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 1pj4_1_C DATA FIRST_RESID 2022 DATA SEQUENCE KEKGKPLXLN PRTNKGXAFT LQERQXLGLQ GLLPPKIETQ DIQALRFHRN DATA SEQUENCE LKKXTSPLEK YIYIXGIQER NEKLFYRILQ DDIESLXPIV YTPTVGLACS DATA SEQUENCE QYGHIFRRPK GLFISISDRG HVRSIVDNWP ENHVKAVVVT DGERILGLGD DATA SEQUENCE LGVYGXGIPV GKLCLYTACA GIRPDRCLPV CIDVGTDNIA LLKDPFYXGL DATA SEQUENCE YQKRDRTQQY DDLIDEFXKA ITDRYGRNTL IQFEDFGNHN AFRFLRKYRE DATA SEQUENCE KYCTFNDDIQ GTAAVALAGL LAAQKVISKP ISEHKILFLG AGEAALGIAN DATA SEQUENCE LIVXSXVENG LSEQEAQKKI WXFDKYGLLV KGRKAKIDSY QEPFTHSAPE DATA SEQUENCE SIPDTFEDAV NILKPSTIIG VAGAGRLFTP DVIRAXASIN ERPVIFALSN DATA SEQUENCE PTAQAECTAE EAYTLTEGRC LFASGSPFGP VKLTDGRVFT PGQGNNVYIF DATA SEQUENCE PGVALAVILC NTRHISDSVF LEAAKALTSQ LTDEELAQGR LYPPLANIQE DATA SEQUENCE VSINIAIKVT EYLYANKXAF RYPEPEDKAK YVKERTWRSE YDSLLPDVYE DATA SEQUENCE WP 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 2022 K HA 0.000 nan 4.320 nan 0.000 0.191 2022 K C 0.000 176.604 176.600 0.006 0.000 0.988 2022 K CA 0.000 56.296 56.287 0.015 0.000 0.838 2022 K CB 0.000 32.509 32.500 0.015 0.000 1.064 2023 E N 2.214 122.418 120.200 0.007 0.000 2.410 2023 E HA 0.135 4.485 4.350 -0.001 0.000 0.255 2023 E C -0.241 176.351 176.600 -0.014 0.000 1.194 2023 E CA 0.510 56.908 56.400 -0.004 0.000 0.955 2023 E CB 0.917 30.618 29.700 0.000 0.000 0.988 2023 E HN 0.068 nan 8.360 nan 0.000 0.461 2024 K N -0.944 119.438 120.400 -0.029 0.000 2.568 2024 K HA 0.437 4.756 4.320 -0.001 0.000 0.273 2024 K C -0.247 176.315 176.600 -0.064 0.000 0.951 2024 K CA 0.187 56.444 56.287 -0.050 0.000 0.854 2024 K CB 1.536 34.010 32.500 -0.044 0.000 1.424 2024 K HN 0.640 nan 8.250 nan 0.000 0.427 2025 G N 2.630 111.373 108.800 -0.096 0.000 2.593 2025 G HA2 -0.312 3.647 3.960 -0.001 0.000 0.237 2025 G HA3 -0.312 3.647 3.960 -0.001 0.000 0.237 2025 G C 0.305 175.147 174.900 -0.097 0.000 1.312 2025 G CA 0.373 45.415 45.100 -0.097 0.000 0.896 2025 G HN 0.731 nan 8.290 nan 0.000 0.574 2026 K N 1.093 121.448 120.400 -0.073 0.000 2.127 2026 K HA -0.073 4.246 4.320 -0.001 0.000 0.208 2026 K C 0.176 176.754 176.600 -0.037 0.000 1.047 2026 K CA 2.814 59.067 56.287 -0.055 0.000 0.927 2026 K CB -1.266 31.210 32.500 -0.040 0.000 0.716 2026 K HN 0.328 nan 8.250 nan 0.000 0.450 2027 P HA -0.133 nan 4.420 nan 0.000 0.219 2027 P C 0.137 177.437 177.300 -0.000 0.000 1.146 2027 P CA 0.857 63.947 63.100 -0.017 0.000 0.808 2027 P CB 0.036 31.725 31.700 -0.020 0.000 0.779 2031 N N 3.127 121.837 118.700 0.016 0.000 2.420 2031 N HA 0.232 4.971 4.740 -0.001 0.000 0.249 2031 N C -1.606 173.917 175.510 0.021 0.000 1.033 2031 N CA -2.056 50.996 53.050 0.004 0.000 0.944 2031 N CB 1.544 40.034 38.487 0.006 0.000 1.113 2031 N HN -0.059 nan 8.380 nan 0.000 0.502 2032 P HA -0.175 nan 4.420 nan 0.000 0.220 2032 P C 1.080 178.404 177.300 0.040 0.000 1.144 2032 P CA 0.851 63.953 63.100 0.003 0.000 0.800 2032 P CB 0.577 32.248 31.700 -0.047 0.000 0.772 2033 R N 0.630 121.153 120.500 0.038 0.000 2.096 2033 R HA -0.081 4.258 4.340 -0.001 0.000 0.235 2033 R C 2.243 178.610 176.300 0.111 0.000 1.127 2033 R CA 2.411 58.556 56.100 0.075 0.000 0.968 2033 R CB -1.209 29.117 30.300 0.043 0.000 0.861 2033 R HN 0.301 nan 8.270 nan 0.000 0.440 2034 T N -3.279 111.333 114.554 0.097 0.000 3.015 2034 T HA 0.121 4.470 4.350 -0.001 0.000 0.250 2034 T C 0.593 175.356 174.700 0.106 0.000 1.057 2034 T CA -0.217 61.956 62.100 0.120 0.000 1.066 2034 T CB -0.316 68.638 68.868 0.143 0.000 0.959 2034 T HN 0.065 nan 8.240 nan 0.000 0.488 2035 N N 2.077 120.838 118.700 0.103 0.000 2.411 2035 N HA 0.074 4.813 4.740 -0.001 0.000 0.265 2035 N C 0.562 175.967 175.510 -0.175 0.000 1.266 2035 N CA 0.266 53.361 53.050 0.075 0.000 0.889 2035 N CB 0.585 39.129 38.487 0.094 0.000 1.069 2035 N HN 0.359 nan 8.380 nan 0.000 0.476 2036 K N 2.303 122.284 120.400 -0.699 0.000 2.355 2036 K HA 0.225 4.544 4.320 -0.001 0.000 0.198 2036 K C 0.813 177.111 176.600 -0.502 0.000 1.039 2036 K CA 0.192 55.923 56.287 -0.926 0.000 1.075 2036 K CB 0.220 31.651 32.500 -1.781 0.000 0.870 2036 K HN 0.789 nan 8.250 nan 0.000 0.540 2040 F N 3.184 123.020 119.950 -0.189 0.000 2.578 2040 F HA 0.299 4.826 4.527 -0.001 0.000 0.381 2040 F C 1.767 177.512 175.800 -0.091 0.000 1.069 2040 F CA 1.368 59.278 58.000 -0.150 0.000 1.231 2040 F CB 0.887 39.822 39.000 -0.108 0.000 1.086 2040 F HN 0.317 nan 8.300 nan 0.000 0.564 2041 T N 1.701 116.328 114.554 0.122 0.000 2.766 2041 T HA 0.071 4.420 4.350 -0.001 0.000 0.295 2041 T C 1.039 175.776 174.700 0.061 0.000 1.024 2041 T CA -0.901 61.238 62.100 0.065 0.000 1.018 2041 T CB 0.912 69.806 68.868 0.043 0.000 1.002 2041 T HN 0.570 nan 8.240 nan 0.000 0.532 2042 L N 0.575 121.818 121.223 0.034 0.000 2.017 2042 L HA -0.059 4.280 4.340 -0.001 0.000 0.208 2042 L C 2.921 179.795 176.870 0.007 0.000 1.073 2042 L CA 1.779 56.629 54.840 0.017 0.000 0.745 2042 L CB -1.080 40.985 42.059 0.011 0.000 0.894 2042 L HN 0.825 nan 8.230 nan 0.000 0.432 2043 Q N -0.609 119.198 119.800 0.012 0.000 2.061 2043 Q HA -0.248 4.092 4.340 -0.001 0.000 0.204 2043 Q C 2.129 178.129 176.000 0.001 0.000 0.984 2043 Q CA 2.157 57.963 55.803 0.005 0.000 0.846 2043 Q CB -0.131 28.614 28.738 0.011 0.000 0.902 2043 Q HN 0.653 nan 8.270 nan 0.000 0.421 2044 E N 0.100 120.313 120.200 0.023 0.000 2.085 2044 E HA -0.208 4.142 4.350 -0.001 0.000 0.194 2044 E C 2.082 178.647 176.600 -0.059 0.000 0.994 2044 E CA 0.919 57.334 56.400 0.024 0.000 0.801 2044 E CB -0.053 29.726 29.700 0.132 0.000 0.743 2044 E HN 0.264 nan 8.360 nan 0.000 0.453 2045 R N 0.903 121.363 120.500 -0.066 0.000 2.081 2045 R HA -0.076 4.263 4.340 -0.001 0.000 0.235 2045 R C 1.350 177.584 176.300 -0.110 0.000 1.131 2045 R CA 0.847 56.863 56.100 -0.140 0.000 0.960 2045 R CB -0.192 30.057 30.300 -0.086 0.000 0.856 2045 R HN 0.259 nan 8.270 nan 0.000 0.436 2049 G N 1.424 110.155 108.800 -0.115 0.000 2.225 2049 G HA2 -0.266 3.693 3.960 -0.001 0.000 0.264 2049 G HA3 -0.266 3.693 3.960 -0.001 0.000 0.264 2049 G C 0.312 175.131 174.900 -0.134 0.000 1.060 2049 G CA 0.666 45.703 45.100 -0.106 0.000 0.833 2049 G HN 0.342 nan 8.290 nan 0.000 0.498 2050 L N -1.080 120.041 121.223 -0.170 0.000 2.817 2050 L HA 0.284 4.623 4.340 -0.001 0.000 0.248 2050 L C 1.309 178.101 176.870 -0.129 0.000 1.133 2050 L CA -0.444 54.279 54.840 -0.196 0.000 0.935 2050 L CB 0.110 41.950 42.059 -0.364 0.000 1.266 2050 L HN 0.158 nan 8.230 nan 0.000 0.535 2051 Q N 1.404 121.145 119.800 -0.098 0.000 2.263 2051 Q HA 0.110 4.449 4.340 -0.001 0.000 0.289 2051 Q C 1.226 177.195 176.000 -0.051 0.000 1.061 2051 Q CA 1.428 57.193 55.803 -0.063 0.000 0.927 2051 Q CB 0.875 29.583 28.738 -0.050 0.000 1.154 2051 Q HN 0.466 nan 8.270 nan 0.000 0.378 2052 G N 2.740 111.517 108.800 -0.038 0.000 2.241 2052 G HA2 -0.262 3.697 3.960 -0.001 0.000 0.244 2052 G HA3 -0.262 3.697 3.960 -0.001 0.000 0.244 2052 G C 0.621 175.504 174.900 -0.028 0.000 0.998 2052 G CA 0.302 45.385 45.100 -0.029 0.000 0.621 2052 G HN 0.559 nan 8.290 nan 0.000 0.519 2053 L N 0.064 121.263 121.223 -0.039 0.000 2.592 2053 L HA 0.502 4.842 4.340 -0.001 0.000 0.227 2053 L C 0.870 177.730 176.870 -0.017 0.000 1.127 2053 L CA 0.302 55.122 54.840 -0.034 0.000 0.884 2053 L CB 0.115 42.141 42.059 -0.055 0.000 1.065 2053 L HN 0.181 nan 8.230 nan 0.000 0.457 2054 L N -0.986 120.230 121.223 -0.011 0.000 2.354 2054 L HA 0.508 4.847 4.340 -0.001 0.000 0.264 2054 L C -2.287 174.591 176.870 0.014 0.000 1.008 2054 L CA -1.923 52.926 54.840 0.015 0.000 0.819 2054 L CB 1.756 43.837 42.059 0.036 0.000 1.339 2054 L HN -0.247 nan 8.230 nan 0.000 0.420 2055 P HA 0.129 nan 4.420 nan 0.000 0.269 2055 P C -2.095 175.216 177.300 0.018 0.000 1.215 2055 P CA -0.860 62.251 63.100 0.017 0.000 0.780 2055 P CB 0.118 31.832 31.700 0.022 0.000 0.898 2056 P HA -0.157 nan 4.420 nan 0.000 0.217 2056 P C 0.133 177.443 177.300 0.017 0.000 1.148 2056 P CA 1.299 64.406 63.100 0.011 0.000 0.828 2056 P CB 0.022 31.726 31.700 0.008 0.000 0.783 2057 K N 0.914 121.326 120.400 0.020 0.000 2.484 2057 K HA 0.042 4.361 4.320 -0.001 0.000 0.280 2057 K C -0.228 176.389 176.600 0.028 0.000 1.013 2057 K CA 0.470 56.771 56.287 0.023 0.000 1.029 2057 K CB -0.255 32.259 32.500 0.024 0.000 0.902 2057 K HN -0.108 nan 8.250 nan 0.000 0.481 2058 I N 4.663 125.249 120.570 0.027 0.000 2.321 2058 I HA 0.248 4.418 4.170 -0.001 0.000 0.291 2058 I C 0.320 176.454 176.117 0.028 0.000 0.998 2058 I CA -0.291 61.027 61.300 0.029 0.000 1.227 2058 I CB 1.100 39.115 38.000 0.026 0.000 1.368 2058 I HN 0.753 nan 8.210 nan 0.000 0.466 2059 E N 3.678 123.895 120.200 0.029 0.000 2.264 2059 E HA 0.557 4.907 4.350 -0.001 0.000 0.260 2059 E C -0.220 176.409 176.600 0.048 0.000 0.961 2059 E CA -0.716 55.706 56.400 0.038 0.000 0.834 2059 E CB 2.173 31.900 29.700 0.045 0.000 1.230 2059 E HN 0.634 nan 8.360 nan 0.000 0.412 2060 T N -2.436 112.156 114.554 0.064 0.000 2.952 2060 T HA 0.123 4.473 4.350 -0.001 0.000 0.286 2060 T C 0.893 175.665 174.700 0.120 0.000 1.024 2060 T CA -0.685 61.467 62.100 0.087 0.000 1.029 2060 T CB 1.767 70.670 68.868 0.059 0.000 1.094 2060 T HN 0.507 nan 8.240 nan 0.000 0.515 2061 Q N -0.217 119.669 119.800 0.144 0.000 2.167 2061 Q HA -0.152 4.188 4.340 -0.001 0.000 0.202 2061 Q C 1.156 177.170 176.000 0.023 0.000 0.970 2061 Q CA 1.590 57.440 55.803 0.078 0.000 0.855 2061 Q CB -0.150 28.500 28.738 -0.145 0.000 0.911 2061 Q HN 0.719 nan 8.270 nan 0.000 0.438 2062 D N 0.392 120.809 120.400 0.028 0.000 2.123 2062 D HA -0.166 4.474 4.640 -0.001 0.000 0.196 2062 D C 1.746 178.079 176.300 0.055 0.000 0.992 2062 D CA 1.082 55.103 54.000 0.034 0.000 0.833 2062 D CB -0.131 40.687 40.800 0.031 0.000 0.954 2062 D HN 0.344 nan 8.370 nan 0.000 0.455 2063 I N 0.611 121.215 120.570 0.057 0.000 2.252 2063 I HA -0.265 3.904 4.170 -0.001 0.000 0.245 2063 I C 2.384 178.542 176.117 0.069 0.000 1.102 2063 I CA 1.012 62.349 61.300 0.061 0.000 1.385 2063 I CB -0.168 37.865 38.000 0.055 0.000 1.064 2063 I HN -0.010 nan 8.210 nan 0.000 0.414 2064 Q N 0.493 120.335 119.800 0.069 0.000 2.124 2064 Q HA -0.177 4.162 4.340 -0.001 0.000 0.202 2064 Q C 2.443 178.480 176.000 0.060 0.000 0.977 2064 Q CA 1.666 57.511 55.803 0.071 0.000 0.850 2064 Q CB -0.271 28.514 28.738 0.079 0.000 0.901 2064 Q HN 0.577 nan 8.270 nan 0.000 0.429 2065 A N 0.813 123.655 122.820 0.038 0.000 1.898 2065 A HA -0.144 4.175 4.320 -0.001 0.000 0.216 2065 A C 2.031 179.664 177.584 0.082 0.000 1.181 2065 A CA 0.924 52.967 52.037 0.010 0.000 0.620 