HA -0.092 4.228 4.320 0.000 0.000 0.218 1969 A C 2.258 179.840 177.584 -0.003 0.000 1.193 1969 A CA 2.153 54.241 52.037 0.084 0.000 0.629 1969 A CB -1.178 17.913 19.000 0.152 0.000 0.826 1969 A HN 0.469 nan 8.150 nan 0.000 0.447 1970 V N -0.548 119.341 119.914 -0.042 0.000 2.287 1970 V HA -0.239 3.881 4.120 0.000 0.000 0.248 1970 V C 2.758 178.781 176.094 -0.117 0.000 1.053 1970 V CA 2.362 64.553 62.300 -0.183 0.000 1.027 1970 V CB -1.012 30.720 31.823 -0.152 0.000 0.646 1970 V HN 0.561 nan 8.190 nan 0.000 0.447 1971 S N -0.174 115.501 115.700 -0.041 0.000 2.383 1971 S HA -0.150 4.320 4.470 0.000 0.000 0.229 1971 S C 1.766 176.344 174.600 -0.037 0.000 1.030 1971 S CA 1.442 59.621 58.200 -0.035 0.000 1.002 1971 S CB -0.359 62.839 63.200 -0.004 0.000 0.829 1971 S HN 0.661 nan 8.310 nan 0.000 0.467 1972 A N 0.553 123.361 122.820 -0.020 0.000 2.370 1972 A HA 0.226 4.547 4.320 0.000 0.000 0.238 1972 A C 0.518 178.081 177.584 -0.035 0.000 1.289 1972 A CA 0.022 52.052 52.037 -0.011 0.000 0.885 1972 A CB -0.286 18.734 19.000 0.032 0.000 0.961 1972 A HN 0.345 nan 8.150 nan 0.000 0.499 1973 D N -0.318 120.039 120.400 -0.072 0.000 2.781 1973 D HA -0.218 4.422 4.640 0.000 0.000 0.221 1973 D C 0.353 176.616 176.300 -0.061 0.000 1.224 1973 D CA 1.002 54.944 54.000 -0.096 0.000 0.625 1973 D CB -1.056 39.698 40.800 -0.077 0.000 0.987 1973 D HN 0.565 nan 8.370 nan 0.000 0.402 1974 A N 1.553 124.349 122.820 -0.039 0.000 3.016 1974 A HA 0.300 4.620 4.320 0.000 0.000 0.303 1974 A C 1.397 179.025 177.584 0.072 0.000 1.507 1974 A CA 0.012 52.061 52.037 0.021 0.000 1.196 1974 A CB 0.564 19.595 19.000 0.050 0.000 1.169 1974 A HN 0.288 nan 8.150 nan 0.000 0.544 1975 Q N 1.889 121.727 119.800 0.063 0.000 2.135 1975 Q HA -0.134 4.206 4.340 0.000 0.000 0.204 1975 Q C 1.884 177.992 176.000 0.181 0.000 0.981 1975 Q CA 2.607 58.503 55.803 0.154 0.000 0.856 1975 Q CB -0.385 28.416 28.738 0.105 0.000 0.902 1975 Q HN 0.739 nan 8.270 nan 0.000 0.425 1976 G N -0.254 108.608 108.800 0.103 0.000 2.628 1976 G HA2 -0.311 3.649 3.960 0.000 0.000 0.217 1976 G HA3 -0.311 3.649 3.960 0.000 0.000 0.217 1976 G C 1.396 176.344 174.900 0.080 0.000 1.240 1976 G CA 1.725 46.869 45.100 0.074 0.000 0.792 1976 G HN 0.323 nan 8.290 nan 0.000 0.593 1977 V N 0.850 120.819 119.914 0.092 0.000 2.261 1977 V HA -0.131 3.989 4.120 0.000 0.000 0.246 1977 V C 2.305 178.466 176.094 0.111 0.000 1.047 1977 V CA 1.896 64.246 62.300 0.083 0.000 1.015 1977 V CB -0.954 30.920 31.823 0.086 0.000 0.642 1977 V HN 0.328 nan 8.190 nan 0.000 0.446 1978 F N 1.462 121.406 119.950 -0.009 0.000 2.088 1978 F HA -0.358 4.169 4.527 0.000 0.000 0.296 1978 F C 2.636 178.423 175.800 -0.021 0.000 1.161 1978 F CA 2.457 60.446 58.000 -0.018 0.000 1.236 1978 F CB -0.999 37.991 39.000 -0.016 0.000 0.936 1978 F HN 0.097 nan 8.300 nan 0.000 0.528 1979 Q N 0.111 119.783 119.800 -0.213 0.000 2.207 1979 Q HA -0.262 4.078 4.340 0.000 0.000 0.215 1979 Q C 2.160 178.041 176.000 -0.199 0.000 1.006 1979 Q CA 2.337 57.977 55.803 -0.271 0.000 0.903 1979 Q CB -1.073 27.620 28.738 -0.075 0.000 0.947 1979 Q HN 0.529 nan 8.270 nan 0.000 0.414 1980 I N 0.100 120.608 120.570 -0.103 0.000 2.076 1980 I HA -0.276 3.895 4.170 0.000 0.000 0.237 1980 I C 2.390 178.440 176.117 -0.111 0.000 1.059 1980 I CA 1.181 62.433 61.300 -0.080 0.000 1.317 1980 I CB -1.254 36.724 38.000 -0.036 0.000 1.037 1980 I HN 0.139 nan 8.210 nan 0.000 0.398 1981 L N -0.084 121.073 121.223 -0.110 0.000 2.083 1981 L HA -0.174 4.166 4.340 0.000 0.000 0.209 1981 L C 2.461 179.244 176.870 -0.146 0.000 1.083 1981 L CA 1.492 56.270 54.840 -0.103 0.000 0.752 1981 L CB -0.793 41.227 42.059 -0.064 0.000 0.899 1981 L HN 0.294 nan 8.230 nan 0.000 0.433 1982 I N -0.787 119.629 120.570 -0.257 0.000 2.500 1982 I HA -0.190 3.980 4.170 0.000 0.000 0.252 1982 I C 2.595 178.600 176.117 -0.186 0.000 1.142 1982 I CA 1.078 62.216 61.300 -0.271 0.000 1.451 1982 I CB -0.093 37.607 38.000 -0.501 0.000 1.093 1982 I HN 0.226 nan 8.210 nan 0.000 0.430 1983 R N 1.075 121.470 120.500 -0.175 0.000 2.189 1983 R HA -0.079 4.261 4.340 0.000 0.000 0.218 1983 R C 0.726 176.979 176.300 -0.079 0.000 1.074 1983 R CA 0.396 56.428 56.100 -0.113 0.000 0.991 1983 R CB -0.544 29.696 30.300 -0.101 0.000 0.883 1983 R HN 0.491 nan 8.270 nan 0.000 0.457 1984 N N 1.069 119.720 118.700 -0.080 0.000 2.488 1984 N HA -0.040 4.700 4.740 0.000 0.000 0.274 1984 N C 1.042 176.522 175.510 -0.050 0.000 1.111 1984 N CA -0.179 52.836 53.050 -0.058 0.000 0.974 1984 N CB 0.956 39.409 38.487 -0.056 0.000 1.089 1984 N HN -0.045 nan 8.380 nan 0.000 0.465 1985 R N 3.619 124.097 120.500 -0.036 0.000 2.115 1985 R HA -0.052 4.288 4.340 0.000 0.000 0.226 1985 R C 1.514 177.799 176.300 -0.026 0.000 1.100 1985 R CA 1.300 57.383 56.100 -0.028 0.000 0.980 1985 R CB -0.349 29.939 30.300 -0.021 0.000 0.875 1985 R HN 0.715 nan 8.270 nan 0.000 0.445 1986 A N 0.905 123.709 122.820 -0.027 0.000 1.908 1986 A HA -0.068 4.252 4.320 0.000 0.000 0.218 1986 A C 0.957 178.526 177.584 -0.025 0.000 1.181 1986 A CA 1.590 53.613 52.037 -0.023 0.000 0.627 1986 A CB -0.825 18.161 19.000 -0.024 0.000 0.818 1986 A HN 0.412 nan 8.150 nan 0.000 0.445 1987 T N 2.112 116.645 114.554 -0.035 0.000 2.792 1987 T HA 0.148 4.498 4.350 0.000 0.000 0.286 1987 T C -0.132 174.547 174.700 -0.035 0.000 0.970 1987 T CA 0.094 62.169 62.100 -0.041 0.000 1.187 1987 T CB 0.190 69.024 68.868 -0.057 