2065 A CB -0.610 18.418 19.000 0.047 0.000 0.819 2065 A HN 0.314 nan 8.150 nan 0.000 0.442 2066 L N -0.982 120.323 121.223 0.136 0.000 2.083 2066 L HA -0.183 4.156 4.340 -0.001 0.000 0.209 2066 L C 2.827 179.771 176.870 0.123 0.000 1.083 2066 L CA 1.669 56.608 54.840 0.164 0.000 0.752 2066 L CB -0.342 41.785 42.059 0.113 0.000 0.899 2066 L HN 0.527 nan 8.230 nan 0.000 0.433 2067 R N -0.350 120.212 120.500 0.104 0.000 2.073 2067 R HA -0.254 4.085 4.340 -0.001 0.000 0.234 2067 R C 2.388 178.758 176.300 0.116 0.000 1.134 2067 R CA 1.937 58.096 56.100 0.099 0.000 0.952 2067 R CB -0.482 29.881 30.300 0.105 0.000 0.850 2067 R HN 0.236 nan 8.270 nan 0.000 0.433 2068 F N 1.127 121.071 119.950 -0.011 0.000 2.046 2068 F HA -0.227 4.299 4.527 -0.001 0.000 0.297 2068 F C 1.879 177.687 175.800 0.014 0.000 1.123 2068 F CA 2.321 60.310 58.000 -0.019 0.000 1.199 2068 F CB -0.675 38.167 39.000 -0.262 0.000 0.972 2068 F HN 0.163 nan 8.300 nan 0.000 0.474 2069 H N -0.998 118.014 119.070 -0.096 0.000 2.422 2069 H HA -0.135 4.420 4.556 -0.001 0.000 0.298 2069 H C 2.290 177.516 175.328 -0.171 0.000 1.098 2069 H CA 1.433 57.362 56.048 -0.198 0.000 1.315 2069 H CB -0.176 29.603 29.762 0.027 0.000 1.382 2069 H HN 0.161 nan 8.280 nan 0.000 0.523 2070 R N 0.669 121.177 120.500 0.014 0.000 2.073 2070 R HA -0.094 4.245 4.340 -0.001 0.000 0.234 2070 R C 1.985 178.245 176.300 -0.067 0.000 1.134 2070 R CA 1.458 57.554 56.100 -0.006 0.000 0.952 2070 R CB 0.007 30.317 30.300 0.016 0.000 0.850 2070 R HN 0.319 nan 8.270 nan 0.000 0.433 2071 N N 0.252 118.892 118.700 -0.101 0.000 2.142 2071 N HA -0.168 4.571 4.740 -0.001 0.000 0.186 2071 N C 1.670 177.063 175.510 -0.194 0.000 1.023 2071 N CA 1.042 53.999 53.050 -0.155 0.000 0.852 2071 N CB -0.296 38.083 38.487 -0.179 0.000 0.998 2071 N HN 0.136 nan 8.380 nan 0.000 0.424 2072 L N 1.877 122.944 121.223 -0.260 0.000 2.079 2072 L HA -0.159 4.180 4.340 -0.001 0.000 0.210 2072 L C 2.211 179.014 176.870 -0.112 0.000 1.081 2072 L CA 1.669 56.376 54.840 -0.222 0.000 0.752 2072 L CB -0.415 41.352 42.059 -0.486 0.000 0.896 2072 L HN -0.049 nan 8.230 nan 0.000 0.433 2073 K N 0.193 120.536 120.400 -0.096 0.000 2.063 2073 K HA -0.144 4.175 4.320 -0.001 0.000 0.208 2073 K C 0.874 177.448 176.600 -0.044 0.000 1.048 2073 K CA 1.309 57.567 56.287 -0.047 0.000 0.928 2073 K CB -0.120 32.360 32.500 -0.032 0.000 0.713 2073 K HN 0.253 nan 8.250 nan 0.000 0.442 2077 S N 2.676 118.392 115.700 0.026 0.000 2.601 2077 S HA 0.409 4.878 4.470 -0.001 0.000 0.271 2077 S C -2.154 172.481 174.600 0.058 0.000 1.305 2077 S CA -0.891 57.331 58.200 0.035 0.000 1.022 2077 S CB 1.263 64.480 63.200 0.029 0.000 0.940 2077 S HN 0.080 nan 8.310 nan 0.000 0.525 2078 P HA -0.049 nan 4.420 nan 0.000 0.216 2078 P C 1.632 179.004 177.300 0.121 0.000 1.153 2078 P CA 0.332 63.484 63.100 0.087 0.000 0.848 2078 P CB -0.014 31.723 31.700 0.060 0.000 0.787 2079 L N 0.352 121.621 121.223 0.078 0.000 2.079 2079 L HA -0.167 4.172 4.340 -0.001 0.000 0.210 2079 L C 2.222 179.182 176.870 0.150 0.000 1.081 2079 L CA 1.900 56.789 54.840 0.081 0.000 0.752 2079 L CB -1.181 40.884 42.059 0.011 0.000 0.896 2079 L HN -0.028 nan 8.230 nan 0.000 0.433 2080 E N -0.689 119.579 120.200 0.114 0.000 2.106 2080 E HA -0.239 4.111 4.350 -0.001 0.000 0.192 2080 E C 2.033 178.740 176.600 0.177 0.000 0.984 2080 E CA 1.044 57.512 56.400 0.114 0.000 0.806 2080 E CB 0.031 29.767 29.700 0.060 0.000 0.750 2080 E HN 0.536 nan 8.360 nan 0.000 0.458 2081 K N -0.425 120.090 120.400 0.192 0.000 2.103 2081 K HA -0.157 4.163 4.320 -0.001 0.000 0.204 2081 K C 2.075 178.848 176.600 0.288 0.000 1.052 2081 K CA 1.207 57.644 56.287 0.249 0.000 0.945 2081 K CB -0.273 32.346 32.500 0.198 0.000 0.722 2081 K HN 0.231 nan 8.250 nan 0.000 0.443 2082 Y N 1.713 122.097 120.300 0.140 0.000 2.145 2082 Y HA -0.185 4.364 4.550 -0.001 0.000 0.286 2082 Y C 1.852 177.826 175.900 0.122 0.000 1.145 2082 Y CA 1.373 59.548 58.100 0.126 0.000 1.148 2082 Y CB -0.080 38.438 38.460 0.097 0.000 0.981 2082 Y HN -0.090 nan 8.280 nan 0.000 0.507 2083 I N -0.702 120.079 120.570 0.351 0.000 2.286 2083 I HA -0.316 3.853 4.170 -0.001 0.000 0.248 2083 I C 2.140 178.346 176.117 0.148 0.000 1.115 2083 I CA 1.558 62.989 61.300 0.217 0.000 1.392 2083 I CB -0.584 37.533 38.000 0.194 0.000 1.065 2083 I HN 0.329 nan 8.210 nan 0.000 0.418 2084 Y N 2.528 122.863 120.300 0.058 0.000 2.153 2084 Y HA -0.049 4.500 4.550 -0.001 0.000 0.289 2084 Y C 1.539 177.490 175.900 0.085 0.000 1.127 2084 Y CA 0.361 58.502 58.100 0.069 0.000 1.131 2084 Y CB -0.542 37.978 38.460 0.100 0.000 0.995 2084 Y HN 0.101 nan 8.280 nan 0.000 0.505 2088 I N 1.415 121.862 120.570 -0.205 0.000 2.394 2088 I HA -0.126 4.044 4.170 -0.001 0.000 0.251 2088 I C 2.616 178.571 176.117 -0.269 0.000 1.136 2088 I CA 1.599 62.792 61.300 -0.178 0.000 1.425 2088 I CB 0.027 37.924 38.000 -0.171 0.000 1.079 2088 I HN 0.283 nan 8.210 nan 0.000 0.425 2089 Q N 1.053 120.480 119.800 -0.621 0.000 2.291 2089 Q HA -0.195 4.145 4.340 -0.001 0.000 0.206 2089 Q C 1.347 177.081 176.000 -0.443 0.000 0.976 2089 Q CA 1.177 56.428 55.803 -0.920 0.000 0.875 2089 Q CB 0.227 27.918 28.738 -1.745 0.000 0.927 2089 Q HN 0.432 nan 8.270 nan 0.000 0.450 2090 E N -0.300 119.707 120.200 -0.322 0.000 2.474 2090 E HA 0.059 4.409 4.350 -0.001 0.000 0.195 2090 E C 1.041 177.566 176.600 -0.126 0.000 1.039 2090 E CA 0.130 56.411 56.400 -0.198 0.000 0.881 2090 E CB 0.481 30.071 29.700 -0.184 0.000 0.970 2090 E HN 0.372 nan 8.360 nan 0.000 0.486 2091 R N -0.171 120.262 120.500 -0.112 0.000 2.243 2091 R HA 0.159 4.499 4.340 -0.001 0.000 0.193 2091 R C 0.548 176.836 176.300 -0.020 0.000 0.933 2091 R CA 0.056 56.125 56.100 -0.051 0.000 1.105 2091 R CB 0.539 30.820 30.300 -0.033 0.000 1.169 2091 R HN -0.130 nan 8.270 nan 0.000 0.599 2092 N N 1.196 119.881 118.700 -0.024 0.000 2.653 2092 N HA 0.001 4.740 4.740 -0.001 0.000 0.261 2092 N C -0.168 175.375 175.510 0.056 0.000 1.216 2092 N CA 0.065 53.136 53.050 0.034 0.000 0.784 2092 N CB 1.602 40.123 38.487 0.056 0.000 1.327 2092 N HN 0.109 nan 8.380 nan 0.000 0.539 2093 E N 2.433 122.683 120.200 0.083 0.000 2.058 2093 E HA -0.190 4.160 4.350 -0.001 0.000 0.194 2093 E C 0.920 177.722 176.600 0.336 0.000 0.997 2093 E CA 1.253 57.748 56.400 0.160 0.000 0.801 2093 E CB 0.319 30.127 29.700 0.180 0.000 0.746 2093 E HN 0.343 nan 8.360 nan 0.000 0.450 2094 K N 0.451 121.051 120.400 0.333 0.000 2.032 2094 K HA -0.186 4.134 4.320 -0.001 0.000 0.209 2094 K C 2.277 178.922 176.600 0.075 0.000 1.048 2094 K CA 0.941 57.396 56.287 0.279 0.000 0.927 2094 K CB -0.714 31.860 32.500 0.125 0.000 0.712 2094 K HN 0.233 nan 8.250 nan 0.000 0.441 2095 L N 0.807 122.041 121.223 0.019 0.000 2.083 2095 L HA -0.131 4.208 4.340 -0.001 0.000 0.209 2095 L C 2.197 178.988 176.870 -0.132 0.000 1.083 2095 L CA 1.376 56.166 54.840 -0.083 0.000 0.752 2095 L CB -0.678 41.368 42.059 -0.021 0.000 0.899 2095 L HN 0.081 nan 8.230 nan 0.000 0.433 2096 F N -0.500 119.296 119.950 -0.257 0.000 2.069 2096 F HA -0.288 4.238 4.527 -0.001 0.000 0.298 2096 F C 2.087 177.618 175.800 -0.449 0.000 1.113 2096 F CA 1.926 59.659 58.000 -0.446 0.000 1.214 2096 F CB -0.728 37.952 39.000 -0.533 0.000 0.978 2096 F HN 0.157 nan 8.300 nan 0.000 0.474 2097 Y N -0.332 119.896 120.300 -0.119 0.000 2.314 2097 Y HA -0.152 4.397 4.550 -0.001 0.000 0.293 2097 Y C 2.567 178.355 175.900 -0.186 0.000 1.129 2097 Y CA 1.121 59.121 58.100 -0.166 0.000 1.201 2097 Y CB -0.429 38.162 38.460 0.218 0.000 0.999 2097 Y HN 0.007 nan 8.280 nan 0.000 0.541 2098 R N 0.903 121.367 120.500 -0.060 0.000 2.096 2098 R HA -0.143 4.196 4.340 -0.001 0.000 0.235 2098 R C 1.739 177.932 176.300 -0.178 0.000 1.127 2098 R CA 1.583 57.608 56.100 -0.125 0.000 0.968 2098 R CB -0.848 29.344 30.300 -0.180 0.000 0.861 2098 R HN 0.205 nan 8.270 nan 0.000 0.440 2099 I N 0.452 120.821 120.570 -0.335 0.000 2.226 2099 I HA -0.202 3.968 4.170 -0.001 0.000 0.245 2099 I C 1.884 177.814 176.117 -0.312 0.000 1.100 2099 I CA 1.051 62.080 61.300 -0.451 0.000 1.374 2099 I CB -0.986 36.434 38.000 -0.967 0.000 1.057 2099 I HN 0.170 nan 8.210 nan 0.000 0.413 2100 L N 0.214 121.198 121.223 -0.398 0.000 2.027 2100 L HA -0.191 4.148 4.340 -0.001 0.000 0.206 2100 L C 2.636 179.435 176.870 -0.117 0.000 1.074 2100 L CA 1.592 56.266 54.840 -0.276 0.000 0.745 2100 L CB -1.195 40.654 42.059 -0.350 0.000 0.898 2100 L HN 0.346 nan 8.230 nan 0.000 0.433 2101 Q N -0.435 119.314 119.800 -0.085 0.000 2.181 2101 Q HA -0.250 4.089 4.340 -0.001 0.000 0.205 2101 Q C 1.556 177.542 176.000 -0.025 0.000 0.980 2101 Q CA 1.779 57.558 55.803 -0.041 0.000 0.862 2101 Q CB -0.025 28.695 28.738 -0.030 0.000 0.905 2101 Q HN 0.458 nan 8.270 nan 0.000 0.429 2102 D N 0.599 120.997 120.400 -0.003 0.000 2.149 2102 D HA -0.109 4.530 4.640 -0.001 0.000 0.198 2102 D C 0.218 176.528 176.300 0.017 0.000 0.990 2102 D CA 1.308 55.331 54.000 0.039 0.000 0.839 2102 D CB 0.091 40.996 40.800 0.174 0.000 0.948 2102 D HN 0.233 nan 8.370 nan 0.000 0.460 2103 D N -0.863 119.553 120.400 0.027 0.000 2.934 2103 D HA -0.003 4.637 4.640 -0.001 0.000 0.249 2103 D C 0.736 177.041 176.300 0.008 0.000 1.293 2103 D CA -0.364 53.643 54.000 0.012 0.000 0.812 2103 D CB -0.078 40.730 40.800 0.014 0.000 1.439 2103 D HN -0.152 nan 8.370 nan 0.000 0.555 2104 I N 1.622 122.180 120.570 -0.019 0.000 2.423 2104 I HA -0.130 4.039 4.170 -0.001 0.000 0.254 2104 I C 1.854 177.956 176.117 -0.025 0.000 1.151 2104 I CA 1.674 62.951 61.300 -0.038 0.000 1.421 2104 I CB -0.047 37.916 38.000 -0.061 0.000 1.079 2104 I HN 0.414 nan 8.210 nan 0.000 0.431 2105 E N -0.295 119.898 120.200 -0.011 0.000 2.106 2105 E HA -0.178 4.172 4.350 -0.001 0.000 0.192 2105 E C 2.138 178.750 176.600 0.021 0.000 0.984 2105 E CA 1.358 57.759 56.400 0.001 0.000 0.806 2105 E CB -0.062 29.644 29.700 0.010 0.000 0.750 2105 E HN 0.651 nan 8.360 nan 0.000 0.458 2106 S N -0.204 115.514 115.700 0.030 0.000 2.478 2106 S HA 0.119 4.589 4.470 -0.001 0.000 0.222 2106 S C 1.146 175.785 174.600 0.065 0.000 1.008 2106 S CA -0.188 58.040 58.200 0.047 0.000 0.928 2106 S CB -0.042 63.187 63.200 0.048 0.000 0.781 2106 S HN 0.089 nan 8.310 nan 0.000 0.518 2110 I N -0.196 120.460 120.570 0.142 0.000 2.556 2110 I HA 0.038 4.207 4.170 -0.001 0.000 0.251 2110 I C 1.979 178.272 176.117 0.294 0.000 1.105 2110 I CA 0.850 62.265 61.300 0.192 0.000 1.436 2110 I CB -0.820 37.287 38.000 0.179 0.000 1.139 2110 I HN -0.099 nan 8.210 nan 0.000 0.438 2111 V N -0.572 119.488 119.914 0.244 0.000 3.235 2111 V HA -0.064 4.055 4.120 -0.001 0.000 0.259 2111 V C 0.959 177.276 176.094 0.372 0.000 1.133 2111 V CA 0.812 63.277 62.300 0.274 0.000 1.128 2111 V CB -0.074 31.835 31.823 0.143 0.000 0.757 2111 V HN 0.339 nan 8.190 nan 0.000 0.469 2112 Y N -0.121 120.262 120.300 0.138 0.000 3.224 2112 Y HA 0.493 5.042 4.550 -0.001 0.000 0.301 2112 Y C 0.735 176.674 175.900 0.065 0.000 1.663 2112 Y CA -0.428 57.734 58.100 0.104 0.000 0.995 2112 Y CB 1.068 39.575 38.460 0.077 0.000 1.381 2112 Y HN -0.111 nan 8.280 nan 0.000 0.643 2113 T N 4.093 118.391 114.554 -0.427 0.000 2.930 2113 T HA 0.172 4.522 4.350 -0.001 0.000 0.306 2113 T C -1.839 172.799 174.700 -0.103 0.000 1.045 2113 T CA -1.138 60.768 62.100 -0.323 0.000 1.134 2113 T CB 0.622 69.217 68.868 -0.455 0.000 0.961 2113 T HN 0.503 nan 8.240 nan 0.000 0.545 2114 P HA 0.069 nan 4.420 nan 0.000 0.228 2114 P C 1.403 178.648 177.300 -0.092 0.000 1.166 2114 P CA 0.538 63.568 63.100 -0.117 0.000 0.812 2114 P CB 0.032 31.667 31.700 -0.109 0.000 0.857 2115 T N 0.731 115.259 114.554 -0.043 0.000 2.760 2115 T HA -0.136 4.213 4.350 -0.001 0.000 0.269 2115 T C 1.851 176.476 174.700 -0.124 0.000 1.047 2115 T CA 1.283 63.354 62.100 -0.047 0.000 1.139 2115 T CB -1.125 67.770 68.868 0.045 0.000 0.855 2115 T HN -0.076 nan 8.240 nan 0.000 0.471 2116 V N 1.349 121.223 119.914 -0.066 0.000 2.490 2116 V HA -0.054 4.066 4.120 -0.001 0.000 0.250 2116 V C 2.512 178.503 176.094 -0.171 0.000 1.061 2116 V CA 2.147 64.392 62.300 -0.090 0.000 1.064 2116 V CB -0.987 30.861 31.823 0.041 0.000 0.670 2116 V HN 0.587 nan 8.190 nan 0.000 0.461 2117 G N -0.396 108.312 108.800 -0.154 0.000 2.408 2117 G HA2 -0.228 3.731 3.960 -0.001 0.000 0.217 2117 G HA3 -0.228 3.731 3.960 -0.001 0.000 0.217 2117 G C 1.484 176.300 174.900 -0.139 0.000 1.150 2117 G CA 1.020 46.035 45.100 -0.140 0.000 0.776 2117 G HN 0.494 nan 8.290 nan 0.000 0.542 2118 L N 1.405 122.538 121.223 -0.150 0.000 2.056 2118 L HA 0.192 4.531 4.340 -0.001 0.000 0.207 2118 L C 3.028 179.781 176.870 -0.195 0.000 1.078 2118 L CA 2.073 56.826 54.840 -0.144 0.000 0.749 2118 L CB -0.748 41.236 42.059 -0.125 0.000 0.901 2118 L HN 0.224 nan 8.230 nan 0.000 0.433 2119 A N -1.452 121.176 122.820 -0.320 0.000 1.902 2119 A HA -0.232 4.087 4.320 -0.001 0.000 0.217 2119 A C 2.410 179.900 177.584 -0.157 0.000 1.181 2119 A CA 1.780 53.591 52.037 -0.376 0.000 0.623 2119 A CB -1.465 16.950 19.000 -0.975 0.000 0.818 2119 A HN 0.615 nan 8.150 nan 0.000 0.443 2120 C N 0.048 119.231 119.300 -0.195 0.000 2.429 2120 C HA -0.100 4.360 4.460 -0.001 0.000 0.277 2120 C C 3.355 178.299 174.990 -0.077 0.000 1.262 2120 C CA 1.506 60.406 59.018 -0.198 0.000 1.733 2120 C CB -1.198 26.428 27.740 -0.191 0.000 2.010 2120 C HN 0.802 nan 8.230 nan 0.000 0.483 2121 S N 0.271 115.936 115.700 -0.058 0.000 2.469 2121 S HA -0.156 4.314 4.470 -0.001 0.000 0.238 2121 S C 1.197 175.761 174.600 -0.059 0.000 0.998 2121 S CA 1.201 59.412 58.200 0.017 0.000 0.957 2121 S CB -0.504 62.684 63.200 -0.020 0.000 0.764 2121 S HN 0.843 nan 8.310 nan 0.000 0.514 2122 Q N -1.435 118.240 119.800 -0.209 0.000 2.112 2122 Q HA 0.287 4.626 4.340 -0.001 0.000 0.222 2122 Q C 0.289 176.065 176.000 -0.373 0.000 0.798 2122 Q CA -0.409 55.180 55.803 -0.356 0.000 1.060 2122 Q CB -0.078 28.501 28.738 -0.266 0.000 1.184 2122 Q HN 0.419 nan 8.270 nan 0.000 0.475 2123 Y N 1.775 121.660 120.300 -0.693 0.000 2.132 2123 Y HA -0.263 4.287 4.550 -0.001 0.000 0.280 2123 Y C 2.256 177.912 175.900 -0.407 0.000 1.193 2123 Y CA 2.217 60.006 58.100 -0.519 0.000 1.157 2123 Y CB -0.399 37.792 38.460 -0.448 0.000 0.966 2123 Y HN 0.286 nan 8.280 nan 0.000 0.511 2124 G N -2.535 105.882 108.800 -0.639 0.000 2.443 2124 G HA2 -0.225 3.734 3.960 -0.001 0.000 0.219 2124 G HA3 -0.225 3.734 3.960 -0.001 0.000 0.219 2124 G C 1.162 176.145 174.900 0.138 0.000 1.131 2124 G CA 0.924 46.055 45.100 0.052 0.000 0.775 2124 G HN 0.444 nan 8.290 nan 0.000 0.547 2125 H N 0.143 119.115 119.070 -0.164 0.000 2.448 2125 H HA 0.113 4.668 4.556 -0.001 0.000 0.292 2125 H C 2.393 177.598 175.328 -0.204 0.000 1.035 2125 H CA 0.823 56.714 56.048 -0.262 0.000 1.349 2125 H CB -0.039 29.627 29.762 -0.160 0.000 1.425 2125 H HN 0.566 nan 8.280 nan 0.000 0.539 2126 I N -3.156 117.407 120.570 -0.011 0.000 3.956 2126 I HA 0.159 4.328 4.170 -0.001 0.000 0.333 2126 I C 0.180 176.256 176.117 -0.068 0.000 1.302 2126 I CA -0.402 60.876 61.300 -0.037 0.000 1.122 2126 I CB -0.196 37.795 38.000 -0.015 0.000 1.013 2126 I HN -0.150 nan 8.210 nan 0.000 0.405 2127 F N 3.385 123.198 119.950 -0.227 0.000 2.629 2127 F HA 0.078 4.605 4.527 -0.001 0.000 0.377 2127 F C 1.123 176.828 175.800 -0.158 0.000 1.101 2127 F CA 0.781 58.631 58.000 -0.250 0.000 1.301 2127 F CB 0.491 39.362 39.000 -0.214 0.000 1.062 2127 F HN 0.061 nan 8.300 nan 0.000 0.583 2128 R N 3.367 123.260 120.500 -1.011 0.000 2.840 2128 R HA 0.306 4.645 4.340 -0.001 0.000 0.173 2128 R C -0.261 175.459 176.300 -0.967 0.000 0.791 2128 R CA -0.496 55.171 56.100 -0.722 0.000 1.069 2128 R CB 0.592 30.675 30.300 -0.362 0.000 1.537 2128 R HN 0.481 nan 8.270 nan 0.000 0.609 2129 R N 1.555 121.472 120.500 -0.972 0.000 2.651 2129 R HA 0.393 4.733 4.340 -0.001 0.000 0.278 2129 R C -2.720 173.329 176.300 -0.418 0.000 1.010 2129 R CA -1.734 54.008 56.100 -0.596 0.000 0.896 2129 R CB 2.607 32.739 30.300 -0.280 0.000 1.211 2129 R HN 0.002 nan 8.270 nan 0.000 0.456 2130 P HA 0.267 nan 4.420 nan 0.000 0.281 2130 P C -1.318 176.128 177.300 0.243 0.000 1.249 2130 P CA -0.466 62.813 63.100 0.299 0.000 0.810 2130 P CB 1.268 33.211 31.700 0.405 0.000 1.008 2131 K N 0.786 121.386 120.400 0.334 0.000 2.422 2131 K HA 0.641 4.960 4.320 -0.001 0.000 0.251 2131 K C 0.004 176.737 176.600 0.221 0.000 0.933 2131 K CA -0.614 55.815 56.287 0.237 0.000 0.798 2131 K CB 2.129 34.713 32.500 0.140 0.000 1.238 2131 K HN 0.895 nan 8.250 nan 0.000 0.428 2132 G N 1.248 110.185 108.800 0.228 0.000 2.796 2132 G HA2 -0.224 3.736 3.960 -0.001 0.000 0.571 2132 G HA3 -0.224 3.736 3.960 -0.001 0.000 0.571 2132 G C -1.147 173.682 174.900 -0.118 0.000 1.370 2132 G CA -0.965 44.076 45.100 -0.100 0.000 0.856 2132 G HN 0.450 nan 8.290 nan 0.000 0.538 2133 L N -0.166 120.792 121.223 -0.440 0.000 2.295 2133 L HA 0.692 5.031 4.340 -0.001 0.000 0.285 2133 L C -0.452 176.182 176.870 -0.393 0.000 1.035 2133 L CA -0.696 54.002 54.840 -0.237 0.000 0.806 2133 L CB 0.968 42.856 42.059 -0.286 0.000 1.214 2133 L HN 0.435 nan 8.230 nan 0.000 0.426 2134 F N 4.846 124.782 119.950 -0.023 0.000 2.426 2134 F HA 0.493 5.019 4.527 -0.001 0.000 0.348 2134 F C 0.148 175.917 175.800 -0.050 0.000 1.124 2134 F CA -0.430 57.539 58.000 -0.053 0.000 1.008 2134 F CB 1.332 40.316 39.000 -0.027 0.000 1.139 2134 F HN 0.169 nan 8.300 nan 0.000 0.452 2135 I N 3.140 123.736 120.570 0.044 0.000 2.410 2135 I HA 0.344 4.513 4.170 -0.001 0.000 0.286 2135 I C -0.342 175.785 176.117 0.017 0.000 1.009 2135 I CA -0.488 60.822 61.300 0.016 0.000 1.111 2135 I CB 1.752 39.712 38.000 -0.068 0.000 1.262 2135 I HN 0.610 nan 8.210 nan 0.000 0.443 2136 S N 5.060 120.788 115.700 0.046 0.000 2.638 2136 S HA 0.406 4.875 4.470 -0.001 0.000 0.298 2136 S C 0.744 175.377 174.600 0.056 0.000 1.111 2136 S CA -0.704 57.521 58.200 0.043 0.000 1.027 2136 S CB 2.053 65.274 63.200 0.035 0.000 1.064 2136 S HN 0.587 nan 8.310 nan 0.000 0.525 2137 I N 2.098 122.708 120.570 0.067 0.000 2.530 2137 I HA -0.102 4.067 4.170 -0.001 0.000 0.257 2137 I C 1.960 178.123 176.117 0.077 0.000 1.179 2137 I CA 1.464 62.814 61.300 0.084 0.000 1.440 2137 I CB -0.676 37.385 38.000 0.100 0.000 1.087 2137 I HN 0.750 nan 8.210 nan 0.000 0.440 2138 S N 0.092 115.833 115.700 0.067 0.000 2.561 2138 S HA -0.029 4.440 4.470 -0.001 0.000 0.225 2138 S C 1.160 175.814 174.600 0.090 0.000 0.977 2138 S CA 0.748 58.989 58.200 0.068 0.000 0.926 2138 S CB -0.315 62.915 63.200 0.050 0.000 0.769 2138 S HN 0.525 nan 8.310 nan 0.000 0.533 2139 D N 1.580 122.038 120.400 0.097 0.000 2.363 2139 D HA 0.029 4.668 4.640 -0.001 0.000 0.214 2139 D C 0.516 176.907 176.300 0.153 0.000 1.093 2139 D CA -0.069 54.013 54.000 0.137 0.000 0.837 2139 D CB 0.163 41.028 40.800 0.109 0.000 0.948 2139 D HN 0.526 nan 8.370 nan 0.000 0.507 2140 R N 0.209 120.773 120.500 0.107 0.000 2.537 2140 R HA 0.223 4.563 4.340 -0.001 0.000 0.281 2140 R C 0.944 177.245 176.300 0.002 0.000 0.988 2140 R CA 0.962 57.097 56.100 0.059 0.000 1.077 2140 R CB 0.007 30.341 30.300 0.057 0.000 0.932 2140 R HN 0.012 nan 8.270 nan 0.000 0.409 2141 G N 2.025 110.772 108.800 -0.087 0.000 2.194 2141 G HA2 -0.242 3.718 3.960 -0.001 0.000 0.236 2141 G HA3 -0.242 3.718 3.960 -0.001 0.000 0.236 2141 G C 0.275 174.854 174.900 -0.535 0.000 0.987 2141 G CA 0.204 45.124 45.100 -0.300 0.000 0.635 2141 G HN 0.810 nan 8.290 nan 0.000 0.520 2142 H N -0.625 118.462 119.070 0.028 0.000 2.865 2142 H HA 0.334 4.889 4.556 -0.001 0.000 0.247 2142 H C 1.862 177.209 175.328 0.031 0.000 1.181 2142 H CA 0.446 56.510 56.048 0.027 0.000 0.975 2142 H CB 0.388 30.167 29.762 0.028 0.000 1.899 2142 H HN 0.231 nan 8.280 nan 0.000 0.651 2143 V N 0.811 120.783 119.914 0.096 0.000 2.490 2143 V HA -0.254 3.866 4.120 -0.001 0.000 0.250 2143 V C 2.743 178.879 176.094 0.070 0.000 1.061 2143 V CA 1.870 64.223 62.300 0.088 0.000 1.064 2143 V CB -0.275 31.594 31.823 0.077 0.000 0.670 2143 V HN 0.192 nan 8.190 nan 0.000 0.461 2144 R N 1.759 122.284 120.500 0.042 0.000 2.075 2144 R HA -0.131 4.208 4.340 -0.001 0.000 0.232 2144 R C 2.548 178.870 176.300 0.036 0.000 1.126 2144 R CA 2.000 58.109 56.100 0.015 0.000 0.963 2144 R CB -0.922 29.375 30.300 -0.005 0.000 0.858 2144 R HN 0.653 nan 8.270 nan 0.000 0.435 2145 S N -0.498 115.243 115.700 0.068 0.000 2.423 2145 S HA -0.083 4.386 4.470 -0.001 0.000 0.231 2145 S C 2.091 176.738 174.600 0.079 0.000 1.014 2145 S CA 1.145 59.387 58.200 0.070 0.000 0.965 2145 S CB -0.444 62.807 63.200 0.086 0.000 0.785 2145 S HN 0.368 nan 8.310 nan 0.000 0.495 2146 I N 1.032 121.658 120.570 0.093 0.000 2.202 2146 I HA -0.095 4.074 4.170 -0.001 0.000 0.242 2146 I C 2.422 178.616 176.117 0.128 0.000 1.091 2146 I CA 0.959 62.325 61.300 0.111 0.000 1.368 2146 I CB -0.331 37.736 38.000 0.112 0.000 1.058 2146 I HN 0.215 nan 8.210 nan 0.000 0.410 2147 V N 0.716 120.690 119.914 0.099 0.000 2.490 2147 V HA -0.282 3.837 4.120 -0.001 0.000 0.250 2147 V C 1.676 177.837 176.094 0.112 0.000 1.061 2147 V CA 1.764 64.122 62.300 0.097 0.000 1.064 2147 V CB -0.663 31.167 31.823 0.011 0.000 0.670 