0.000 0.915 1987 T HN 0.352 nan 8.240 nan 0.000 0.529 1988 D N 3.246 123.630 120.400 -0.028 0.000 2.363 1988 D HA 0.009 4.649 4.640 0.000 0.000 0.263 1988 D C 0.987 177.264 176.300 -0.038 0.000 1.258 1988 D CA -0.163 53.825 54.000 -0.020 0.000 0.907 1988 D CB 0.361 41.159 40.800 -0.004 0.000 1.107 1988 D HN 0.478 nan 8.370 nan 0.000 0.495 1989 L N 2.523 123.729 121.223 -0.029 0.000 2.478 1989 L HA 0.037 4.377 4.340 0.000 0.000 0.223 1989 L C 0.845 177.696 176.870 -0.030 0.000 1.140 1989 L CA 0.548 55.367 54.840 -0.035 0.000 0.842 1989 L CB 0.113 42.163 42.059 -0.014 0.000 0.953 1989 L HN 0.324 nan 8.230 nan 0.000 0.452 1990 D N 0.599 120.994 120.400 -0.009 0.000 2.501 1990 D HA 0.210 4.850 4.640 0.000 0.000 0.226 1990 D C 0.684 177.004 176.300 0.033 0.000 1.198 1990 D CA 0.054 54.062 54.000 0.014 0.000 0.830 1990 D CB 0.711 41.529 40.800 0.031 0.000 1.014 1990 D HN 0.072 nan 8.370 nan 0.000 0.496 1991 A N 1.587 124.414 122.820 0.011 0.000 2.498 1991 A HA 0.263 4.583 4.320 0.000 0.000 0.239 1991 A C 0.849 178.554 177.584 0.201 0.000 1.068 1991 A CA -0.050 52.035 52.037 0.080 0.000 0.766 1991 A CB 0.336 19.372 19.000 0.060 0.000 1.003 1991 A HN 0.255 nan 8.150 nan 0.000 0.497 1992 R N 1.918 122.534 120.500 0.193 0.000 2.782 1992 R HA 0.801 5.142 4.340 0.000 0.000 0.258 1992 R C -0.435 175.913 176.300 0.080 0.000 1.055 1992 R CA -0.847 55.355 56.100 0.170 0.000 1.065 1992 R CB 0.955 31.321 30.300 0.109 0.000 1.172 1992 R HN 0.647 nan 8.270 nan 0.000 0.510 1993 M N 0.179 119.746 119.600 -0.055 0.000 2.823 1993 M HA 0.262 4.742 4.480 0.000 0.000 0.282 1993 M C 0.839 177.117 176.300 -0.036 0.000 1.177 1993 M CA -1.056 54.123 55.300 -0.202 0.000 0.871 1993 M CB 0.893 33.286 32.600 -0.344 0.000 1.595 1993 M HN 0.624 nan 8.290 nan 0.000 0.524 1994 H N 0.895 119.935 119.070 -0.049 0.000 2.456 1994 H HA -0.099 4.457 4.556 0.000 0.000 0.296 1994 H C 0.775 176.102 175.328 -0.002 0.000 1.079 1994 H CA 1.431 57.468 56.048 -0.018 0.000 1.322 1994 H CB -0.365 29.385 29.762 -0.020 0.000 1.388 1994 H HN 0.540 nan 8.280 nan 0.000 0.538 1995 D N -1.332 119.127 120.400 0.099 0.000 2.363 1995 D HA 0.115 4.755 4.640 0.000 0.000 0.214 1995 D C 1.202 177.550 176.300 0.080 0.000 1.093 1995 D CA 0.451 54.501 54.000 0.083 0.000 0.837 1995 D CB -0.152 40.692 40.800 0.075 0.000 0.948 1995 D HN 0.279 nan 8.370 nan 0.000 0.507 1996 G N 1.745 110.585 108.800 0.065 0.000 2.295 1996 G HA2 -0.257 3.703 3.960 0.000 0.000 0.287 1996 G HA3 -0.257 3.703 3.960 0.000 0.000 0.287 1996 G C 0.266 175.210 174.900 0.074 0.000 1.055 1996 G CA 0.509 45.653 45.100 0.073 0.000 0.922 1996 G HN 0.567 nan 8.290 nan 0.000 0.503 1997 T N -0.448 114.118 114.554 0.020 0.000 2.817 1997 T HA 0.630 4.980 4.350 0.000 0.000 0.293 1997 T C 0.670 175.454 174.700 0.139 0.000 0.964 1997 T CA 0.137 62.248 62.100 0.017 0.000 1.085 1997 T CB 1.847 70.660 68.868 -0.092 0.000 0.921 1997 T HN 1.102 nan 8.240 nan 0.000 0.502 1998 T N 0.705 115.343 114.554 0.140 0.000 2.913 1998 T HA 0.377 4.727 4.350 0.000 0.000 0.287 1998 T C -1.952 172.823 174.700 0.126 0.000 1.008 1998 T CA -2.032 60.172 62.100 0.174 0.000 1.067 1998 T CB 1.029 69.948 68.868 0.085 0.000 0.996 1998 T HN 0.174 nan 8.240 nan 0.000 0.513 1999 P HA -0.063 nan 4.420 nan 0.000 0.216 1999 P C 1.842 179.131 177.300 -0.018 0.000 1.150 1999 P CA 0.373 63.456 63.100 -0.029 0.000 0.837 1999 P CB -0.008 31.615 31.700 -0.128 0.000 0.786 2000 L N -0.953 120.269 121.223 -0.002 0.000 2.189 2000 L HA -0.176 4.164 4.340 0.000 0.000 0.214 2000 L C 1.863 178.718 176.870 -0.025 0.000 1.097 2000 L CA 1.750 56.592 54.840 0.003 0.000 0.764 2000 L CB -0.747 41.328 42.059 0.027 0.000 0.900 2000 L HN -0.013 nan 8.230 nan 0.000 0.436 2001 I N -0.374 120.163 120.570 -0.054 0.000 2.141 2001 I HA -0.283 3.887 4.170 0.000 0.000 0.236 2001 I C 2.621 178.564 176.117 -0.290 0.000 1.071 2001 I CA 0.985 62.173 61.300 -0.187 0.000 1.345 2001 I CB -1.195 36.652 38.000 -0.255 0.000 1.066 2001 I HN 0.210 nan 8.210 nan 0.000 0.406 2002 L N 1.208 122.287 121.223 -0.241 0.000 1.991 2002 L HA -0.280 4.060 4.340 0.000 0.000 0.221 2002 L C 2.927 179.700 176.870 -0.162 0.000 1.079 2002 L CA 1.912 56.622 54.840 -0.216 0.000 0.778 2002 L CB -1.353 40.636 42.059 -0.116 0.000 0.893 2002 L HN 0.241 nan 8.230 nan 0.000 0.437 2003 A N 0.339 123.084 122.820 -0.124 0.000 1.923 2003 A HA -0.360 3.960 4.320 0.000 0.000 0.222 2003 A C 2.525 180.059 177.584 -0.085 0.000 1.258 2003 A CA 3.038 55.007 52.037 -0.114 0.000 0.670 2003 A CB -1.111 17.839 19.000 -0.084 0.000 0.834 2003 A HN 0.527 nan 8.150 nan 0.000 0.470 2004 A N -0.141 122.638 122.820 -0.068 0.000 1.930 2004 A HA -0.130 4.190 4.320 0.000 0.000 0.217 2004 A C 2.257 179.837 177.584 -0.006 0.000 1.175 2004 A CA 1.880 53.907 52.037 -0.016 0.000 0.627 2004 A CB -0.449 18.572 19.000 0.035 0.000 0.815 2004 A HN 0.787 nan 8.150 nan 0.000 0.443 2005 R N -0.540 119.915 120.500 -0.075 0.000 2.064 2005 R HA 0.200 4.540 4.340 0.000 0.000 0.221 2005 R C 1.476 177.752 176.300 -0.040 0.000 1.136 2005 R CA 0.966 57.047 56.100 -0.031 0.000 0.980 2005 R CB -0.833 29.397 30.300 -0.116 0.000 0.876 2005 R HN 0.337 nan 8.270 nan 0.000 0.437 2006 L N 2.262 123.431 121.223 -0.090 0.000 2.740 2006 L HA 0.025 4.365 4.340 0.000 0.000 0.242 2006 L C 0.518 177.355 176.870 -0.056 0.000 1.175 2006 L CA 0.560 55.357 54.840 -0.072 0.000 0.859 2006 L CB -0.843 41.160 42.059 -0.094 0.000 