2147 V HN 0.407 nan 8.190 nan 0.000 0.461 2148 D N -0.088 120.353 120.400 0.068 0.000 2.371 2148 D HA -0.064 4.575 4.640 -0.001 0.000 0.221 2148 D C 1.722 178.087 176.300 0.108 0.000 0.986 2148 D CA 0.477 54.512 54.000 0.058 0.000 0.899 2148 D CB -0.207 40.608 40.800 0.025 0.000 0.902 2148 D HN 0.397 nan 8.370 nan 0.000 0.530 2149 N N -0.322 118.468 118.700 0.150 0.000 2.424 2149 N HA -0.076 4.664 4.740 -0.001 0.000 0.178 2149 N C 0.319 175.957 175.510 0.213 0.000 1.060 2149 N CA -0.029 53.111 53.050 0.150 0.000 0.901 2149 N CB 0.122 38.696 38.487 0.145 0.000 0.979 2149 N HN 0.351 nan 8.380 nan 0.000 0.451 2150 W N 2.973 124.321 121.300 0.080 0.000 2.308 2150 W HA 0.059 4.718 4.660 -0.001 0.000 0.324 2150 W C -1.655 174.924 176.519 0.101 0.000 1.387 2150 W CA -1.306 56.099 57.345 0.100 0.000 1.250 2150 W CB 0.989 30.541 29.460 0.153 0.000 1.257 2150 W HN 0.081 nan 8.180 nan 0.000 0.554 2151 P HA -0.189 nan 4.420 nan 0.000 0.215 2151 P C -0.057 177.139 177.300 -0.173 0.000 1.153 2151 P CA 1.635 64.555 63.100 -0.299 0.000 0.853 2151 P CB 0.148 31.588 31.700 -0.434 0.000 0.788 2152 E N 0.202 120.252 120.200 -0.250 0.000 2.344 2152 E HA 0.049 4.398 4.350 -0.001 0.000 0.270 2152 E C 0.668 177.453 176.600 0.308 0.000 1.021 2152 E CA 0.110 56.544 56.400 0.058 0.000 0.887 2152 E CB 0.067 29.840 29.700 0.121 0.000 0.997 2152 E HN 0.203 nan 8.360 nan 0.000 0.429 2153 N N 0.984 119.839 118.700 0.259 0.000 2.373 2153 N HA -0.080 4.660 4.740 -0.001 0.000 0.181 2153 N C 0.062 175.840 175.510 0.446 0.000 1.082 2153 N CA 0.406 53.664 53.050 0.346 0.000 0.885 2153 N CB 0.348 38.944 38.487 0.181 0.000 0.977 2153 N HN 0.490 nan 8.380 nan 0.000 0.462 2154 H N 0.705 119.874 119.070 0.165 0.000 2.336 2154 H HA 0.277 4.833 4.556 -0.001 0.000 0.230 2154 H C -0.837 174.422 175.328 -0.116 0.000 1.426 2154 H CA -0.339 55.758 56.048 0.081 0.000 1.359 2154 H CB 0.342 30.145 29.762 0.070 0.000 1.555 2154 H HN -0.251 nan 8.280 nan 0.000 0.512 2155 V N 3.584 123.244 119.914 -0.424 0.000 2.572 2155 V HA -0.011 4.108 4.120 -0.001 0.000 0.291 2155 V C 0.865 176.740 176.094 -0.364 0.000 1.039 2155 V CA 0.360 62.280 62.300 -0.633 0.000 1.055 2155 V CB 1.346 32.353 31.823 -1.360 0.000 0.969 2155 V HN 0.679 nan 8.190 nan 0.000 0.482 2156 K N 3.140 123.387 120.400 -0.256 0.000 2.399 2156 K HA 0.420 4.739 4.320 -0.001 0.000 0.196 2156 K C 0.275 176.839 176.600 -0.061 0.000 1.103 2156 K CA 0.464 56.667 56.287 -0.140 0.000 0.986 2156 K CB 1.471 33.882 32.500 -0.149 0.000 0.952 2156 K HN 0.663 nan 8.250 nan 0.000 0.541 2157 A N 1.310 124.075 122.820 -0.091 0.000 2.398 2157 A HA 0.599 4.918 4.320 -0.001 0.000 0.301 2157 A C -0.999 176.478 177.584 -0.177 0.000 1.041 2157 A CA -0.533 51.483 52.037 -0.034 0.000 0.711 2157 A CB 1.679 20.770 19.000 0.151 0.000 1.240 2157 A HN -0.098 nan 8.150 nan 0.000 0.420 2158 V N 2.384 122.199 119.914 -0.165 0.000 2.604 2158 V HA 0.582 4.702 4.120 -0.001 0.000 0.305 2158 V C -0.586 175.356 176.094 -0.253 0.000 1.043 2158 V CA -0.548 61.613 62.300 -0.230 0.000 0.888 2158 V CB 1.895 33.618 31.823 -0.167 0.000 0.995 2158 V HN 0.700 nan 8.190 nan 0.000 0.429 2159 V N 5.165 124.886 119.914 -0.321 0.000 2.444 2159 V HA 0.578 4.697 4.120 -0.001 0.000 0.294 2159 V C -0.425 175.478 176.094 -0.318 0.000 1.022 2159 V CA -0.561 61.545 62.300 -0.325 0.000 0.850 2159 V CB 1.889 33.491 31.823 -0.369 0.000 0.992 2159 V HN 0.622 nan 8.190 nan 0.000 0.426 2160 V N 4.746 124.466 119.914 -0.323 0.000 2.680 2160 V HA 0.876 4.995 4.120 -0.001 0.000 0.309 2160 V C -0.359 175.609 176.094 -0.211 0.000 1.052 2160 V CA 0.187 62.272 62.300 -0.359 0.000 0.908 2160 V CB 2.494 34.005 31.823 -0.519 0.000 1.001 2160 V HN 0.968 nan 8.190 nan 0.000 0.431 2161 T N 2.569 116.927 114.554 -0.326 0.000 2.864 2161 T HA 0.492 4.841 4.350 -0.001 0.000 0.299 2161 T C -0.638 173.659 174.700 -0.671 0.000 1.166 2161 T CA 0.184 61.998 62.100 -0.477 0.000 1.007 2161 T CB 1.793 70.465 68.868 -0.326 0.000 1.219 2161 T HN 0.949 nan 8.240 nan 0.000 0.506 2162 D N -0.032 119.820 120.400 -0.914 0.000 2.503 2162 D HA 0.224 4.864 4.640 -0.001 0.000 0.218 2162 D C 1.287 177.386 176.300 -0.336 0.000 1.183 2162 D CA 0.547 54.217 54.000 -0.549 0.000 0.827 2162 D CB -0.342 40.160 40.800 -0.496 0.000 1.034 2162 D HN 1.061 nan 8.370 nan 0.000 0.510 2163 G N 1.544 110.144 108.800 -0.332 0.000 2.258 2163 G HA2 -0.408 3.551 3.960 -0.001 0.000 0.274 2163 G HA3 -0.408 3.551 3.960 -0.001 0.000 0.274 2163 G C 0.667 175.480 174.900 -0.144 0.000 1.021 2163 G CA 0.822 45.807 45.100 -0.192 0.000 0.798 2163 G HN 0.521 nan 8.290 nan 0.000 0.507 2164 E N -0.550 119.552 120.200 -0.163 0.000 2.318 2164 E HA 0.069 4.418 4.350 -0.001 0.000 0.193 2164 E C 1.627 178.189 176.600 -0.063 0.000 0.998 2164 E CA 0.234 56.576 56.400 -0.097 0.000 0.859 2164 E CB 0.110 29.764 29.700 -0.077 0.000 0.812 2164 E HN 0.427 nan 8.360 nan 0.000 0.492 2165 R N 1.393 121.855 120.500 -0.063 0.000 2.644 2165 R HA 0.182 4.521 4.340 -0.001 0.000 0.271 2165 R C -1.091 175.179 176.300 -0.050 0.000 1.687 2165 R CA -0.488 55.590 56.100 -0.037 0.000 1.655 2165 R CB 0.193 30.491 30.300 -0.003 0.000 1.285 2165 R HN 0.040 nan 8.270 nan 0.000 0.643 2166 I N 5.587 126.119 120.570 -0.063 0.000 2.363 2166 I HA 0.066 4.235 4.170 -0.001 0.000 0.292 2166 I C 1.488 177.565 176.117 -0.066 0.000 1.075 2166 I CA 0.302 61.559 61.300 -0.073 0.000 1.333 2166 I CB -0.368 37.585 38.000 -0.080 0.000 1.415 2166 I HN 0.690 nan 8.210 nan 0.000 0.502 2167 L N 5.190 126.373 121.223 -0.066 0.000 5.891 2167 L HA -0.314 4.025 4.340 -0.001 0.000 0.053 2167 L C 1.360 178.201 176.870 -0.049 0.000 2.528 2167 L CA 1.473 56.273 54.840 -0.067 0.000 1.612 2167 L CB -1.566 40.438 42.059 -0.093 0.000 2.817 2167 L HN 0.695 nan 8.230 nan 0.000 0.990 2168 G N -1.055 107.714 108.800 -0.051 0.000 3.774 2168 G HA2 0.440 4.399 3.960 -0.001 0.000 0.287 2168 G HA3 0.440 4.399 3.960 -0.001 0.000 0.287 2168 G C 0.652 175.529 174.900 -0.039 0.000 1.030 2168 G CA -0.212 44.864 45.100 -0.040 0.000 0.824 2168 G HN 0.197 nan 8.290 nan 0.000 0.518 2169 L N 0.286 121.483 121.223 -0.044 0.000 2.529 2169 L HA 0.305 4.644 4.340 -0.001 0.000 0.223 2169 L C 1.697 178.547 176.870 -0.034 0.000 1.113 2169 L CA 1.247 56.064 54.840 -0.039 0.000 0.861 2169 L CB -1.323 40.710 42.059 -0.043 0.000 1.012 2169 L HN 0.408 nan 8.230 nan 0.000 0.461 2170 G N 0.011 108.789 108.800 -0.036 0.000 2.484 2170 G HA2 -0.231 3.728 3.960 -0.001 0.000 0.225 2170 G HA3 -0.231 3.728 3.960 -0.001 0.000 0.225 2170 G C -0.447 174.428 174.900 -0.043 0.000 1.250 2170 G CA -0.169 44.910 45.100 -0.035 0.000 0.926 2170 G HN 0.173 nan 8.290 nan 0.000 0.581 2171 D N 1.203 121.574 120.400 -0.048 0.000 2.336 2171 D HA 0.468 5.107 4.640 -0.001 0.000 0.249 2171 D C 1.174 177.438 176.300 -0.059 0.000 1.213 2171 D CA -0.096 53.868 54.000 -0.060 0.000 0.870 2171 D CB 0.500 41.259 40.800 -0.068 0.000 1.076 2171 D HN 0.392 nan 8.370 nan 0.000 0.483 2172 L N 3.359 124.556 121.223 -0.043 0.000 3.122 2172 L HA 0.270 4.609 4.340 -0.001 0.000 0.274 2172 L C 1.582 178.468 176.870 0.026 0.000 1.222 2172 L CA -0.289 54.549 54.840 -0.004 0.000 1.028 2172 L CB 0.156 42.247 42.059 0.053 0.000 1.386 2172 L HN 0.607 nan 8.230 nan 0.000 0.578 2173 G N 0.986 109.784 108.800 -0.004 0.000 2.602 2173 G HA2 -0.360 3.599 3.960 -0.001 0.000 0.306 2173 G HA3 -0.360 3.599 3.960 -0.001 0.000 0.306 2173 G C 0.850 175.799 174.900 0.082 0.000 1.301 2173 G CA 0.317 45.458 45.100 0.068 0.000 0.974 2173 G HN -0.072 nan 8.290 nan 0.000 0.547 2174 V N 0.483 120.455 119.914 0.097 0.000 2.867 2174 V HA -0.150 3.969 4.120 -0.001 0.000 0.260 2174 V C 2.291 178.533 176.094 0.247 0.000 1.099 2174 V CA 2.540 64.895 62.300 0.092 0.000 1.122 2174 V CB -0.883 30.911 31.823 -0.049 0.000 0.708 2174 V HN 0.553 nan 8.190 nan 0.000 0.490 2175 Y N 0.744 121.106 120.300 0.103 0.000 2.483 2175 Y HA -0.040 4.509 4.550 -0.001 0.000 0.291 2175 Y C 1.960 177.738 175.900 -0.204 0.000 1.143 2175 Y CA -0.138 58.003 58.100 0.069 0.000 1.289 2175 Y CB -0.150 38.390 38.460 0.134 0.000 0.983 2175 Y HN 0.445 nan 8.280 nan 0.000 0.556 2179 I N 1.893 122.368 120.570 -0.158 0.000 2.163 2179 I HA 0.003 4.172 4.170 -0.001 0.000 0.240 2179 I C -0.259 175.814 176.117 -0.072 0.000 1.081 2179 I CA 1.140 62.388 61.300 -0.087 0.000 1.353 2179 I CB -1.684 36.246 38.000 -0.115 0.000 1.054 2179 I HN 0.021 nan 8.210 nan 0.000 0.407 2180 P HA -0.065 nan 4.420 nan 0.000 0.218 2180 P C 2.222 179.445 177.300 -0.129 0.000 1.149 2180 P CA 0.940 63.937 63.100 -0.172 0.000 0.817 2180 P CB 0.133 31.689 31.700 -0.239 0.000 0.785 2181 V N -0.169 119.703 119.914 -0.070 0.000 2.358 2181 V HA -0.151 3.969 4.120 -0.001 0.000 0.246 2181 V C 2.552 178.678 176.094 0.053 0.000 1.047 2181 V CA 2.517 64.811 62.300 -0.011 0.000 1.035 2181 V CB -1.814 30.041 31.823 0.054 0.000 0.658 2181 V HN 0.166 nan 8.190 nan 0.000 0.452 2182 G N -0.531 108.336 108.800 0.111 0.000 2.402 2182 G HA2 -0.267 3.693 3.960 -0.001 0.000 0.216 2182 G HA3 -0.267 3.693 3.960 -0.001 0.000 0.216 2182 G C 1.626 176.653 174.900 0.212 0.000 1.162 2182 G CA 0.946 46.172 45.100 0.210 0.000 0.777 2182 G HN 0.382 nan 8.290 nan 0.000 0.539 2183 K N 0.278 120.767 120.400 0.147 0.000 2.032 2183 K HA 0.085 4.404 4.320 -0.001 0.000 0.209 2183 K C 2.483 179.160 176.600 0.129 0.000 1.048 2183 K CA 0.844 57.200 56.287 0.115 0.000 0.927 2183 K CB -0.615 31.809 32.500 -0.127 0.000 0.712 2183 K HN 0.330 nan 8.250 nan 0.000 0.441 2184 L N -0.267 120.914 121.223 -0.070 0.000 2.201 2184 L HA -0.224 4.115 4.340 -0.001 0.000 0.212 2184 L C 2.291 179.231 176.870 0.117 0.000 1.105 2184 L CA 0.688 55.436 54.840 -0.154 0.000 0.775 2184 L CB -0.365 41.540 42.059 -0.257 0.000 0.913 2184 L HN 0.261 nan 8.230 nan 0.000 0.440 2185 C N -0.146 119.272 119.300 0.197 0.000 2.425 2185 C HA -0.143 4.316 4.460 -0.001 0.000 0.277 2185 C C 2.667 177.847 174.990 0.318 0.000 1.280 2185 C CA 0.557 59.788 59.018 0.354 0.000 1.744 2185 C CB -0.715 27.223 27.740 0.329 0.000 1.989 2185 C HN 0.452 nan 8.230 nan 0.000 0.491 2186 L N -1.273 120.096 121.223 0.244 0.000 2.217 2186 L HA -0.095 4.245 4.340 -0.001 0.000 0.211 2186 L C 2.417 179.415 176.870 0.214 0.000 1.107 2186 L CA 1.082 56.017 54.840 0.158 0.000 0.783 2186 L CB -0.634 41.461 42.059 0.059 0.000 0.919 2186 L HN 0.292 nan 8.230 nan 0.000 0.442 2187 Y N 0.766 121.142 120.300 0.128 0.000 2.128 2187 Y HA -0.288 4.262 4.550 -0.001 0.000 0.284 2187 Y C 2.840 178.715 175.900 -0.041 0.000 1.154 2187 Y CA 1.954 