0.992 2006 L HN 0.489 nan 8.230 nan 0.000 0.454 2007 A N 0.371 123.166 122.820 -0.042 0.000 1.999 2007 A HA -0.125 4.195 4.320 0.000 0.000 0.261 2007 A C 0.397 177.951 177.584 -0.049 0.000 1.316 2007 A CA 0.825 52.842 52.037 -0.033 0.000 0.752 2007 A CB -1.882 17.108 19.000 -0.016 0.000 1.166 2007 A HN 0.337 nan 8.150 nan 0.000 0.311 2008 V N -1.146 118.726 119.914 -0.070 0.000 2.850 2008 V HA 0.746 4.867 4.120 0.000 0.000 0.315 2008 V C 0.346 176.398 176.094 -0.071 0.000 1.064 2008 V CA -1.128 61.120 62.300 -0.086 0.000 0.979 2008 V CB 1.578 33.315 31.823 -0.143 0.000 1.039 2008 V HN 0.589 nan 8.190 nan 0.000 0.452 2009 E N 1.202 121.367 120.200 -0.059 0.000 2.343 2009 E HA 0.480 4.831 4.350 0.000 0.000 0.269 2009 E C 1.192 177.772 176.600 -0.032 0.000 1.047 2009 E CA 0.420 56.799 56.400 -0.035 0.000 0.874 2009 E CB 1.224 30.912 29.700 -0.020 0.000 1.033 2009 E HN 1.281 nan 8.360 nan 0.000 0.409 2010 G N 3.018 111.815 108.800 -0.006 0.000 3.639 2010 G HA2 -0.467 3.493 3.960 0.000 0.000 0.224 2010 G HA3 -0.467 3.493 3.960 0.000 0.000 0.224 2010 G C 1.228 176.158 174.900 0.049 0.000 1.339 2010 G CA 0.838 45.954 45.100 0.027 0.000 0.933 2010 G HN 0.574 nan 8.290 nan 0.000 0.568 2011 M N -0.085 119.510 119.600 -0.008 0.000 2.190 2011 M HA -0.253 4.227 4.480 0.000 0.000 0.252 2011 M C 2.599 178.947 176.300 0.080 0.000 1.076 2011 M CA 2.606 57.879 55.300 -0.045 0.000 1.079 2011 M CB -0.996 31.291 32.600 -0.520 0.000 1.303 2011 M HN 0.477 nan 8.290 nan 0.000 0.412 2012 L N 0.495 121.719 121.223 0.003 0.000 1.978 2012 L HA -0.249 4.092 4.340 0.000 0.000 0.218 2012 L C 2.450 179.347 176.870 0.046 0.000 1.075 2012 L CA 2.048 56.900 54.840 0.021 0.000 0.767 2012 L CB -0.638 41.423 42.059 0.004 0.000 0.890 2012 L HN 0.293 nan 8.230 nan 0.000 0.434 2013 E N -0.475 119.749 120.200 0.040 0.000 2.049 2013 E HA -0.260 4.090 4.350 0.000 0.000 0.198 2013 E C 1.871 178.491 176.600 0.032 0.000 1.007 2013 E CA 1.797 58.214 56.400 0.028 0.000 0.809 2013 E CB -0.305 29.409 29.700 0.024 0.000 0.749 2013 E HN 0.628 nan 8.360 nan 0.000 0.450 2014 D N 0.635 121.085 120.400 0.083 0.000 2.123 2014 D HA -0.151 4.489 4.640 0.000 0.000 0.196 2014 D C 2.143 178.456 176.300 0.022 0.000 0.992 2014 D CA 0.730 54.764 54.000 0.058 0.000 0.833 2014 D CB -0.377 40.495 40.800 0.119 0.000 0.954 2014 D HN 0.161 nan 8.370 nan 0.000 0.455 2015 L N 0.314 121.604 121.223 0.111 0.000 2.046 2015 L HA -0.134 4.206 4.340 0.000 0.000 0.208 2015 L C 2.525 179.389 176.870 -0.010 0.000 1.077 2015 L CA 0.723 55.600 54.840 0.061 0.000 0.747 2015 L CB -0.313 41.818 42.059 0.120 0.000 0.896 2015 L HN 0.034 nan 8.230 nan 0.000 0.432 2016 I N 0.017 120.579 120.570 -0.013 0.000 2.127 2016 I HA -0.336 3.834 4.170 0.000 0.000 0.241 2016 I C 2.279 178.297 176.117 -0.166 0.000 1.075 2016 I CA 1.342 62.610 61.300 -0.053 0.000 1.334 2016 I CB -0.496 37.488 38.000 -0.027 0.000 1.040 2016 I HN 0.371 nan 8.210 nan 0.000 0.405 2017 N N 0.704 119.300 118.700 -0.174 0.000 2.094 2017 N HA -0.156 4.585 4.740 0.000 0.000 0.191 2017 N C 1.750 176.986 175.510 -0.456 0.000 1.023 2017 N CA 1.483 54.359 53.050 -0.291 0.000 0.857 2017 N CB -0.475 37.921 38.487 -0.152 0.000 1.013 2017 N HN 0.200 nan 8.380 nan 0.000 0.426 2018 S N -0.173 115.383 115.700 -0.241 0.000 2.660 2018 S HA -0.021 4.449 4.470 0.000 0.000 0.228 2018 S C -0.574 173.998 174.600 -0.046 0.000 0.966 2018 S CA 0.033 58.151 58.200 -0.137 0.000 0.940 2018 S CB -0.459 62.693 63.200 -0.080 0.000 0.773 2018 S HN 0.457 nan 8.310 nan 0.000 0.535 2019 H N -0.776 118.291 119.070 -0.006 0.000 2.960 2019 H HA -0.122 4.434 4.556 0.000 0.000 0.325 2019 H C 0.187 175.515 175.328 0.001 0.000 1.301 2019 H CA 0.271 56.318 56.048 -0.001 0.000 1.190 2019 H CB -1.997 27.762 29.762 -0.005 0.000 1.462 2019 H HN 0.455 nan 8.280 nan 0.000 0.442 2020 A N 0.579 123.429 122.820 0.051 0.000 2.371 2020 A HA 0.318 4.638 4.320 0.000 0.000 0.257 2020 A C 0.491 178.108 177.584 0.055 0.000 1.089 2020 A CA -0.139 51.925 52.037 0.046 0.000 0.794 2020 A CB 0.499 19.515 19.000 0.028 0.000 1.029 2020 A HN 0.448 nan 8.150 nan 0.000 0.488 2021 D N 1.982 122.414 120.400 0.052 0.000 2.389 2021 D HA 0.019 4.659 4.640 0.000 0.000 0.263 2021 D C 1.311 177.641 176.300 0.050 0.000 1.255 2021 D CA 0.594 54.625 54.000 0.052 0.000 0.914 2021 D CB 0.926 41.755 40.800 0.049 0.000 1.116 2021 D HN 0.402 nan 8.370 nan 0.000 0.502 2022 V N 3.417 123.360 119.914 0.048 0.000 2.719 2022 V HA -0.094 4.026 4.120 0.000 0.000 0.252 2022 V C 0.931 177.055 176.094 0.050 0.000 1.065 2022 V CA 1.221 63.548 62.300 0.045 0.000 1.086 2022 V CB -0.279 31.567 31.823 0.038 0.000 0.700 2022 V HN 0.325 nan 8.190 nan 0.000 0.467 2023 N N 1.440 120.170 118.700 0.049 0.000 2.280 2023 N HA 0.407 5.147 4.740 0.000 0.000 0.192 2023 N C 0.721 176.271 175.510 0.067 0.000 1.109 2023 N CA 0.677 53.757 53.050 0.050 0.000 0.855 2023 N CB 0.033 38.543 38.487 0.038 0.000 0.974 2023 N HN 0.671 nan 8.380 nan 0.000 0.482 2024 A N 0.763 123.625 122.820 0.070 0.000 2.587 2024 A HA 0.273 4.593 4.320 0.000 0.000 0.233 2024 A C 0.459 178.107 177.584 0.107 0.000 1.049 2024 A CA 0.032 52.117 52.037 0.080 0.000 0.754 2024 A CB -0.035 19.010 19.000 0.074 0.000 0.977 2024 A HN 0.156 nan 8.150 nan 0.000 0.509 2025 V N 0.516 120.498 119.914 0.113 0.000 2.823 2025 V HA 0.704 4.824 4.120 0.000 0.000 0.312 2025 V C -0.404 175.776 176.094 0.144 0.000 1.072 2025 V CA -0.831 61.558 62.300 0.147 0.000 0.937 2025 V CB 1.869 33.779 31.823 0.145 0.000 1.013 2025 V HN 0.967 nan 8.190 nan 0.000 0.430 2026 D N 1.492 122.005 120.400 0.188 0.000 2.371 2026 D HA 0.139 4.779 4.640 0.000 0.000 0.242 2026 D C 0.597 176.975 176.300 0.130 0.000 1.218 2026 D CA -0.186 53.917 54.000 0.170 0.000 0.945 2026 D CB 0.430 41.376 40.800 0.244 0.000 1.137 2026 D HN 0.559 nan 8.370 nan 0.000 0.464 2027 D N -0.221 120.244 120.400 0.108 0.000 2.239 2027 D HA -0.151 4.489 4.640 0.000 0.000 0.202 2027 D C 1.497 177.833 176.300 0.059 0.000 0.993 2027 D CA 0.988 55.035 54.000 0.078 0.000 0.874 2027 D CB -0.195 40.648 40.800 0.071 0.000 0.922 2027 D HN 0.271 nan 8.370 nan 0.000 0.464 2028 L N -0.626 120.636 121.223 0.064 0.000 2.591 2028 L HA 0.255 4.595 4.340 0.000 0.000 0.228 2028 L C 1.327 178.187 176.870 -0.015 0.000 1.133 2028 L CA 0.298 55.142 54.840 0.007 0.000 0.880 2028 L CB -0.214 41.834 42.059 -0.018 0.000 1.033 2028 L HN 0.089 nan 8.230 nan 0.000 0.450 2029 G N 0.569 109.395 108.800 0.043 0.000 2.314 2029 G HA2 -0.318 3.642 3.960 0.000 0.000 0.292 2029 G HA3 -0.318 3.642 3.960 0.000 0.000 0.292 2029 G C 0.237 175.181 174.900 0.073 0.000 1.059 2029 G CA 0.133 45.269 45.100 0.061 0.000 0.982 2029 G HN 0.358 nan 8.290 nan 0.000 0.505 2030 K N 0.445 120.916 120.400 0.118 0.000 2.244 2030 K HA 0.567 4.887 4.320 0.000 0.000 0.260 2030 K C 0.682 177.516 176.600 0.390 0.000 0.951 2030 K CA -0.133 56.254 56.287 0.166 0.000 0.826 2030 K CB 1.485 33.892 32.500 -0.155 0.000 1.108 2030 K HN 0.407 nan 8.250 nan 0.000 0.433 2031 S N 1.042 117.035 115.700 0.488 0.000 2.652 2031 S HA 0.287 4.757 4.470 0.000 0.000 0.270 2031 S C 1.252 176.073 174.600 0.369 0.000 1.243 2031 S CA -0.425 57.953 58.200 0.297 0.000 0.999 2031 S CB 1.616 64.879 63.200 0.104 0.000 0.973 2031 S HN 0.668 nan 8.310 nan 0.000 0.544 2032 A N 0.803 123.783 122.820 0.266 0.000 2.032 2032 A HA -0.069 4.252 4.320 0.000 0.000 0.221 2032 A C 1.941 179.656 177.584 0.219 0.000 1.165 2032 A CA 1.517 53.703 52.037 0.247 0.000 0.645 2032 A CB -0.954 18.116 19.000 0.116 0.000 0.807 2032 A HN 0.906 nan 8.150 nan 0.000 0.453 2033 L N -0.831 120.469 121.223 0.128 0.000 2.056 2033 L HA -0.130 4.210 4.340 0.000 0.000 0.207 2033 L C 2.179 179.105 176.870 0.093 0.000 1.078 2033 L CA 2.401 57.280 54.840 0.064 0.000 0.749 2033 L CB -0.819 41.222 42.059 -0.029 0.000 0.901 2033 L HN 0.582 nan 8.230 nan 0.000 0.433 2034 H N -1.936 117.200 119.070 0.110 0.000 2.280 2034 H HA -0.267 4.289 4.556 0.000 0.000 0.294 2034 H C 1.875 177.233 175.328 0.051 0.000 1.064 2034 H CA 2.477 58.548 56.048 0.038 0.000 1.208 2034 H CB -0.492 29.248 29.762 -0.037 0.000 1.365 2034 H HN 0.382 nan 8.280 nan 0.000 0.511 2035 W N 0.536 121.939 121.300 0.173 0.000 2.301 2035 W HA -0.311 4.350 4.660 0.000 0.000 0.325 2035 W C 2.968 179.523 176.519 0.060 0.000 1.250 2035 W CA 1.371 58.770 57.345 0.090 0.000 1.261 2035 W CB -0.857 28.644 29.460 0.069 0.000 1.157 2035 W HN 0.270 nan 8.180 nan 0.000 0.473 2036 A N 0.153 123.165 122.820 0.321 0.000 2.054 2036 A HA -0.208 4.112 4.320 0.000 0.000 0.223 2036 A C 1.981 179.636 177.584 0.118 0.000 1.169 2036 A CA 2.694 54.834 52.037 0.172 0.000 0.655 2036 A CB -1.217 17.855 19.000 0.120 0.000 0.812 2036 A HN 0.321 nan 8.150 nan 0.000 0.462 2037 A N -1.163 121.726 122.820 0.116 0.000 2.081 2037 A HA 0.469 4.789 4.320 0.000 0.000 0.214 2037 A C 2.331 179.944 177.584 0.047 0.000 1.158 2037 A CA 1.285 53.361 52.037 0.065 0.000 0.724 2037 A CB -0.613 18.424 19.000 0.062 0.000 0.826 2037 A HN 0.949 nan 8.150 nan 0.000 0.463 2038 A N 0.140 122.997 122.820 0.062 0.000 1.898 2038 A HA 0.025 4.345 4.320 0.000 0.000 0.216 2038 A C 1.843 179.462 177.584 0.058 0.000 1.181 2038 A CA 1.769 53.819 52.037 0.023 0.000 0.620 2038 A CB -0.923 18.057 19.000 -0.033 0.000 0.819 2038 A HN 1.131 nan 8.150 nan 0.000 0.442 2039 V N -2.773 117.207 119.914 0.110 0.000 3.331 2039 V HA 0.238 4.359 4.120 0.000 0.000 0.332 2039 V C 0.395 176.521 176.094 0.053 0.000 1.341 2039 V CA 0.264 62.620 62.300 0.093 0.000 1.218 2039 V CB -1.716 30.186 31.823 0.131 0.000 1.152 2039 V HN 0.543 nan 8.190 nan 0.000 0.445 2040 N N 2.837 121.558 118.700 0.035 0.000 2.700 2040 N HA -0.278 4.462 4.740 0.000 0.000 0.265 2040 N C 0.051 175.573 175.510 0.020 0.000 0.975 2040 N CA 1.047 54.106 53.050 0.015 0.000 0.800 2040 N CB -1.533 36.954 38.487 0.000 0.000 0.908 2040 N HN 0.836 nan 8.380 nan 0.000 0.551 2041 N N 0.782 119.502 118.700 0.033 0.000 3.322 2041 N HA 0.126 4.866 4.740 0.000 0.000 0.290 2041 N C 1.140 176.661 175.510 0.019 0.000 1.297 2041 N CA -0.201 52.867 53.050 0.029 0.000 1.167 2041 N CB 0.000 38.515 38.487 0.045 0.000 1.434 2041 N HN 0.145 nan 8.380 nan 0.000 0.526 2042 V N 1.280 121.197 119.914 0.005 0.000 2.250 2042 V HA -0.319 3.801 4.120 0.000 0.000 0.250 2042 V C 1.625 177.720 176.094 0.002 0.000 1.060 2042 V CA 1.997 64.294 62.300 -0.006 0.000 1.030 2042 V CB -0.391 31.423 31.823 -0.015 0.000 0.643 2042 V HN 0.450 nan 8.190 nan 0.000 0.445 2043 D N 0.312 120.715 120.400 0.006 0.000 2.127 2043 D HA -0.208 4.432 4.640 0.000 0.000 0.190 2043 D C 2.240 178.551 176.300 0.019 0.000 1.000 2043 D CA 1.980 55.987 54.000 0.011 0.000 0.839 2043 D CB -0.703 40.102 40.800 0.008 0.000 0.955 2043 D HN 0.444 nan 8.370 nan 0.000 0.446 2044 A N 0.925 123.757 122.820 0.020 0.000 1.903 2044 A HA -0.208 4.113 4.320 0.000 0.000 0.219 2044 A C 