60.102 58.100 0.081 0.000 1.149 2187 Y CB -0.839 37.662 38.460 0.067 0.000 0.976 2187 Y HN 0.121 nan 8.280 nan 0.000 0.505 2188 T N -0.578 114.010 114.554 0.057 0.000 2.809 2188 T HA -0.067 4.283 4.350 -0.001 0.000 0.260 2188 T C 2.192 176.802 174.700 -0.149 0.000 1.039 2188 T CA 1.171 63.133 62.100 -0.229 0.000 1.141 2188 T CB -0.677 67.707 68.868 -0.807 0.000 0.869 2188 T HN 0.361 nan 8.240 nan 0.000 0.437 2189 A N 0.530 123.345 122.820 -0.008 0.000 1.902 2189 A HA -0.115 4.204 4.320 -0.001 0.000 0.217 2189 A C 2.606 180.186 177.584 -0.007 0.000 1.181 2189 A CA 1.597 53.675 52.037 0.068 0.000 0.623 2189 A CB -1.167 17.904 19.000 0.118 0.000 0.818 2189 A HN 0.640 nan 8.150 nan 0.000 0.443 2190 C N -2.064 117.209 119.300 -0.044 0.000 2.519 2190 C HA 0.437 4.896 4.460 -0.001 0.000 0.281 2190 C C 2.785 177.724 174.990 -0.085 0.000 1.331 2190 C CA 0.574 59.535 59.018 -0.096 0.000 1.725 2190 C CB -0.671 26.960 27.740 -0.182 0.000 2.079 2190 C HN 0.677 nan 8.230 nan 0.000 0.496 2191 A N -0.548 122.223 122.820 -0.081 0.000 2.431 2191 A HA 0.505 4.824 4.320 -0.001 0.000 0.239 2191 A C 1.530 179.091 177.584 -0.039 0.000 1.230 2191 A CA 0.943 52.933 52.037 -0.078 0.000 0.928 2191 A CB -0.584 18.339 19.000 -0.128 0.000 1.006 2191 A HN 1.158 nan 8.150 nan 0.000 0.520 2192 G N 0.099 108.895 108.800 -0.007 0.000 2.198 2192 G HA2 -0.245 3.714 3.960 -0.001 0.000 0.260 2192 G HA3 -0.245 3.714 3.960 -0.001 0.000 0.260 2192 G C 0.130 175.064 174.900 0.056 0.000 1.025 2192 G CA 0.443 45.583 45.100 0.067 0.000 0.769 2192 G HN 0.509 nan 8.290 nan 0.000 0.507 2193 I N 0.532 121.090 120.570 -0.020 0.000 2.588 2193 I HA 0.136 4.305 4.170 -0.001 0.000 0.283 2193 I C 1.404 177.426 176.117 -0.159 0.000 1.119 2193 I CA -0.477 60.804 61.300 -0.030 0.000 1.419 2193 I CB 0.494 38.523 38.000 0.049 0.000 1.394 2193 I HN 0.116 nan 8.210 nan 0.000 0.562 2194 R N 8.155 128.557 120.500 -0.165 0.000 2.458 2194 R HA 0.035 4.374 4.340 -0.001 0.000 0.303 2194 R C -1.387 174.642 176.300 -0.452 0.000 1.013 2194 R CA -1.027 54.832 56.100 -0.402 0.000 1.026 2194 R CB 0.106 30.305 30.300 -0.169 0.000 0.948 2194 R HN 0.462 nan 8.270 nan 0.000 0.417 2195 P HA -0.222 nan 4.420 nan 0.000 0.216 2195 P C 0.427 177.602 177.300 -0.208 0.000 1.150 2195 P CA 1.402 64.239 63.100 -0.437 0.000 0.837 2195 P CB 0.100 31.487 31.700 -0.522 0.000 0.786 2196 D N -0.803 119.484 120.400 -0.189 0.000 2.371 2196 D HA -0.121 4.518 4.640 -0.001 0.000 0.221 2196 D C 1.338 177.614 176.300 -0.040 0.000 0.986 2196 D CA 0.503 54.467 54.000 -0.060 0.000 0.899 2196 D CB -0.392 40.391 40.800 -0.028 0.000 0.902 2196 D HN 0.120 nan 8.370 nan 0.000 0.530 2197 R N -0.228 120.207 120.500 -0.108 0.000 2.432 2197 R HA 0.221 4.560 4.340 -0.001 0.000 0.260 2197 R C -0.106 176.105 176.300 -0.148 0.000 0.935 2197 R CA -0.196 55.820 56.100 -0.140 0.000 1.080 2197 R CB -0.128 30.066 30.300 -0.176 0.000 1.155 2197 R HN 0.159 nan 8.270 nan 0.000 0.531 2198 C N 1.277 120.506 119.300 -0.119 0.000 2.391 2198 C HA 0.641 5.100 4.460 -0.001 0.000 0.339 2198 C C -0.234 174.655 174.990 -0.167 0.000 1.205 2198 C CA -0.977 57.940 59.018 -0.168 0.000 1.937 2198 C CB 1.267 28.898 27.740 -0.182 0.000 2.341 2198 C HN 0.278 nan 8.230 nan 0.000 0.516 2199 L N 5.171 126.211 121.223 -0.306 0.000 2.491 2199 L HA 0.571 4.910 4.340 -0.001 0.000 0.267 2199 L C -2.848 173.746 176.870 -0.461 0.000 0.971 2199 L CA -1.602 52.951 54.840 -0.478 0.000 0.857 2199 L CB 1.559 43.225 42.059 -0.655 0.000 1.226 2199 L HN 0.400 nan 8.230 nan 0.000 0.408 2200 P HA 0.481 nan 4.420 nan 0.000 0.285 2200 P C -1.347 175.672 177.300 -0.469 0.000 1.259 2200 P CA -0.337 62.535 63.100 -0.380 0.000 0.794 2200 P CB 1.679 33.216 31.700 -0.272 0.000 0.940 2201 V N 2.806 122.453 119.914 -0.445 0.000 2.760 2201 V HA 0.402 4.522 4.120 -0.001 0.000 0.309 2201 V C -0.622 175.164 176.094 -0.514 0.000 1.077 2201 V CA -0.513 61.486 62.300 -0.502 0.000 0.910 2201 V CB 2.430 33.978 31.823 -0.459 0.000 1.008 2201 V HN 0.682 nan 8.190 nan 0.000 0.424 2202 C N 6.627 125.594 119.300 -0.555 0.000 2.340 2202 C HA 0.665 5.124 4.460 -0.001 0.000 0.323 2202 C C -0.578 174.215 174.990 -0.329 0.000 1.260 2202 C CA -0.513 58.247 59.018 -0.429 0.000 1.464 2202 C CB -0.123 27.381 27.740 -0.393 0.000 2.156 2202 C HN 0.704 nan 8.230 nan 0.000 0.476 2203 I N 5.471 125.849 120.570 -0.319 0.000 2.297 2203 I HA 0.279 4.448 4.170 -0.001 0.000 0.291 2203 I C 0.011 176.070 176.117 -0.096 0.000 1.033 2203 I CA 0.290 61.453 61.300 -0.229 0.000 1.253 2203 I CB 0.952 38.801 38.000 -0.252 0.000 1.396 2203 I HN 0.692 nan 8.210 nan 0.000 0.476 2204 D N 6.455 126.839 120.400 -0.027 0.000 2.373 2204 D HA 0.320 4.960 4.640 -0.001 0.000 0.227 2204 D C 0.540 176.863 176.300 0.039 0.000 1.091 2204 D CA -0.368 53.637 54.000 0.007 0.000 0.840 2204 D CB 1.310 42.119 40.800 0.015 0.000 1.060 2204 D HN 0.339 nan 8.370 nan 0.000 0.502 2205 V N 1.688 121.634 119.914 0.053 0.000 3.159 2205 V HA 0.730 4.849 4.120 -0.001 0.000 0.333 2205 V C 0.745 176.855 176.094 0.026 0.000 1.424 2205 V CA 0.405 62.750 62.300 0.075 0.000 1.125 2205 V CB -0.330 31.589 31.823 0.160 0.000 1.075 2205 V HN 0.746 nan 8.190 nan 0.000 0.482 2206 G N -0.135 108.675 108.800 0.017 0.000 2.498 2206 G HA2 0.286 4.245 3.960 -0.001 0.000 0.651 2206 G HA3 0.286 4.245 3.960 -0.001 0.000 0.651 2206 G C -0.477 174.412 174.900 -0.019 0.000 1.284 2206 G CA 0.032 45.136 45.100 0.006 0.000 0.950 2206 G HN 1.309 nan 8.290 nan 0.000 0.511 2207 T N -1.412 113.110 114.554 -0.053 0.000 2.923 2207 T HA 0.590 4.939 4.350 -0.001 0.000 0.311 2207 T C -0.651 173.983 174.700 -0.110 0.000 1.183 2207 T CA 0.226 62.269 62.100 -0.096 0.000 1.020 2207 T CB 1.805 70.581 68.868 -0.153 0.000 1.165 2207 T HN 0.407 nan 8.240 nan 0.000 0.482 2208 D N 1.853 122.192 120.400 -0.102 0.000 2.349 2208 D HA 0.128 4.768 4.640 -0.001 0.000 0.214 2208 D C 0.338 176.580 176.300 -0.097 0.000 1.063 2208 D CA 0.040 53.989 54.000 -0.086 0.000 0.847 2208 D CB 0.195 40.955 40.800 -0.066 0.000 0.933 2208 D HN 0.427 nan 8.370 nan 0.000 0.513 2209 N N 2.060 120.680 118.700 -0.134 0.000 2.402 2209 N HA -0.026 4.714 4.740 -0.001 0.000 0.259 2209 N C 1.205 176.623 175.510 -0.152 0.000 1.167 2209 N CA -0.165 52.803 53.050 -0.137 0.000 0.949 2209 N CB 0.434 38.822 38.487 -0.165 0.000 1.212 2209 N HN -0.099 nan 8.380 nan 0.000 0.493 2210 I N 2.733 123.243 120.570 -0.100 0.000 2.264 2210 I HA -0.246 3.923 4.170 -0.001 0.000 0.248 2210 I C 2.159 178.224 176.117 -0.086 0.000 1.111 2210 I CA 0.839 62.089 61.300 -0.083 0.000 1.382 2210 I CB -1.666 36.303 38.000 -0.053 0.000 1.060 2210 I HN 0.538 nan 8.210 nan 0.000 0.418 2211 A N 1.228 123.999 122.820 -0.080 0.000 1.883 2211 A HA -0.168 4.151 4.320 -0.001 0.000 0.217 2211 A C 2.397 179.928 177.584 -0.087 0.000 1.186 2211 A CA 1.419 53.422 52.037 -0.057 0.000 0.624 2211 A CB -0.842 18.139 19.000 -0.032 0.000 0.822 2211 A HN 0.427 nan 8.150 nan 0.000 0.444 2212 L N -0.807 120.292 121.223 -0.207 0.000 2.141 2212 L HA -0.091 4.249 4.340 -0.001 0.000 0.209 2212 L C 2.300 178.944 176.870 -0.378 0.000 1.094 2212 L CA 0.620 55.218 54.840 -0.404 0.000 0.763 2212 L CB -0.503 41.065 42.059 -0.818 0.000 0.908 2212 L HN 0.340 nan 8.230 nan 0.000 0.437 2213 L N -0.174 120.898 121.223 -0.252 0.000 2.362 2213 L HA -0.164 4.176 4.340 -0.001 0.000 0.219 2213 L C 1.827 178.748 176.870 0.085 0.000 1.134 2213 L CA 1.192 56.020 54.840 -0.021 0.000 0.807 2213 L CB -0.207 41.828 42.059 -0.040 0.000 0.927 2213 L HN 0.258 nan 8.230 nan 0.000 0.447 2214 K N -1.387 119.019 120.400 0.010 0.000 2.387 2214 K HA 0.083 4.402 4.320 -0.001 0.000 0.203 2214 K C -0.043 176.562 176.600 0.008 0.000 1.030 2214 K CA -0.214 56.062 56.287 -0.018 0.000 1.099 2214 K CB 0.463 32.944 32.500 -0.031 0.000 0.863 2214 K HN -0.022 nan 8.250 nan 0.000 0.529 2215 D N 2.478 122.934 120.400 0.093 0.000 2.316 2215 D HA 0.056 4.695 4.640 -0.001 0.000 0.245 2215 D C -1.505 174.890 176.300 0.157 0.000 1.171 2215 D CA -2.248 51.840 54.000 0.146 0.000 0.856 2215 D CB 1.518 42.466 40.800 0.246 0.000 1.090 2215 D HN -0.051 nan 8.370 nan 0.000 0.476 2216 P HA -0.068 nan 4.420 nan 0.000 0.230 2216 P C 0.707 177.890 177.300 -0.195 0.000 1.158 2216 P CA 0.492 63.445 63.100 -0.245 0.000 0.769 2216 P CB 0.041 31.434 31.700 -0.511 0.000 0.807 2217 F N -2.270 117.810 119.950 0.218 0.000 2.727 2217 F HA 0.220 4.746 4.527 -0.001 0.000 0.302 2217 F C 1.565 177.572 175.800 0.343 0.000 1.097 2217 F CA -1.452 56.673 58.000 0.209 0.000 1.330 2217 F CB -1.156 37.930 39.000 0.144 0.000 1.084 2217 F HN -0.141 nan 8.300 nan 0.000 0.578 2221 L N 0.436 121.543 121.223 -0.194 0.000 2.410 2221 L HA 0.266 4.606 4.340 -0.001 0.000 0.273 2221 L C -0.433 176.417 176.870 -0.033 0.000 1.152 2221 L CA -0.338 54.459 54.840 -0.072 0.000 0.855 2221 L CB 0.484 42.543 42.059 -0.000 0.000 1.129 2221 L HN 0.483 nan 8.230 nan 0.000 0.463 2222 Y N 3.427 123.792 120.300 0.110 0.000 2.636 2222 Y HA 0.181 4.730 4.550 -0.001 0.000 0.334 2222 Y C 0.491 176.407 175.900 0.026 0.000 1.286 2222 Y CA -0.232 57.915 58.100 0.078 0.000 1.688 2222 Y CB -0.025 38.463 38.460 0.048 0.000 1.662 2222 Y HN 0.542 nan 8.280 nan 0.000 0.465 2223 Q N -0.099 119.762 119.800 0.101 0.000 2.522 2223 Q HA 0.452 4.791 4.340 -0.001 0.000 0.285 2223 Q C -1.389 174.619 176.000 0.012 0.000 0.982 2223 Q CA -1.432 54.405 55.803 0.057 0.000 0.805 2223 Q CB 1.453 30.223 28.738 0.053 0.000 1.457 2223 Q HN -0.012 nan 8.270 nan 0.000 0.394 2224 K N 1.224 121.623 120.400 -0.001 0.000 2.180 2224 K HA 0.281 4.601 4.320 -0.001 0.000 0.251 2224 K C -0.159 176.425 176.600 -0.027 0.000 1.014 2224 K CA -0.292 55.980 56.287 -0.025 0.000 0.913 2224 K CB 0.394 32.881 32.500 -0.023 0.000 1.008 2224 K HN 0.571 nan 8.250 nan 0.000 0.490 2225 R N 1.624 122.094 120.500 -0.050 0.000 2.522 2225 R HA -0.050 4.290 4.340 -0.001 0.000 0.284 2225 R C 0.221 176.484 176.300 -0.062 0.000 1.032 2225 R CA 0.067 56.124 56.100 -0.071 0.000 1.049 2225 R CB 0.246 30.476 30.300 -0.117 0.000 0.956 2225 R HN 0.464 nan 8.270 nan 0.000 0.422 2226 D N 2.952 123.325 120.400 -0.045 0.000 2.336 2226 D HA 0.022 4.662 4.640 -0.001 0.000 0.249 2226 D C 0.132 176.402 176.300 -0.050 0.000 1.213 2226 D CA 0.053 54.051 54.000 -0.003 0.000 0.870 2226 D CB 0.662 41.500 40.800 0.065 0.000 1.076 2226 D HN 0.420 nan 8.370 nan 0.000 0.483 2227 R N 2.044 122.524 120.500 -0.033 0.000 2.427 2227 R HA 0.104 4.443 4.340 -0.001 0.000 0.262 2227 R C 0.930 177.278 176.300 0.081 0.000 0.943 2227 R CA -0.216 55.863 56.100 -0.036 0.000 1.081 2227 R CB 0.522 30.794 30.300 -0.047 0.000 1.166 2227 R HN 0.482 nan 8.270 nan 0.000 0.534 2228 T N -2.378 112.242 114.554 0.110 0.000 2.793 2228 T HA -0.020 4.329 4.350 -0.001 0.000 0.299 2228 T C 1.225 176.040 174.700 0.192 0.000 1.038 2228 T CA -0.523 61.653 62.100 0.127 0.000 0.948 2228 T CB 0.897 69.823 68.868 0.097 0.000 1.231 2228 T HN -0.090 nan 8.240 nan 0.000 0.538 2229 Q N -0.198 119.695 119.800 0.155 0.000 2.364 2229 Q HA -0.094 4.246 4.340 -0.001 0.000 0.209 2229 Q C 2.286 178.388 176.000 0.170 0.000 0.977 2229 Q CA 1.554 57.454 55.803 0.163 0.000 0.885 2229 Q CB -0.641 28.166 28.738 0.114 0.000 0.941 2229 Q HN 0.766 nan 8.270 nan 0.000 0.464 2230 Q N -1.475 118.423 119.800 0.162 0.000 2.226 2230 Q HA -0.196 4.143 4.340 -0.001 0.000 0.204 2230 Q C 1.395 177.516 176.000 0.201 0.000 0.975 2230 Q CA 1.317 57.210 55.803 0.149 0.000 0.866 2230 Q CB -0.199 28.615 28.738 0.127 0.000 0.915 2230 Q HN 0.536 nan 8.270 nan 0.000 0.440 2231 Y N 1.981 122.358 120.300 0.128 0.000 2.133 2231 Y HA -0.212 4.337 4.550 -0.001 0.000 0.287 2231 Y C 1.338 177.367 175.900 0.215 0.000 1.134 2231 Y CA 1.925 60.126 58.100 0.168 0.000 1.133 2231 Y CB -0.187 38.390 38.460 0.196 0.000 0.987 2231 Y HN 0.073 nan 8.280 nan 0.000 0.502 2232 D N 0.087 120.590 120.400 0.171 0.000 2.144 2232 D HA -0.162 4.478 4.640 -0.001 0.000 0.199 2232 D C 1.707 178.036 176.300 0.048 0.000 0.984 2232 D CA 1.680 55.751 54.000 0.119 0.000 0.834 2232 D CB -0.337 40.613 40.800 0.250 0.000 0.955 2232 D HN 0.385 nan 8.370 nan 0.000 0.465 2233 D N -0.221 120.225 120.400 0.076 0.000 2.144 2233 D HA -0.103 4.536 4.640 -0.001 0.000 0.199 2233 D C 2.014 178.328 176.300 0.024 0.000 0.984 2233 D CA 0.310 54.344 54.000 0.058 0.000 0.834 2233 D CB -0.268 40.572 40.800 0.066 0.000 0.955 2233 D HN 0.122 nan 8.370 nan 0.000 0.465 2234 L N 0.702 121.930 121.223 0.009 0.000 2.017 2234 L HA -0.121 4.218 4.340 -0.001 0.000 0.208 2234 L C 2.023 178.863 176.870 -0.051 0.000 1.073 2234 L CA 1.271 56.108 54.840 -0.005 0.000 0.745 2234 L CB -0.420 41.650 42.059 0.018 0.000 0.894 2234 L HN -0.031 nan 8.230 nan 0.000 0.432 2235 I N -0.196 120.269 120.570 -0.175 0.000 2.264 2235 I HA -0.306 3.863 4.170 -0.001 0.000 0.248 2235 I C 2.334 178.363 176.117 -0.146 0.000 1.111 2235 I CA 1.575 62.727 61.300 -0.248 0.000 1.382 2235 I CB -1.254 36.358 38.000 -0.647 0.000 1.060 2235 I HN 0.498 nan 8.210 nan 0.000 0.418 2236 D N 0.478 120.845 120.400 -0.055 0.000 2.117 2236 D HA -0.209 4.430 4.640 -0.001 0.000 0.198 2236 D C 2.002 178.286 176.300 -0.026 0.000 0.982 2236 D CA 0.940 54.957 54.000 0.028 0.000 0.828 2236 D CB 0.255 41.128 40.800 0.121 0.000 0.967 2236 D HN 0.386 nan 8.370 nan 0.000 0.464 2237 E N -0.663 119.534 120.200 -0.006 0.000 2.110 2237 E HA -0.153 4.197 4.350 -0.001 0.000 0.193 2237 E C 0.983 177.561 176.600 -0.036 0.000 0.988 2237 E CA 0.182 56.576 56.400 -0.010 0.000 0.804 2237 E CB -0.044 29.662 29.700 0.011 0.000 0.745 2237 E HN 0.126 nan 8.360 nan 0.000 0.458 2241 A N 2.103 124.799 122.820 -0.207 0.000 1.877 2241 A HA -0.086 4.233 4.320 -0.001 0.000 0.216 2241 A C 1.915 179.354 177.584 -0.241 0.000 1.186 2241 A CA 1.473 53.404 52.037 -0.177 0.000 0.620 2241 A CB -0.461 18.468 19.000 -0.120 0.000 0.822 2241 A HN 0.320 nan 8.150 nan 0.000 0.443 2242 I N 0.802 121.134 120.570 -0.396 0.000 2.179 2242 I HA -0.202 3.967 4.170 -0.001 0.000 0.242 2242 I C 2.858 178.868 176.117 -0.178 0.000 1.088 2242 I CA 2.360 63.460 61.300 -0.333 0.000 1.357 2242 I CB -1.590 36.045 38.000 -0.609 0.000 1.051 2242 I HN 0.583 nan 8.210 nan 0.000 0.409 2243 T N -2.166 112.275 114.554 -0.189 0.000 2.867 2243 T HA -0.126 4.223 4.350 -0.001 0.000 0.268 2243 T C 1.510 176.196 174.700 -0.024 0.000 1.057 2243 T CA 1.114 63.192 62.100 -0.035 0.000 1.136 2243 T CB -0.311 68.612 68.868 0.092 0.000 0.874 2243 T HN 0.142 nan 8.240 nan 0.000 0.466 2244 D N 1.060 121.419 120.400 -0.069 0.000 2.178 2244 D HA 0.004 4.643 4.640 -0.001 0.000 0.202 2244 D C 2.212 178.447 176.300 -0.108 0.000 0.974 2244 D CA 0.754 54.716 54.000 -0.064 0.000 0.841 2244 D CB -0.210 40.552 40.800 -0.064 0.000 0.953 2244 D HN 0.485 nan 8.370 nan 0.000 0.478 2245 R N -0.963 119.413 120.500 -0.208 0.000 2.105 2245 R HA 0.001 4.340 4.340 -0.001 0.000 0.214 2245 R C 1.423 177.516 176.300 -0.345 0.000 1.091 2245 R CA 0.629 56.516 56.100 -0.355 0.000 1.007 2245 R CB 0.067 29.991 30.300 -0.628 0.000 0.912 2245 R HN 0.224 nan 8.270 nan 0.000 0.450 2246 Y N -0.717 119.586 120.300 0.005 0.000 2.458 2246 Y HA 0.374 4.923 4.550 -0.001 0.000 0.254 2246 Y C 0.610 176.541 175.900 0.051 0.000 1.120 2246 Y CA 0.010 58.135 58.100 0.042 0.000 1.282 2246 Y CB 1.579 40.059 38.460 0.033 0.000 1.109 2246 Y HN 0.310 nan 8.280 nan 0.000 0.526 2247 G N 0.371 109.256 108.800 0.142 0.000 2.465 2247 G HA2 -0.120 3.839 3.960 -0.001 0.000 0.681 2247 G HA3 -0.120 3.839 3.960 -0.001 0.000 0.681 2247 G C -0.441 174.514 174.900 0.091 0.000 1.340 2247 G CA -0.837 44.328 45.100 0.108 0.000 0.884 2247 G HN 0.011 nan 8.290 nan 0.000 0.650 2248 R N 0.759 121.300 120.500 0.068 0.000 2.235 2248 R HA 0.010 4.349 4.340 -0.001 0.000 0.213 2248 R C 2.029 178.368 176.300 0.065 0.000 1.059 2248 R CA 1.893 58.039 56.100 0.076 0.000 0.997 2248 R CB -0.054 30.255 30.300 0.015 0.000 0.884 2248 R HN 0.638 nan 8.270 nan 0.000 0.462 2249 N N -0.909 117.819 118.700 0.046 0.000 2.279 2249 N HA -0.006 4.733 4.740 -0.001 0.000 0.226 2249 N C -0.840 174.710 175.510 0.065 0.000 1.126 2249 N CA -0.058 53.011 53.050 0.032 0.000 0.846 2249 N CB 0.199 38.699 38.487 0.020 0.000 1.050 2249 N HN -0.145 nan 8.380 nan 0.000 0.502 2250 T N 1.863 116.462 114.554 0.075 0.000 2.834 2250 T HA 0.094 4.443 4.350 -0.001 0.000 0.298 2250 T C 0.454 175.188 174.700 0.058 0.000 0.966 2250 T CA -0.420 61.714 62.100 0.057 0.000 1.141 2250 T CB 1.234 70.130 68.868 0.047 0.000 0.905 2250 T HN 0.228 nan 8.240 nan 0.000 0.535 2251 L N 5.148 126.417 121.223 0.076 0.000 2.418 2251 L HA 0.330 4.669 4.340 -0.001 0.000 0.274 2251 L C -0.507 176.410 176.870 0.080 0.000 1.135 2251 L CA 0.012 54.933 54.840 0.135 0.000 0.870 2251 L CB 0.082 42.263 42.059 0.204 0.000 1.154 2251 L HN 0.642 nan 8.230 nan 0.000 0.462 2252 I N 5.596 126.215 120.570 0.080 0.000 2.390 2252 I HA 0.220 4.389 4.170 -0.001 0.000 0.283 2252 I C -0.170 175.924 176.117 -0.037 0.000 1.016 2252 I CA -0.322 60.968 61.300 -0.017 0.000 1.151 2252 I CB 1.636 39.605 38.000 -0.052 0.000 1.293 2252 I HN 0.587 nan 8.210 nan 0.000 0.458 2253 Q N 6.441 126.126 119.800 -0.192 0.000 2.360 2253 Q HA 0.389 4.728 4.340 -0.001 0.000 0.254 2253 Q C -1.371 174.452 176.000 -0.295 0.000 0.975 2253 Q CA -0.657 54.867 55.803 -0.465 0.000 0.912 2253 Q CB 0.899 29.360 28.738 -0.461 0.000 1.212 2253 Q HN 0.418 nan 8.270 nan 0.000 0.452 2254 F N 2.767 122.486 119.950 -0.385 0.000 2.427 2254 F HA 0.248 4.775 4.527 -0.001 0.000 0.352 2254 F C 0.362 176.101 175.800 -0.101 0.000 1.100 2254 F CA -0.158 57.728 58.000 -0.189 0.000 1.191 2254 F CB 1.173 39.982 39.000 -0.318 0.000 1.128 2254 F HN 0.554 nan 8.300 nan 0.000 0.533 2255 E N 2.007 122.322 120.200 0.193 0.000 2.246 2255 E HA 0.321 4.670 4.350 -0.001 0.000 0.266 2255 E C -1.233 175.447 176.600 0.134 0.000 0.880 2255 E CA -0.549 55.904 56.400 0.087 0.000 0.762 2255 E CB 0.824 30.479 29.700 -0.075 0.000 1.180 2255 E HN 0.477 nan 8.360 nan 0.000 0.416 2256 D N 2.548 123.010 120.400 0.104 0.000 2.699 2256 D HA -0.225 4.415 4.640 -0.001 0.000 0.239 2256 D C -0.949 175.369 176.300 0.031 0.000 1.136 2256 D CA 0.936 54.959 54.000 0.038 0.000 0.668 2256 D CB -1.360 39.407 40.800 -0.054 0.000 1.060 2256 D HN 0.232 nan 8.370 nan 0.000 0.429 2257 F N 0.461 120.425 119.950 0.023 0.000 2.403 2257 F HA 0.568 5.095 4.527 -0.001 0.000 0.326 2257 F C 1.909 177.725 175.800 0.026 0.000 1.081 2257 F CA 0.008 58.054 58.000 0.077 0.000 1.041 2257 F CB 0.896 40.007 39.000 0.185 0.000 1.234 2257 F HN -0.018 nan 8.300 nan 0.000 0.503 2258 G N 1.243 110.169 108.800 0.211 0.000 2.690 2258 G HA2 -0.085 3.874 3.960 -0.001 0.000 0.239 2258 G HA3 -0.085 3.874 3.960 -0.001 0.000 0.239 2258 G C 0.943 175.910 174.900 0.112 0.000 1.233 2258 G CA -0.300 44.871 45.100 0.119 0.000 0.847 2258 G HN 0.748 nan 8.290 nan 0.000 0.588 2259 N N -0.187 118.573 118.700 0.100 0.000 2.036 2259 N HA -0.235 4.505 4.740 -0.001 0.000 0.195 2259 N C 1.829 177.455 175.510 0.193 0.000 1.037 2259 N CA 2.038 55.167 53.050 0.132 0.000 0.855 2259 N CB -0.349 38.235 38.487 0.163 0.000 1.033 2259 N HN 0.718 nan 8.380 nan 0.000 0.423 2260 H N 0.682 119.805 119.070 0.089 0.000 2.293 2260 H HA 0.070 4.625 4.556 -0.001 0.000 0.300 2260 H C 1.758 177.070 175.328 -0.027 0.000 1.082 2260 H CA 2.365 58.454 56.048 0.069 0.000 1.308 2260 H CB -0.510 29.270 29.762 0.031 0.000 1.375 2260 H HN 0.417 nan 8.280 nan 0.000 0.495 2261 N N -0.195 118.422 118.700 -0.140 0.000 2.149 2261 N HA -0.179 4.560 4.740 -0.001 0.000 0.188 2261 N C 2.006 177.198 175.510 -0.530 0.000 1.019 2261 N CA 0.806 53.575 53.050 -0.468 0.000 0.857 2261 N CB -0.138 38.319 38.487 -0.051 0.000 0.997 2261 N HN 0.445 nan 8.380 nan 0.000 0.426 2262 A N 0.918 123.601 122.820 -0.228 0.000 1.865 2262 A HA -0.156 4.163 4.320 -0.001 0.000 0.217 2262 A C 1.858 179.167 177.584 -0.458 0.000 1.191 2262 A CA 1.317 53.165 52.037 -0.314 0.000 0.623 2262 A CB -0.954 17.857 19.000 -0.314 0.000 0.826 2262 A HN 0.234 nan 8.150 nan 0.000 0.444 2263 F N -0.808 118.936 119.950 -0.343 0.000 2.113 2263 F HA -0.077 4.450 4.527 -0.001 0.000 0.297 2263 F C 2.527 178.146 175.800 -0.301 0.000 1.103 2263 F CA 1.737 59.504 58.000 -0.389 0.000 1.248 2263 F CB -0.270 38.372 39.000 -0.598 0.000 0.999 2263 F HN 0.120 nan 8.300 nan 0.000 0.475 2264 R N -0.063 120.314 120.500 -0.204 0.000 2.105 2264 R HA -0.172 4.167 4.340 -0.001 0.000 0.239 2264 R C 2.143 178.365 176.300 -0.130 0.000 1.135 2264 R CA 1.656 57.619 56.100 -0.229 0.000 0.967 2264 R CB -0.484 29.538 30.300 -0.463 0.000 0.861 2264 R HN 0.297 nan 8.270 nan 0.000 0.442 2265 F N -0.518 119.295 119.950 -0.228 0.000 2.234 2265 F HA -0.126 4.400 4.527 -0.001 0.000 0.296 2265 F C 2.113 177.716 175.800 -0.328 0.000 1.089 2265 F CA -0.207 57.632 58.000 -0.270 0.000 1.343 2265 F CB -0.092 38.655 39.000 -0.423 0.000 1.040 2265 F HN 0.112 nan 8.300 nan 0.000 0.498 2266 L N 1.126 122.223 121.223 -0.211 0.000 1.994 2266 L HA -0.193 4.146 4.340 -0.001 0.000 0.208 2266 L C 2.436 179.289 176.870 -0.030 0.000 1.071 2266 L CA 1.792 56.523 54.840 -0.182 0.000 0.745 2266 L CB -0.750 41.194 42.059 -0.191 0.000 0.892 2266 L HN -0.039 nan 8.230 nan 0.000 0.431 2267 R N -0.259 120.241 120.500 0.001 0.000 2.081 2267 R HA -0.226 4.113 4.340 -0.001 0.000 0.235 2267 R C 2.488 178.772 176.300 -0.027 0.000 1.131 2267 R CA 2.018 58.142 56.100 0.040 0.000 0.960 2267 R CB -0.321 30.040 30.300 0.102 0.000 0.856 2267 R HN 0.444 nan 8.270 nan 0.000 0.436 2268 K N -1.107 119.222 120.400 -0.118 0.000 2.148 2268 K HA -0.154 4.165 4.320 -0.001 0.000 0.204 2268 K C 0.939 177.314 176.600 -0.374 0.000 1.050 2268 K CA 1.471 57.575 56.287 -0.306 0.000 0.942 2268 K CB 0.085 32.280 32.500 -0.508 0.000 0.724 2268 K HN 0.340 nan 8.250 nan 0.000 0.446 2269 Y N -0.118 120.226 120.300 0.074 0.000 2.444 2269 Y HA 0.136 4.686 4.550 -0.001 0.000 0.252 2269 Y C 1.903 177.912 175.900 0.182 0.000 1.091 2269 Y CA -0.292 57.908 58.100 0.168 0.000 1.276 2269 Y CB 0.337 38.902 38.460 0.176 0.000 1.170 2269 Y HN 0.011 nan 8.280 nan 0.000 0.517 2270 R N 0.663 121.303 120.500 0.234 0.000 2.139 2270 R HA -0.148 4.191 4.340 -0.001 0.000 0.243 2270 R C 0.765 177.202 176.300 0.227 0.000 1.145 2270 R CA 1.812 58.053 56.100 0.234 0.000 0.976 2270 R CB -0.311 30.089 30.300 0.166 0.000 0.866 2270 R HN 0.215 nan 8.270 nan 0.000 0.449 2271 E N 0.564 120.814 120.200 0.083 0.000 2.447 2271 E HA 0.012 4.362 4.350 -0.001 0.000 0.195 2271 E C 1.176 177.678 176.600 -0.163 0.000 1.028 2271 E CA 0.471 56.768 56.400 -0.172 0.000 0.876 2271 E CB 0.439 30.042 29.700 -0.163 0.000 0.885 2271 E HN 0.453 nan 8.360 nan 0.000 0.500 2272 K N -0.653 119.795 120.400 0.080 0.000 2.335 2272 K HA 0.092 4.411 4.320 -0.001 0.000 0.195 2272 K C -0.098 176.394 176.600 -0.179 0.000 1.058 2272 K CA 0.322 56.573 56.287 -0.059 0.000 0.988 2272 K CB 0.622 33.018 32.500 -0.172 0.000 0.880 2272 K HN -0.083 nan 8.250 nan 0.000 0.513 2273 Y N -1.512 118.968 120.300 0.301 0.000 2.665 2273 Y HA 0.297 4.846 4.550 -0.001 0.000 0.336 2273 Y C -0.654 175.333 175.900 0.145 0.000 1.085 2273 Y CA -1.338 56.855 58.100 0.155 0.000 1.096 2273 Y CB 1.220 39.736 38.460 0.093 0.000 1.301 2273 Y HN -0.196 nan 8.280 nan 0.000 0.493 2274 C N 2.125 121.567 119.300 0.236 0.000 2.158 2274 C HA 0.652 5.111 4.460 -0.001 0.000 0.350 2274 C C -0.020 175.129 174.990 0.264 0.000 1.064 2274 C CA 0.224 59.347 59.018 0.176 0.000 1.507 2274 C CB -2.081 25.717 27.740 0.096 0.000 1.934 2274 C HN 0.690 nan 8.230 nan 0.000 0.479 2275 T N 4.652 119.405 114.554 0.332 0.000 2.868 2275 T HA 0.802 5.151 4.350 -0.001 0.000 0.306 2275 T C -1.135 173.819 174.700 0.424 0.000 1.224 2275 T CA -0.353 61.950 62.100 0.338 0.000 1.012 2275 T CB 1.289 70.332 68.868 0.292 0.000 1.221 2275 T HN 0.909 nan 8.240 nan 0.000 0.499 2276 F N 1.487 121.573 119.950 0.227 0.000 2.713 2276 F HA 0.651 5.177 4.527 -0.001 0.000 0.311 2276 F C -1.453 174.416 175.800 0.114 0.000 1.141 2276 F CA -1.127 56.971 58.000 0.164 0.000 0.939 2276 F CB 1.359 40.545 39.000 0.309 0.000 1.325 2276 F HN 0.477 nan 8.300 nan 0.000 0.453 2277 N N 2.117 120.848 118.700 0.052 0.000 2.446 2277 N HA 0.135 4.874 4.740 -0.001 0.000 0.265 2277 N C -0.158 175.389 175.510 0.061 0.000 0.975 2277 N CA -0.137 52.861 53.050 -0.085 0.000 0.928 2277 N CB 1.607 39.988 38.487 -0.176 0.000 1.160 2277 N HN 0.950 nan 8.380 nan 0.000 0.495 2278 D N 2.359 122.770 120.400 0.018 0.000 2.144 2278 D HA -0.124 4.515 4.640 -0.001 0.000 0.199 2278 D C 0.631 177.010 176.300 0.132 0.000 0.984 2278 D CA 1.333 55.471 54.000 0.229 0.000 0.834 2278 D CB 0.367 41.226 40.800 0.098 0.000 0.955 2278 D HN 0.570 nan 8.370 nan 0.000 0.465 2279 D N -0.634 119.786 120.400 0.034 0.000 2.269 2279 D HA -0.033 4.606 4.640 -0.001 0.000 0.208 2279 D C 2.048 178.317 176.300 -0.052 0.000 0.963 2279 D CA 0.435 54.437 54.000 0.005 0.000 0.864 2279 D CB 0.522 41.311 40.800 -0.018 0.000 0.936 2279 D HN 0.396 nan 8.370 nan 0.000 0.505 2280 I N 0.173 120.669 120.570 -0.123 0.000 2.685 2280 I HA -0.112 4.057 4.170 -0.001 0.000 0.251 2280 I C 2.229 178.261 176.117 -0.142 0.000 1.102 2280 I CA 0.438 61.627 61.300 -0.185 0.000 1.442 2280 I CB 0.126 37.908 38.000 -0.363 0.000 1.194 2280 I HN -0.205 nan 8.210 nan 0.000 0.448 2281 Q N 0.537 120.208 119.800 -0.214 0.000 2.226 2281 Q HA 0.073 4.412 4.340 -0.001 0.000 0.199 2281 Q C 2.257 178.030 176.000 -0.378 0.000 0.945 2281 Q CA 1.123 56.634 55.803 -0.487 0.000 0.861 2281 Q CB -0.166 27.918 28.738 -1.089 0.000 0.953 2281 Q HN 0.522 nan 8.270 nan 0.000 0.490 2282 G N 0.440 109.199 108.800 -0.069 0.000 2.404 2282 G HA2 -0.222 3.737 3.960 -0.001 0.000 0.215 2282 G HA3 -0.222 3.737 3.960 -0.001 0.000 0.215 2282 G C 1.404 176.437 174.900 0.222 0.000 1.174 2282 G CA 1.327 46.571 45.100 0.240 0.000 0.780 2282 G HN 0.226 nan 8.290 nan 0.000 0.537 2283 T N 1.620 116.275 114.554 0.168 0.000 2.788 2283 T HA 0.053 4.402 4.350 -0.001 0.000 0.268 2283 T C 2.796 177.592 174.700 0.160 0.000 1.044 2283 T CA 1.357 63.556 62.100 0.166 0.000 1.139 2283 T CB -0.309 68.635 68.868 0.127 0.000 0.867 2283 T HN 0.366 nan 8.240 nan 0.000 0.454 2284 A N 1.514 124.397 122.820 0.107 0.000 1.908 2284 A HA 0.083 4.402 4.320 -0.001 0.000 0.218 2284 A C 2.629 180.312 177.584 0.165 0.000 1.181 2284 A CA 1.912 54.018 52.037 0.115 0.000 0.627 2284 A CB -1.084 17.941 19.000 0.043 0.000 0.818 2284 A HN 0.513 nan 8.150 nan 0.000 0.445 2285 A N -0.665 122.268 122.820 0.188 0.000 1.930 2285 A HA 0.068 4.387 4.320 -0.001 0.000 0.217 2285 A C 2.180 179.900 177.584 0.227 0.000 1.175 2285 A CA 1.699 53.873 52.037 0.229 0.000 0.627 2285 A CB -0.768 18.425 19.000 0.321 0.000 0.815 2285 A HN 0.444 nan 8.150 nan 0.000 0.443 2286 V N -0.228 119.833 119.914 0.245 0.000 2.453 2286 V HA -0.155 3.964 4.120 -0.001 0.000 0.247 2286 V C 2.968 179.283 176.094 0.367 0.000 1.048 2286 V CA 1.624 64.094 62.300 0.284 0.000 1.049 2286 V CB -1.351 30.599 31.823 0.212 0.000 0.672 2286 V HN 0.570 nan 8.190 nan 0.000 0.457 2287 A N 0.428 123.442 122.820 0.323 0.000 1.877 2287 A HA -0.198 4.122 4.320 -0.001 0.000 0.216 2287 A C 2.188 179.973 177.584 0.335 0.000 1.186 2287 A CA 2.106 54.385 52.037 0.404 0.000 0.620 2287 A CB -0.662 18.547 19.000 0.348 0.000 0.822 2287 A HN 0.437 nan 8.150 nan 0.000 0.443 2288 L N 0.005 121.367 121.223 0.232 0.000 2.013 2288 L HA -0.162 4.177 4.340 -0.001 0.000 0.212 2288 L C 2.684 179.631 176.870 0.129 0.000 1.073 2288 L CA 2.422 57.358 54.840 0.160 0.000 0.753 2288 L CB -0.872 41.272 42.059 0.142 0.000 0.890 2288 L HN 0.371 nan 8.230 nan 0.000 0.432 2289 A N -0.689 122.215 122.820 0.142 0.000 1.948 2289 A HA -0.139 4.180 4.320 -0.001 0.000 0.220 2289 A C 2.325 179.858 177.584 -0.086 0.000 1.177 2289 A CA 1.748 53.816 52.037 0.051 0.000 0.636 2289 A CB -1.563 17.498 19.000 0.101 0.000 0.815 2289 A HN 0.575 nan 8.150 nan 0.000 0.449 2290 G N -0.638 108.155 108.800 -0.013 0.000 2.394 2290 G HA2 -0.014 3.945 3.960 -0.001 0.000 0.215 2290 G HA3 -0.014 3.945 3.960 -0.001 0.000 0.215 2290 G C 1.315 176.283 174.900 0.113 0.000 1.165 2290 G CA 0.969 46.014 45.100 -0.092 0.000 0.784 2290 G HN 0.340 nan 8.290 nan 0.000 0.535 2291 L N 0.092 121.376 121.223 0.101 0.000 2.083 2291 L HA 0.059 4.398 4.340 -0.001 0.000 0.209 2291 L C 2.736 179.598 176.870 -0.013 0.000 1.083 2291 L CA 0.916 55.730 54.840 -0.042 0.000 0.752 2291 L CB -0.914 41.096 42.059 -0.081 0.000 0.899 2291 L HN 0.095 nan 8.230 nan 0.000 0.433 2292 L N -0.846 120.380 121.223 0.006 0.000 2.093 2292 L HA -0.087 4.252 4.340 -0.001 0.000 0.208 2292 L C 2.584 179.448 176.870 -0.011 0.000 1.085 2292 L CA 1.785 56.631 54.840 0.009 0.000 0.755 2292 L CB -1.341 40.725 42.059 0.011 0.000 0.904 2292 L HN 0.215 nan 8.230 nan 0.000 0.435 2293 A N -0.704 122.086 122.820 -0.050 0.000 1.898 2293 A HA -0.080 4.239 4.320 -0.001 0.000 0.216 2293 A C 2.511 180.085 177.584 -0.016 0.000 1.181 2293 A CA 1.560 53.560 52.037 -0.060 0.000 0.620 2293 A CB -0.879 18.031 19.000 -0.150 0.000 0.819 2293 A HN 0.358 nan 8.150 nan 0.000 0.442 2294 A N -0.683 122.138 122.820 0.001 0.000 1.883 2294 A HA -0.245 4.074 4.320 -0.001 0.000 0.217 2294 A C 2.148 179.742 177.584 0.017 0.000 1.186 2294 A CA 2.201 54.254 52.037 0.025 0.000 0.624 2294 A CB -0.637 18.375 19.000 0.020 0.000 0.822 2294 A HN 0.536 nan 8.150 nan 0.000 0.444 2295 Q N 0.034 119.843 119.800 0.014 0.000 2.297 2295 Q HA -0.150 4.189 4.340 -0.001 0.000 0.208 2295 Q C 1.860 177.888 176.000 0.046 0.000 0.981 2295 Q CA 2.077 57.910 55.803 0.049 0.000 0.876 2295 Q CB -0.363 28.430 28.738 0.093 0.000 0.921 2295 Q HN 0.668 nan 8.270 nan 0.000 0.446 2296 K N -0.756 119.662 120.400 0.030 0.000 2.365 2296 K HA -0.059 4.260 4.320 -0.001 0.000 0.199 2296 K C 1.482 178.100 176.600 0.029 0.000 1.045 2296 K CA 1.191 57.493 56.287 0.025 0.000 0.962 2296 K CB 0.193 32.700 32.500 0.012 0.000 0.759 2296 K HN 0.316 nan 8.250 nan 0.000 0.469 2297 V N -2.464 117.471 119.914 0.035 0.000 3.621 2297 V HA 0.141 4.260 4.120 -0.001 0.000 0.263 2297 V C 1.406 177.526 176.094 0.043 0.000 1.272 2297 V CA 0.256 62.581 62.300 0.041 0.000 1.080 2297 V CB 0.055 31.910 31.823 0.053 0.000 0.816 2297 V HN 0.100 nan 8.190 nan 0.000 0.451 2298 I N 0.552 121.148 120.570 0.043 0.000 2.731 2298 I HA 0.146 4.316 4.170 -0.001 0.000 0.260 2298 I C 1.334 177.482 176.117 0.053 0.000 1.138 2298 I CA 0.809 62.135 61.300 0.044 0.000 1.461 2298 I CB 0.033 38.053 38.000 0.033 0.000 1.128 2298 I HN 0.335 nan 8.210 nan 0.000 0.438 2299 S N 1.982 117.719 115.700 0.061 0.000 3.524 2299 S HA -0.213 4.257 4.470 -0.001 0.000 0.377 2299 S C 0.240 174.883 174.600 0.071 0.000 0.949 2299 S CA 0.657 58.892 58.200 0.059 0.000 1.264 2299 S CB -1.351 61.872 63.200 0.038 0.000 0.918 2299 S HN 0.414 nan 8.310 nan 0.000 0.517 2300 K N 1.287 121.765 120.400 0.131 0.000 2.201 2300 K HA 0.366 4.685 4.320 -0.001 0.000 0.278 2300 K C -2.666 173.974 176.600 0.067 0.000 1.027 2300 K CA -2.372 54.004 56.287 0.149 0.000 0.909 2300 K CB 0.664 33.316 32.500 0.253 0.000 1.062 2300 K HN -0.050 nan 8.250 nan 0.000 0.465 2301 P HA -0.082 nan 4.420 nan 0.000 0.260 2301 P C 0.594 177.764 177.300 -0.217 0.000 1.185 2301 P CA 0.323 63.382 63.100 -0.070 0.000 0.763 2301 P CB 0.349 32.033 31.700 -0.027 0.000 0.776 2302 I N 3.335 123.719 120.570 -0.311 0.000 2.381 2302 I HA -0.346 3.823 4.170 -0.001 0.000 0.255 2302 I C 1.665 177.618 176.117 -0.274 0.000 1.140 2302 I CA 2.158 63.178 61.300 -0.468 0.000 1.404 2302 I CB 0.070 37.924 38.000 -0.243 0.000 1.075 2302 I HN 0.353 nan 8.210 nan 0.000 0.433 2303 S N -0.776 114.845 115.700 -0.132 0.000 