2.329 179.936 177.584 0.037 0.000 1.191 2044 A CA 3.147 55.201 52.037 0.028 0.000 0.638 2044 A CB -1.104 17.916 19.000 0.033 0.000 0.823 2044 A HN 0.280 nan 8.150 nan 0.000 0.451 2045 A N -0.854 121.987 122.820 0.035 0.000 1.908 2045 A HA -0.013 4.307 4.320 0.000 0.000 0.218 2045 A C 2.276 179.892 177.584 0.054 0.000 1.181 2045 A CA 2.010 54.070 52.037 0.038 0.000 0.627 2045 A CB -0.988 18.021 19.000 0.017 0.000 0.818 2045 A HN 0.457 nan 8.150 nan 0.000 0.445 2046 V N -0.529 119.414 119.914 0.048 0.000 2.244 2046 V HA -0.233 3.888 4.120 0.000 0.000 0.244 2046 V C 2.540 178.684 176.094 0.083 0.000 1.042 2046 V CA 1.892 64.244 62.300 0.087 0.000 1.006 2046 V CB -1.094 30.766 31.823 0.062 0.000 0.641 2046 V HN 0.349 nan 8.190 nan 0.000 0.446 2047 V N -0.186 119.759 119.914 0.051 0.000 2.250 2047 V HA -0.356 3.764 4.120 0.000 0.000 0.253 2047 V C 2.419 178.535 176.094 0.038 0.000 1.065 2047 V CA 2.513 64.836 62.300 0.037 0.000 1.039 2047 V CB -0.663 31.176 31.823 0.026 0.000 0.647 2047 V HN 0.434 nan 8.190 nan 0.000 0.446 2048 L N -1.311 119.938 121.223 0.044 0.000 2.079 2048 L HA -0.196 4.144 4.340 0.000 0.000 0.210 2048 L C 2.245 179.143 176.870 0.047 0.000 1.081 2048 L CA 1.600 56.465 54.840 0.042 0.000 0.752 2048 L CB -0.412 41.674 42.059 0.046 0.000 0.896 2048 L HN 0.281 nan 8.230 nan 0.000 0.433 2049 L N -0.673 120.596 121.223 0.076 0.000 2.027 2049 L HA -0.165 4.176 4.340 0.000 0.000 0.206 2049 L C 1.833 178.706 176.870 0.004 0.000 1.074 2049 L CA 0.981 55.870 54.840 0.082 0.000 0.745 2049 L CB -0.433 41.775 42.059 0.248 0.000 0.898 2049 L HN 0.139 nan 8.230 nan 0.000 0.433 2050 K N 0.770 121.171 120.400 0.001 0.000 2.668 2050 K HA 0.004 4.324 4.320 0.000 0.000 0.204 2050 K C -0.268 176.328 176.600 -0.006 0.000 1.016 2050 K CA 0.444 56.716 56.287 -0.026 0.000 1.131 2050 K CB -0.693 31.801 32.500 -0.011 0.000 0.891 2050 K HN 0.349 nan 8.250 nan 0.000 0.499 2051 N N -0.174 118.529 118.700 0.004 0.000 2.628 2051 N HA 0.149 4.889 4.740 0.000 0.000 0.299 2051 N C 0.262 175.782 175.510 0.017 0.000 1.834 2051 N CA 0.264 53.321 53.050 0.011 0.000 0.871 2051 N CB 1.615 40.108 38.487 0.010 0.000 1.377 2051 N HN 0.269 nan 8.380 nan 0.000 0.493 2052 G N 1.359 110.165 108.800 0.010 0.000 2.972 2052 G HA2 0.032 3.992 3.960 0.000 0.000 0.265 2052 G HA3 0.032 3.992 3.960 0.000 0.000 0.265 2052 G C -0.175 174.734 174.900 0.015 0.000 1.506 2052 G CA -0.074 45.034 45.100 0.014 0.000 1.016 2052 G HN 1.320 nan 8.290 nan 0.000 0.563 2053 A N -0.923 121.909 122.820 0.020 0.000 1.563 2053 A HA 0.159 4.480 4.320 0.000 0.000 0.268 2053 A C 0.244 177.834 177.584 0.010 0.000 1.078 2053 A CA 1.379 53.425 52.037 0.016 0.000 0.560 2053 A CB -1.324 17.690 19.000 0.022 0.000 1.588 2053 A HN 2.524 nan 8.150 nan 0.000 0.222 2054 N N 1.829 120.529 118.700 0.001 0.000 2.423 2054 N HA 0.073 4.813 4.740 0.000 0.000 0.275 2054 N C 1.389 176.884 175.510 -0.025 0.000 1.283 2054 N CA 0.573 53.621 53.050 -0.003 0.000 0.932 2054 N CB 0.527 39.013 38.487 -0.003 0.000 1.185 2054 N HN 0.792 nan 8.380 nan 0.000 0.483 2055 K N 1.826 122.230 120.400 0.007 0.000 2.432 2055 K HA 0.014 4.334 4.320 0.000 0.000 0.196 2055 K C -0.288 176.315 176.600 0.004 0.000 1.038 2055 K CA 0.912 57.208 56.287 0.014 0.000 0.986 2055 K CB 0.473 33.017 32.500 0.073 0.000 0.782 2055 K HN 0.260 nan 8.250 nan 0.000 0.485 2056 D N 0.790 121.194 120.400 0.007 0.000 2.469 2056 D HA 0.073 4.713 4.640 0.000 0.000 0.215 2056 D C 0.193 176.504 176.300 0.019 0.000 1.154 2056 D CA -0.226 53.788 54.000 0.024 0.000 0.832 2056 D CB 0.282 41.107 40.800 0.041 0.000 1.008 2056 D HN 0.270 nan 8.370 nan 0.000 0.506 2057 M N 1.210 120.798 119.600 -0.020 0.000 2.234 2057 M HA -0.096 4.384 4.480 0.000 0.000 0.326 2057 M C -0.310 176.060 176.300 0.118 0.000 1.077 2057 M CA 0.812 56.118 55.300 0.010 0.000 1.052 2057 M CB 0.620 33.188 32.600 -0.053 0.000 1.607 2057 M HN -0.168 nan 8.290 nan 0.000 0.445 2058 Q N 2.548 122.434 119.800 0.143 0.000 2.359 2058 Q HA 0.492 4.833 4.340 0.000 0.000 0.275 2058 Q C -1.052 175.023 176.000 0.125 0.000 1.082 2058 Q CA -1.230 54.660 55.803 0.144 0.000 0.849 2058 Q CB 1.570 30.325 28.738 0.028 0.000 1.377 2058 Q HN 0.826 nan 8.270 nan 0.000 0.452 2059 N N 0.015 118.690 118.700 -0.041 0.000 2.457 2059 N HA 0.141 4.881 4.740 0.000 0.000 0.290 2059 N C -0.542 174.888 175.510 -0.134 0.000 1.232 2059 N CA -0.809 52.172 53.050 -0.114 0.000 0.852 2059 N CB 0.427 38.725 38.487 -0.314 0.000 1.313 2059 N HN 0.515 nan 8.380 nan 0.000 0.522 2060 N N 0.204 118.838 118.700 -0.110 0.000 3.085 2060 N HA -0.013 4.728 4.740 0.000 0.000 0.313 2060 N C -0.210 175.163 175.510 -0.229 0.000 1.277 2060 N CA 0.139 53.123 53.050 -0.110 0.000 1.150 2060 N CB -0.230 38.227 38.487 -0.050 0.000 1.437 2060 N HN 0.531 nan 8.380 nan 0.000 0.558 2061 R N -0.155 120.130 120.500 -0.357 0.000 2.504 2061 R HA 0.072 4.412 4.340 0.000 0.000 0.396 2061 R C -0.543 175.440 176.300 -0.529 0.000 0.896 2061 R CA -0.307 55.332 56.100 -0.768 0.000 1.152 2061 R CB 0.425 30.262 30.300 -0.771 0.000 1.681 2061 R HN 0.217 nan 8.270 nan 0.000 0.537 2062 E N 1.389 121.426 120.200 -0.271 0.000 2.513 2062 E HA -0.200 4.151 4.350 0.000 0.000 0.257 2062 E C -1.147 175.300 176.600 -0.255 0.000 1.098 2062 E CA 0.788 57.083 56.400 -0.176 0.000 0.752 2062 E CB -0.710 28.932 29.700 -0.097 0.000 1.324 2062 E HN 0.361 nan 8.360 nan 0.000 0.403 2063 E N 0.759 120.796 120.200 -0.272 0.000 2.081 2063 E HA 0.174 4.524 4.350 0.000 0.000 0.276 2063 E C -0.055 176.558 176.600 0.022 0.000 0.950 2063 E CA -0.237 55.991 56.400 -0.285 0.000 0.776 2063 E CB 1.487 31.049 29.700 -0.231 0.000 1.094 2063 E HN 0.069 nan 8.360 nan 0.000 0.402 2064 T N 3.251 117.861 114.554 0.094 0.000 2.932 2064 T HA 0.060 4.410 4.350 0.000 0.000 0.312 2064 T C -1.683 173.238 174.700 0.369 0.000 1.071 2064 T CA -1.539 60.704 62.100 0.239 0.000 1.128 2064 T CB 0.619 69.571 68.868 0.140 0.000 0.984 2064 T HN 0.196 nan 8.240 nan 0.000 0.549 2065 P HA 0.010 nan 4.420 nan 0.000 0.221 2065 P C 1.619 179.031 177.300 0.188 0.000 1.150 2065 P CA 0.180 63.483 63.100 0.338 0.000 0.800 2065 P CB -0.037 31.675 31.700 0.021 0.000 0.787 2066 L N -1.511 119.795 121.223 0.138 0.000 2.189 2066 L HA -0.168 4.172 4.340 0.000 0.000 0.214 2066 L C 2.072 179.028 176.870 0.142 0.000 1.097 2066 L CA 1.689 56.592 54.840 0.105 0.000 0.764 2066 L CB -1.312 40.804 42.059 0.096 0.000 0.900 2066 L HN -0.153 nan 8.230 nan 0.000 0.436 2067 F N -0.710 119.267 119.950 0.045 0.000 2.022 2067 F HA -0.189 4.338 4.527 0.000 0.000 0.293 2067 F C 2.117 177.925 175.800 0.014 0.000 1.142 2067 F CA 1.768 59.784 58.000 0.027 0.000 1.177 2067 F CB -0.591 38.417 39.000 0.014 0.000 0.982 2067 F HN 0.014 nan 8.300 nan 0.000 0.473 2068 L N 0.824 122.121 121.223 0.123 0.000 2.034 2068 L HA -0.318 4.022 4.340 0.000 0.000 0.217 2068 L C 2.678 179.504 176.870 -0.074 0.000 1.077 2068 L CA 2.175 56.999 54.840 -0.028 0.000 0.769 2068 L CB -1.825 40.229 42.059 -0.008 0.000 0.890 2068 L HN 0.306 nan 8.230 nan 0.000 0.435 2069 A N -0.414 122.392 122.820 -0.023 0.000 1.848 2069 A HA -0.291 4.029 4.320 0.000 0.000 0.217 2069 A C 2.464 180.000 177.584 -0.080 0.000 1.220 2069 A CA 2.708 54.719 52.037 -0.043 0.000 0.645 2069 A CB -1.399 17.583 19.000 -0.031 0.000 0.842 2069 A HN 0.442 nan 8.150 nan 0.000 0.451 2070 A N -0.802 121.960 122.820 -0.097 0.000 2.084 2070 A HA -0.196 4.124 4.320 0.000 0.000 0.221 2070 A C 2.150 179.671 177.584 -0.104 0.000 1.161 2070 A CA 2.128 54.111 52.037 -0.090 0.000 0.653 2070 A CB -0.538 18.402 19.000 -0.101 0.000 0.802 2070 A HN 0.667 nan 8.150 nan 0.000 0.457 2071 R N -0.225 120.116 120.500 -0.266 0.000 2.078 2071 R HA -0.096 4.244 4.340 0.000 0.000 0.224 2071 R C 1.855 178.192 176.300 0.061 0.000 1.149 2071 R CA 1.422 57.398 56.100 -0.207 0.000 0.916 2071 R CB -0.389 29.718 30.300 -0.321 0.000 0.821 2071 R HN 0.404 nan 8.270 nan 0.000 0.434 2072 E N -0.294 119.901 120.200 -0.009 0.000 2.333 2072 E HA -0.133 4.218 4.350 0.000 0.000 0.200 2072 E C 1.025 177.557 176.600 -0.113 0.000 1.010 2072 E CA 1.216 57.619 56.400 0.004 0.000 0.841 2072 E CB -0.174 29.506 29.700 -0.034 0.000 0.757 2072 E HN 0.788 nan 8.360 nan 0.000 0.508 2073 G N 1.729 110.424 108.800 -0.176 0.000 2.155 2073 G HA2 -0.331 3.629 3.960 0.000 0.000 0.257 2073 G HA3 -0.331 3.629 3.960 0.000 0.000 0.257 2073 G C 0.411 175.143 174.900 -0.279 0.000 0.983 2073 G CA 0.665 45.452 45.100 -0.522 0.000 0.676 2073 G HN 0.384 nan 8.290 nan 0.000 0.528 2074 S N -0.248 115.368 115.700 -0.139 0.000 2.519 2074 S HA 0.331 4.801 4.470 0.000 0.000 0.320 2074 S C 0.960 175.546 174.600 -0.023 0.000 1.179 2074 S CA 0.238 58.400 58.200 -0.064 0.000 1.173 2074 S CB 0.519 63.694 63.200 -0.041 0.000 1.224 2074 S HN 0.753 nan 8.310 nan 0.000 0.542 2075 Y N 3.432 123.654 120.300 -0.130 0.000 2.220 2075 Y HA -0.053 4.497 4.550 0.000 0.000 0.291 2075 Y C 1.894 177.721 175.900 -0.120 0.000 1.129 2075 Y CA 1.749 59.776 58.100 -0.122 0.000 1.161 2075 Y CB -0.080 38.306 38.460 -0.123 0.000 0.997 2075 Y HN 0.625 nan 8.280 nan 0.000 0.522 2076 E N -0.400 119.854 120.200 0.090 0.000 2.028 2076 E HA -0.136 4.215 4.350 0.000 0.000 0.191 2076 E C 2.230 178.764 176.600 -0.111 0.000 0.988 2076 E CA 2.014 58.415 56.400 0.002 0.000 0.799 2076 E CB -0.642 29.088 29.700 0.050 0.000 0.755 2076 E HN 0.315 nan 8.360 nan 0.000 0.447 2077 T N 0.628 115.139 114.554 -0.072 0.000 2.737 2077 T HA -0.221 4.130 4.350 0.000 0.000 0.269 2077 T C 1.849 176.474 174.700 -0.126 0.000 1.040 2077 T CA 1.334 63.388 62.100 -0.077 0.000 1.142 2077 T CB -0.382 68.466 68.868 -0.033 0.000 0.861 2077 T HN 0.291 nan 8.240 nan 0.000 0.456 2078 A N 1.572 124.292 122.820 -0.167 0.000 1.858 2078 A HA -0.123 4.197 4.320 0.000 0.000 0.216 2078 A C 2.222 179.638 177.584 -0.280 0.000 1.190 2078 A CA 1.840 53.754 52.037 -0.205 0.000 0.617 2078 A CB -0.583 18.278 19.000 -0.231 0.000 0.827 2078 A HN 0.429 nan 8.150 nan 0.000 0.443 2079 K N -0.297 119.833 120.400 -0.450 0.000 2.160 2079 K HA -0.141 4.179 4.320 0.000 0.000 0.206 2079 K C 1.817 178.251 176.600 -0.277 0.000 1.047 2079 K CA 1.691 57.683 56.287 -0.492 0.000 0.930 2079 K CB -0.280 31.852 32.500 -0.612 0.000 0.720 2079 K HN 0.275 nan 8.250 nan 0.000 0.450 2080 V N 1.215 120.980 119.914 -0.249 0.000 2.427 2080 V HA -0.230 3.890 4.120 0.000 0.000 0.248 2080 V C 2.075 177.964 176.094 -0.342 0.000 1.051 2080 V CA 1.402 63.532 62.300 -0.284 0.000 1.048 2080 V CB -0.212 31.477 31.823 -0.223 0.000 0.666 2080 V HN 0.233 nan 8.190 nan 0.000 0.456 2081 L N -1.233 119.873 121.223 -0.195 0.000 2.095 2081 L HA -0.055 4.286 4.340 0.000 0.000 0.204 2081 L C 2.211 179.028 176.870 -0.087 0.000 1.080 2081 L CA 1.137 55.910 54.840 -0.112 0.000 0.759 2081 L CB -0.955 41.085 42.059 -0.031 0.000 0.914 2081 L HN 0.155 nan 8.230 nan 0.000 0.439 2082 L N 0.087 121.269 121.223 -0.068 0.000 2.263 2082 L HA -0.243 4.097 4.340 0.000 0.000 0.216 2082 L C 1.932 178.745 176.870 -0.095 0.000 1.111 2082 L CA 1.643 56.485 54.840 0.004 0.000 0.773 2082 L CB -1.111 41.013 42.059 0.108 0.000 0.906 2082 L HN 0.373 nan 8.230 nan 0.000 0.439 2083 D N -1.449 118.833 120.400 -0.196 0.000 2.183 2083 D HA -0.076 4.565 4.640 0.000 0.000 0.205 2083 D C 1.531 177.515 176.300 -0.526 0.000 0.962 2083 D CA 0.910 54.702 54.000 -0.347 0.000 0.849 2083 D CB 0.060 40.659 40.800 -0.335 0.000 0.978 2083 D HN 0.485 nan 8.370 nan 0.000 0.488 2084 H N -0.559 118.324 119.070 -0.312 0.000 2.567 2084 H HA 0.139 4.695 4.556 0.000 0.000 0.294 2084 H C -0.313 175.013 175.328 -0.003 0.000 1.050 2084 H CA -0.607 55.311 56.048 -0.216 0.000 1.168 2084 H CB -0.617 29.128 29.762 -0.028 0.000 1.422 2084 H HN -0.025 nan 8.280 nan 0.000 0.562 2085 F N 0.175 120.194 119.950 0.115 0.000 2.384 2085 F HA -0.271 4.256 4.527 0.000 0.000 0.199 2085 F C 0.770 176.610 175.800 0.067 0.000 1.027 2085 F CA -0.121 57.919 58.000 0.068 0.000 0.870 2085 F CB -1.926 37.100 39.000 0.044 0.000 0.895 2085 F HN 0.239 nan 8.300 nan 0.000 0.818 2086 A N 1.354 124.280 122.820 0.178 0.000 2.386 2086 A HA 0.397 4.717 4.320 0.000 0.000 0.248 2086 A C 0.486 178.151 177.584 0.136 0.000 1.082 2086 A CA -0.274 51.845 52.037 0.136 0.000 0.789 2086 A CB 0.391 19.442 19.000 0.087 0.000 1.025 2086 A HN 0.638 nan 8.150 nan 0.000 0.490 2087 N N 0.065 118.830 118.700 0.108 0.000 2.420 2087 N HA 0.080 4.820 4.740 0.000 0.000 0.262 2087 N C 1.149 176.712 175.510 0.088 0.000 1.144 2087 N CA -0.041 53.064 53.050 0.091 0.000 0.952 2087 N CB 0.601 39.129 38.487 0.068 0.000 1.081 2087 N HN 0.616 nan 8.380 nan 0.000 0.480 2088 R N 2.166 122.719 120.500 0.089 0.000 2.276 2088 R HA 0.108 4.448 4.340 0.000 0.000 0.196 2088 R C -0.326 176.025 176.300 0.085 0.000 0.961 2088 R CA 0.575 56.730 56.100 0.090 0.000 1.024 2088 R CB 0.195 30.547 30.300 0.087 0.000 0.940 2088 R HN 0.383 nan 8.270 nan 0.000 0.480 2089 D N 1.444 121.885 120.400 0.068 0.000 2.305 2089 D HA 0.102 4.742 4.640 0.000 0.000 0.206 2089 D C 0.732 177.058 176.300 0.043 0.000 0.974 2089 D CA 0.252 54.285 54.000 0.054 0.000 0.871 2089 D CB 0.150 40.975 40.800 0.042 0.000 0.947 2089 D HN 0.232 nan 8.370 nan 0.000 0.516 2090 I N 1.647 122.242 120.570 0.042 0.000 2.821 2090 I HA -0.104 4.066 4.170 0.000 0.000 0.294 2090 I C 1.394 177.512 176.117 0.002 0.000 1.210 2090 I CA 0.419 61.730 61.300 0.019 0.000 1.430 2090 I CB 0.429 38.443 38.000 0.022 0.000 1.356 2090 I HN -0.123 nan 8.210 nan 0.000 0.563 2091 T N 3.795 118.326 114.554 -0.038 0.000 2.888 2091 T HA 0.286 4.636 4.350 0.000 0.000 0.283 2091 T C -0.120 174.422 174.700 -0.263 0.000 1.013 2091 T CA -0.712 61.331 62.100 -0.094 0.000 0.938 2091 T CB 1.132 69.970 68.868 -0.050 0.000 1.298 2091 T HN 0.677 nan 8.240 nan 0.000 0.580 2092 D N -0.919 119.250 120.400 -0.383 0.000 2.511 2092 D HA 0.150 4.790 4.640 0.000 0.000 0.276 2092 D C 0.576 176.805 176.300 -0.119 0.000 1.220 2092 D CA -0.425 53.298 54.000 -0.462 0.000 1.077 2092 D CB -0.453 39.977 40.800 -0.616 0.000 1.126 2092 D HN 0.942 nan 8.370 nan 0.000 0.583 2093 H N -2.174 116.775 119.070 -0.203 0.000 2.708 2093 H HA 0.392 4.948 4.556 0.000 0.000 0.309 2093 H C 0.189 175.467 175.328 -0.082 0.000 1.084 2093 H CA -0.377 55.602 56.048 -0.114 0.000 1.165 2093 H CB -0.363 29.345 29.762 -0.090 0.000 1.388 2093 H HN 0.115 nan 8.280 nan 0.000 0.553 2094 M N 0.540 120.147 119.600 0.011 0.000 2.783 2094 M HA 0.106 4.586 4.480 0.000 0.000 0.443 2094 M C -0.623 175.664 176.300 -0.022 0.000 1.265 2094 M CA -0.206 55.057 55.300 -0.060 0.000 0.844 2094 M CB 0.873 33.443 32.600 -0.049 0.000 1.596 2094 M HN 0.193 nan 8.290 nan 0.000 0.546 2095 D N 0.930 121.318 120.400 -0.020 0.000 3.012 2095 D HA -0.160 4.480 4.640 0.000 0.000 0.222 2095 D C -0.041 176.266 176.300 0.013 0.000 1.167 2095 D CA 0.951 54.944 54.000 -0.011 0.000 0.854 2095 D CB -0.910 39.883 40.800 -0.012 0.000 1.107 2095 D HN 0.403 nan 8.370 nan 0.000 0.421 2096 R N 0.264 120.784 120.500 0.033 0.000 2.248 2096 R HA 0.393 4.734 4.340 0.000 0.000 0.328 2096 R C 0.623 177.004 176.300 0.134 0.000 1.067 2096 R CA -0.554 55.605 56.100 0.097 0.000 0.924 2096 R CB 0.620 31.023 30.300 0.171 0.000 1.013 2096 R HN 0.185 nan 8.270 nan 0.000 0.454 2097 L N 5.843 127.145 121.223 0.132 0.000 2.492 2097 L HA -0.027 4.313 4.340 0.000 0.000 0.280 2097 L C -0.898 176.171 176.870 0.332 0.000 1.240 2097 L CA -0.892 54.046 54.840 0.163 0.000 0.831 2097 L CB 0.408 42.531 42.059 0.106 0.000 1.100 2097 L HN 0.497 nan 8.230 nan 0.000 0.505 2098 P HA -0.218 nan 4.420 nan 0.000 0.215 2098 P C 1.330 178.696 177.300 0.110 0.000 1.157 2098 P CA 1.014 64.326 63.100 0.354 0.000 0.863 2098 P CB -0.110 31.775 31.700 0.307 0.000 0.787 2099 R N 0.288 120.850 120.500 0.104 0.000 2.293 2099 R HA -0.210 4.130 4.340 0.000 0.000 0.270 2099 R C 1.371 177.695 176.300 0.041 0.000 1.192 2099 R CA 1.911 58.048 56.100 0.062 0.000 1.017 2099 R CB -0.845 29.493 30.300 0.063 0.000 0.887 2099 R HN 0.263 nan 8.270 nan 0.000 0.480 2100 D N -0.737 119.702 120.400 0.064 0.000 2.414 2100 D HA -0.067 4.573 4.640 0.000 0.000 0.237 2100 D C 1.765 178.066 176.300 0.002 0.000 0.975 2100 D CA 0.312 54.337 54.000 0.041 0.000 0.917 2100 D CB -0.403 40.442 40.800 0.074 0.000 1.061 2100 D HN 0.120 nan 8.370 nan 0.000 0.480 2101 I N 1.760 122.329 120.570 -0.002 0.000 2.623 2101 I HA -0.203 3.967 4.170 0.000 0.000 0.261 2101 I C 1.821 177.850 176.117 -0.147 0.000 1.204 2101 I CA 0.412 61.648 61.300 -0.108 0.000 1.444 2101 I CB -0.386 37.434 38.000 -0.300 0.000 1.094 2101 I HN -0.105 nan 8.210 nan 0.000 0.451 2102 A N -0.512 122.252 122.820 -0.094 0.000 1.822 2102 A HA -0.211 4.110 4.320 0.000 0.000 0.214 2102 A C 2.081 179.605 177.584 -0.099 0.000 1.245 2102 A CA 1.484 53.495 52.037 -0.044 0.000 0.608 2102 A CB -1.015 17.999 19.000 0.023 0.000 0.896 2102 A HN 0.413 nan 8.150 nan 0.000 0.457 2103 Q N -0.397 119.360 119.800 -0.073 0.000 2.160 2103 Q HA -0.351 3.989 4.340 0.000 0.000 0.219 2103 Q C 1.912 177.836 176.000 -0.127 0.000 1.051 2103 Q CA 2.676 58.410 55.803 -0.114 0.000 0.929 2103 Q CB -0.785 27.907 28.738 -0.077 0.000 1.059 2103 Q HN 0.883 nan 8.270 nan 0.000 0.428 2104 E N -0.499 119.638 120.200 -0.105 0.000 2.012 2104 E HA -0.183 4.167 4.350 0.000 0.000 0.197 2104 E C 1.693 178.205 176.600 -0.147 0.000 1.007 2104 E CA 0.978 57.318 56.400 -0.100 0.000 0.816 2104 E CB -0.016 29.641 29.700 -0.071 0.000 0.762 2104 E HN 0.134 nan 8.360 nan 0.000 0.451 2105 R N -0.400 119.950 120.500 -0.250 0.000 2.357 2105 R HA -0.027 4.313 4.340 0.000 0.000 0.202 2105 R C 0.508 176.506 176.300 -0.504 0.000 1.047 2105 R CA 0.550 56.404 56.100 -0.409 0.000 1.034 2105 R CB -0.109 29.834 30.300 -0.596 0.000 0.875 2105 R HN 0.470 nan 8.270 nan 0.000 0.473 2106 M N -1.210 118.234 119.600 -0.260 0.000 2.976 2106 M HA -0.199 4.281 4.480 0.000 0.000 0.209 2106 M C -0.826 175.655 176.300 0.302 0.000 0.579 2106 M CA 0.893 56.226 55.300 0.055 0.000 0.783 2106 M CB -2.574 30.082 32.600 0.094 0.000 2.807 2106 M HN 0.330 nan 8.290 nan 0.000 0.362 2107 H N 0.045 119.235 119.070 0.200 0.000 3.118 2107 H HA 0.212 4.768 4.556 0.000 0.000 0.266 2107 H C 1.305 176.781 175.328 0.246 0.000 1.465 2107 H CA -0.168 55.983 56.048 0.171 0.000 1.460 2107 H CB -0.140 29.665 29.762 0.071 0.000 1.661 2107 H HN 0.444 nan 8.280 nan 0.000 0.516 2108 H N 0.805 119.938 119.070 0.106 0.000 2.546 2108 H HA -0.098 4.458 4.556 0.000 0.000 0.277 2108 H C 0.863 176.237 175.328 0.076 0.000 1.004 2108 H CA -0.064 56.023 56.048 0.066 0.000 1.231 2108 H CB 0.640 30.423 29.762 0.035 0.000 1.382 2108 H HN 0.613 nan 8.280 nan 0.000 0.580 2109 D N 1.086 121.616 120.400 0.215 0.000 2.106 2109 D HA -0.061 4.579 4.640 0.000 0.000 0.203 2109 D C 2.275 178.737 176.300 0.271 0.000 0.977 2109 D CA 0.341 54.441 54.000 0.166 0.000 0.844 2109 D CB -0.071 40.722 40.800 -0.011 0.000 1.002 2109 D HN 0.252 nan 8.370 nan 0.000 0.461 2110 I N 0.875 121.612 120.570 0.279 0.000 2.248 2110 I HA -0.272 3.898 4.170 0.000 0.000 0.248 2110 I C 2.279 178.465 176.117 0.116 0.000 1.107 2110 I CA 0.654 62.065 61.300 0.185 0.000 1.373 2110 I CB 0.004 38.086 38.000 0.137 0.000 1.055 2110 I HN -0.096 nan 8.210 nan 0.000 0.418 2111 V N 0.630 120.621 119.914 0.128 0.000 2.220 2111 V HA -0.343 3.777 4.120 0.000 0.000 0.246 2111 V C 2.615 178.761 176.094 0.086 0.000 1.049 2111 V CA 2.131 64.481 62.300 0.082 0.000 1.003 2111 V CB -0.830 31.024 31.823 0.052 0.000 0.634 2111 V HN 0.451 nan 8.190 nan 0.000 0.444 2112 R N -0.488 120.078 120.500 0.111 0.000 2.139 2112 R HA -0.211 4.129 4.340 0.000 0.000 0.243 2112 R C 2.203 178.569 176.300 0.109 0.000 1.145 2112 R CA 1.882 58.045 56.100 0.105 0.000 0.976 2112 R CB -0.348 30.021 30.300 0.115 0.000 0.866 2112 R HN 0.464 nan 8.270 nan 0.000 0.449 2113 L N 0.743 122.029 121.223 0.106 0.000 2.068 2113 L HA -0.061 4.279 4.340 0.000 0.000 0.204 2113 L C 2.109 179.024 176.870 0.076 0.000 1.076 2113 L CA 1.451 56.323 54.840 0.053 0.000 0.753 2113 L CB -0.324 41.663 42.059 -0.121 0.000 0.910 2113 L HN 0.145 nan 8.230 nan 0.000 0.439 2114 L N -0.572 120.683 121.223 0.054 0.000 2.131 2114 L HA -0.182 4.158 4.340 0.000 0.000 0.210 2114 L C 2.127 179.042 176.870 0.075 0.000 1.092 2114 L CA 0.998 55.876 54.840 0.063 0.000 0.759 2114 L CB -0.763 41.326 42.059 0.051 0.000 0.903 2114 L HN 0.291 nan 8.230 nan 0.000 0.435 2115 D N 0.155 120.598 120.400 0.073 0.000 2.144 2115 D HA -0.138 4.502 4.640 0.000 0.000 0.200 2115 D C 1.320 177.665 176.300 0.075 0.000 0.978 2115 D CA 1.298 55.337 54.000 0.065 0.000 0.833 2115 D CB 0.178 41.012 40.800 0.057 0.000 0.961 2115 D HN 0.413 nan 8.370 nan 0.000 0.470 2116 E N -1.598 118.662 120.200 0.101 0.000 2.810 2116 E HA 0.055 4.406 4.350 0.000 0.000 0.214 2116 E C -0.795 175.897 176.600 0.153 0.000 0.980 2116 E CA -0.269 56.194 56.400 0.106 0.000 1.159 2116 E CB 1.005 30.763 29.700 0.096 0.000 1.047 2116 E HN 0.114 nan 8.360 nan 0.000 0.484 2117 Y N 1.030 121.338 120.300 0.014 0.000 2.376 2117 Y HA 0.308 4.858 4.550 0.000 0.000 0.326 2117 Y C 0.161 176.062 175.900 0.002 0.000 0.970 2117 Y CA -0.338 57.762 58.100 -0.000 0.000 1.248 2117 Y CB 0.143 38.588 38.460 -0.026 0.000 1.117 2117 Y HN -0.049 nan 8.280 nan 0.000 0.476 2118 N N 1.907 120.393 118.700 -0.357 0.000 2.722 2118 N HA -0.206 4.534 4.740 0.000 0.000 0.235 2118 N C -1.226 174.268 175.510 -0.027 0.000 0.608 2118 N CA 1.535 54.464 53.050 -0.201 0.000 1.802 2118 N CB -0.760 37.643 38.487 -0.141 0.000 1.754 2118 N HN 0.539 nan 8.380 nan 0.000 0.336 2119 L N 0.000 121.249 121.223 0.043 0.000 2.949 2119 L HA 0.000 4.340 4.340 0.000 0.000 0.249 2119 L CA 0.000 54.869 54.840 0.048 0.000 0.813 2119 L CB 0.000 42.077 42.059 0.030 0.000 0.961 2119 L HN 0.000 nan 8.230 nan 0.000 0.502