2.461 2303 S HA -0.078 4.391 4.470 -0.001 0.000 0.228 2303 S C 1.506 176.106 174.600 0.001 0.000 1.005 2303 S CA 0.536 58.708 58.200 -0.047 0.000 0.942 2303 S CB -0.263 62.921 63.200 -0.027 0.000 0.776 2303 S HN 0.592 nan 8.310 nan 0.000 0.514 2304 E N 0.477 120.682 120.200 0.009 0.000 2.437 2304 E HA 0.143 4.492 4.350 -0.001 0.000 0.189 2304 E C -0.414 176.298 176.600 0.187 0.000 1.054 2304 E CA -0.181 56.267 56.400 0.080 0.000 0.874 2304 E CB 0.088 29.829 29.700 0.069 0.000 1.011 2304 E HN 0.705 nan 8.360 nan 0.000 0.474 2305 H N 1.053 120.138 119.070 0.026 0.000 2.646 2305 H HA 0.227 4.782 4.556 -0.001 0.000 0.325 2305 H C -0.138 175.223 175.328 0.055 0.000 1.075 2305 H CA -0.210 55.854 56.048 0.027 0.000 1.421 2305 H CB 0.882 30.660 29.762 0.026 0.000 1.461 2305 H HN -0.191 nan 8.280 nan 0.000 0.525 2306 K N 3.944 124.424 120.400 0.132 0.000 2.613 2306 K HA 0.278 4.597 4.320 -0.001 0.000 0.248 2306 K C -1.806 174.844 176.600 0.085 0.000 0.959 2306 K CA -0.489 55.885 56.287 0.145 0.000 0.855 2306 K CB 0.468 33.035 32.500 0.111 0.000 1.143 2306 K HN 0.353 nan 8.250 nan 0.000 0.437 2307 I N 4.363 125.019 120.570 0.143 0.000 2.359 2307 I HA 0.412 4.581 4.170 -0.001 0.000 0.294 2307 I C -0.995 175.215 176.117 0.155 0.000 0.987 2307 I CA -0.816 60.511 61.300 0.045 0.000 1.225 2307 I CB 1.477 39.479 38.000 0.004 0.000 1.366 2307 I HN 0.493 nan 8.210 nan 0.000 0.466 2308 L N 7.300 128.544 121.223 0.034 0.000 2.349 2308 L HA 0.607 4.947 4.340 -0.001 0.000 0.278 2308 L C -1.465 175.500 176.870 0.159 0.000 0.996 2308 L CA -0.119 54.832 54.840 0.185 0.000 0.825 2308 L CB 0.819 42.925 42.059 0.078 0.000 1.243 2308 L HN 0.270 nan 8.230 nan 0.000 0.412 2309 F N 4.948 125.106 119.950 0.346 0.000 2.404 2309 F HA 0.487 5.014 4.527 -0.001 0.000 0.339 2309 F C -0.116 175.931 175.800 0.413 0.000 1.105 2309 F CA -0.388 57.796 58.000 0.306 0.000 1.087 2309 F CB 1.716 40.822 39.000 0.177 0.000 1.143 2309 F HN 0.378 nan 8.300 nan 0.000 0.491 2310 L N 4.018 125.493 121.223 0.420 0.000 2.272 2310 L HA 0.759 5.098 4.340 -0.001 0.000 0.284 2310 L C -0.090 176.907 176.870 0.211 0.000 1.045 2310 L CA 0.165 55.108 54.840 0.171 0.000 0.842 2310 L CB -0.027 41.851 42.059 -0.301 0.000 1.224 2310 L HN 0.712 nan 8.230 nan 0.000 0.430 2311 G N 3.600 112.569 108.800 0.281 0.000 2.576 2311 G HA2 0.408 4.367 3.960 -0.001 0.000 0.686 2311 G HA3 0.408 4.367 3.960 -0.001 0.000 0.686 2311 G C -0.636 174.362 174.900 0.164 0.000 1.242 2311 G CA -0.392 44.813 45.100 0.176 0.000 0.819 2311 G HN 1.375 nan 8.290 nan 0.000 0.655 2312 A N 0.494 123.369 122.820 0.091 0.000 3.045 2312 A HA 0.841 5.161 4.320 -0.001 0.000 0.244 2312 A C 0.881 178.479 177.584 0.023 0.000 0.917 2312 A CA 0.991 53.044 52.037 0.026 0.000 1.075 2312 A CB 0.006 19.040 19.000 0.057 0.000 1.202 2312 A HN 2.263 nan 8.150 nan 0.000 0.486 2313 G N -0.727 108.099 108.800 0.043 0.000 3.135 2313 G HA2 0.455 4.414 3.960 -0.001 0.000 0.159 2313 G HA3 0.455 4.414 3.960 -0.001 0.000 0.159 2313 G C 0.544 175.548 174.900 0.172 0.000 1.244 2313 G CA 0.131 45.301 45.100 0.117 0.000 0.965 2313 G HN 0.266 nan 8.290 nan 0.000 0.599 2314 E N -0.244 120.055 120.200 0.165 0.000 2.095 2314 E HA -0.304 4.046 4.350 -0.001 0.000 0.212 2314 E C 2.736 179.327 176.600 -0.014 0.000 1.044 2314 E CA 1.799 58.183 56.400 -0.027 0.000 0.857 2314 E CB -0.267 29.327 29.700 -0.176 0.000 0.764 2314 E HN 0.382 nan 8.360 nan 0.000 0.462 2315 A N 1.083 123.900 122.820 -0.005 0.000 1.873 2315 A HA -0.032 4.287 4.320 -0.001 0.000 0.215 2315 A C 2.383 179.940 177.584 -0.045 0.000 1.186 2315 A CA 1.657 53.700 52.037 0.009 0.000 0.616 2315 A CB -0.700 18.335 19.000 0.059 0.000 0.823 2315 A HN 0.308 nan 8.150 nan 0.000 0.442 2316 A N -0.025 122.715 122.820 -0.133 0.000 1.883 2316 A HA -0.088 4.231 4.320 -0.001 0.000 0.217 2316 A C 2.181 179.365 177.584 -0.666 0.000 1.186 2316 A CA 1.616 53.304 52.037 -0.582 0.000 0.624 2316 A CB -0.707 18.006 19.000 -0.478 0.000 0.822 2316 A HN 0.474 nan 8.150 nan 0.000 0.444 2317 L N -0.837 120.208 121.223 -0.295 0.000 2.093 2317 L HA -0.103 4.237 4.340 -0.001 0.000 0.208 2317 L C 2.839 179.667 176.870 -0.071 0.000 1.085 2317 L CA 1.049 55.777 54.840 -0.188 0.000 0.755 2317 L CB -0.894 41.183 42.059 0.029 0.000 0.904 2317 L HN 0.505 nan 8.230 nan 0.000 0.435 2318 G N 0.486 109.283 108.800 -0.005 0.000 2.404 2318 G HA2 -0.193 3.766 3.960 -0.001 0.000 0.215 2318 G HA3 -0.193 3.766 3.960 -0.001 0.000 0.215 2318 G C 1.590 176.494 174.900 0.007 0.000 1.174 2318 G CA 0.634 45.741 45.100 0.012 0.000 0.780 2318 G HN 0.257 nan 8.290 nan 0.000 0.537 2319 I N 1.468 122.031 120.570 -0.011 0.000 2.179 2319 I HA -0.175 3.995 4.170 -0.001 0.000 0.242 2319 I C 3.330 179.496 176.117 0.081 0.000 1.088 2319 I CA 0.990 62.349 61.300 0.097 0.000 1.357 2319 I CB -0.327 37.834 38.000 0.268 0.000 1.051 2319 I HN 0.241 nan 8.210 nan 0.000 0.409 2320 A N 1.222 123.946 122.820 -0.161 0.000 1.865 2320 A HA -0.248 4.071 4.320 -0.001 0.000 0.217 2320 A C 2.108 179.735 177.584 0.071 0.000 1.191 2320 A CA 2.113 54.031 52.037 -0.199 0.000 0.623 2320 A CB -0.862 17.518 19.000 -1.034 0.000 0.826 2320 A HN 0.448 nan 8.150 nan 0.000 0.444 2321 N N -0.539 118.228 118.700 0.112 0.000 2.205 2321 N HA -0.139 4.600 4.740 -0.001 0.000 0.186 2321 N C 1.510 177.127 175.510 0.178 0.000 1.015 2321 N CA 1.440 54.632 53.050 0.236 0.000 0.862 2321 N CB -0.330 38.286 38.487 0.214 0.000 0.986 2321 N HN 0.387 nan 8.380 nan 0.000 0.429 2322 L N 1.121 122.429 121.223 0.142 0.000 2.209 2322 L HA 0.150 4.490 4.340 -0.001 0.000 0.207 2322 L C 2.010 178.966 176.870 0.144 0.000 1.094 2322 L CA 0.731 55.654 54.840 0.139 0.000 0.790 2322 L CB -0.251 41.888 42.059 0.133 0.000 0.932 2322 L HN 0.049 nan 8.230 nan 0.000 0.447 2323 I N -1.510 119.155 120.570 0.159 0.000 2.226 2323 I HA -0.203 3.966 4.170 -0.001 0.000 0.245 2323 I C 1.230 177.444 176.117 0.162 0.000 1.100 2323 I CA 0.221 61.617 61.300 0.162 0.000 1.374 2323 I CB -0.231 37.882 38.000 0.189 0.000 1.057 2323 I HN -0.097 nan 8.210 nan 0.000 0.413 2329 E N 0.978 121.205 120.200 0.046 0.000 2.472 2329 E HA -0.092 4.257 4.350 -0.001 0.000 0.200 2329 E C 0.815 177.435 176.600 0.034 0.000 1.046 2329 E CA 0.963 57.389 56.400 0.043 0.000 0.871 2329 E CB 0.088 29.820 29.700 0.052 0.000 0.806 2329 E HN 0.612 nan 8.360 nan 0.000 0.533 2330 N N -0.690 118.028 118.700 0.029 0.000 2.338 2330 N HA 0.119 4.858 4.740 -0.001 0.000 0.251 2330 N C 0.294 175.808 175.510 0.007 0.000 1.199 2330 N CA 0.600 53.661 53.050 0.018 0.000 0.879 2330 N CB 1.629 40.125 38.487 0.016 0.000 1.159 2330 N HN 0.281 nan 8.380 nan 0.000 0.514 2331 G N 0.774 109.580 108.800 0.010 0.000 2.472 2331 G HA2 -0.225 3.734 3.960 -0.001 0.000 0.217 2331 G HA3 -0.225 3.734 3.960 -0.001 0.000 0.217 2331 G C -0.187 174.716 174.900 0.005 0.000 2.125 2331 G CA -0.634 44.468 45.100 0.004 0.000 1.637 2331 G HN 0.171 nan 8.290 nan 0.000 0.548 2332 L N 2.206 123.431 121.223 0.002 0.000 2.557 2332 L HA 0.343 4.683 4.340 -0.001 0.000 0.308 2332 L C 1.632 178.508 176.870 0.010 0.000 1.283 2332 L CA 1.418 56.261 54.840 0.005 0.000 0.847 2332 L CB 0.399 42.463 42.059 0.010 0.000 1.088 2332 L HN 1.008 nan 8.230 nan 0.000 0.537 2333 S N 0.946 116.649 115.700 0.005 0.000 2.672 2333 S HA 0.228 4.698 4.470 -0.001 0.000 0.276 2333 S C 0.902 175.505 174.600 0.005 0.000 1.207 2333 S CA -0.240 57.963 58.200 0.004 0.000 1.002 2333 S CB 1.157 64.354 63.200 -0.005 0.000 0.998 2333 S HN 0.719 nan 8.310 nan 0.000 0.542 2334 E N 0.257 120.459 120.200 0.004 0.000 2.118 2334 E HA -0.256 4.093 4.350 -0.001 0.000 0.195 2334 E C 1.938 178.525 176.600 -0.022 0.000 0.992 2334 E CA 1.398 57.799 56.400 0.002 0.000 0.804 2334 E CB -0.162 29.535 29.700 -0.005 0.000 0.741 2334 E HN 0.817 nan 8.360 nan 0.000 0.458 2335 Q N 0.301 120.081 119.800 -0.034 0.000 2.046 2335 Q HA -0.204 4.135 4.340 -0.001 0.000 0.200 2335 Q C 1.782 177.748 176.000 -0.055 0.000 0.975 2335 Q CA 1.618 57.388 55.803 -0.055 0.000 0.836 2335 Q CB 0.049 28.757 28.738 -0.050 0.000 0.896 2335 Q HN 0.359 nan 8.270 nan 0.000 0.428 2336 E N 0.401 120.580 120.200 -0.034 0.000 2.077 2336 E HA -0.164 4.185 4.350 -0.001 0.000 0.193 2336 E C 1.959 178.550 176.600 -0.016 0.000 0.989 2336 E CA 1.035 57.416 56.400 -0.031 0.000 0.800 2336 E CB -0.164 29.527 29.700 -0.015 0.000 0.746 2336 E HN 0.456 nan 8.360 nan 0.000 0.452 2337 A N 1.368 124.195 122.820 0.011 0.000 1.877 2337 A HA -0.259 4.061 4.320 -0.001 0.000 0.216 2337 A C 2.086 179.719 177.584 0.083 0.000 1.186 2337 A CA 1.442 53.512 52.037 0.056 0.000 0.620 2337 A CB -0.485 18.560 19.000 0.074 0.000 0.822 2337 A HN 0.172 nan 8.150 nan 0.000 0.443 2338 Q N -1.080 118.745 119.800 0.043 0.000 2.226 2338 Q HA -0.175 4.164 4.340 -0.001 0.000 0.204 2338 Q C 1.840 177.846 176.000 0.010 0.000 0.975 2338 Q CA 1.518 57.351 55.803 0.051 0.000 0.866 2338 Q CB -0.117 28.522 28.738 -0.164 0.000 0.915 2338 Q HN 0.442 nan 8.270 nan 0.000 0.440 2339 K N 0.901 121.208 120.400 -0.155 0.000 2.432 2339 K HA -0.030 4.289 4.320 -0.001 0.000 0.196 2339 K C 1.050 177.471 176.600 -0.299 0.000 1.038 2339 K CA 0.789 56.799 56.287 -0.461 0.000 0.986 2339 K CB 0.294 32.589 32.500 -0.341 0.000 0.782 2339 K HN 0.013 nan 8.250 nan 0.000 0.485 2340 K N -0.294 120.089 120.400 -0.027 0.000 2.444 2340 K HA 0.171 4.490 4.320 -0.001 0.000 0.193 2340 K C -0.299 176.433 176.600 0.221 0.000 1.024 2340 K CA 0.217 56.575 56.287 0.119 0.000 1.077 2340 K CB 0.416 33.001 32.500 0.140 0.000 0.833 2340 K HN 0.060 nan 8.250 nan 0.000 0.517 2341 I N 0.768 121.458 120.570 0.201 0.000 2.389 2341 I HA 0.250 4.419 4.170 -0.001 0.000 0.288 2341 I C -0.835 175.472 176.117 0.316 0.000 0.999 2341 I CA -0.885 60.626 61.300 0.353 0.000 1.129 2341 I CB 0.977 39.239 38.000 0.436 0.000 1.288 2341 I HN -0.043 nan 8.210 nan 0.000 0.444 2345 D N 4.549 124.938 120.400 -0.019 0.000 2.560 2345 D HA 0.203 4.842 4.640 -0.001 0.000 0.277 2345 D C 0.738 176.950 176.300 -0.147 0.000 1.194 2345 D CA -0.183 53.825 54.000 0.014 0.000 1.092 2345 D CB 0.701 41.534 40.800 0.055 0.000 1.169 2345 D HN 0.637 nan 8.370 nan 0.000 0.607 2346 K N -1.149 119.153 120.400 -0.163 0.000 2.574 2346 K HA -0.099 4.220 4.320 -0.001 0.000 0.193 2346 K C 0.652 176.924 176.600 -0.546 0.000 1.035 2346 K CA 1.033 57.115 56.287 -0.342 0.000 0.982 2346 K CB -0.479 31.748 32.500 -0.456 0.000 0.795 2346 K HN 0.374 nan 8.250 nan 0.000 0.491 2347 Y N 0.382 120.586 120.300 -0.160 0.000 2.500 2347 Y HA 0.291 4.840 4.550 -0.001 0.000 0.246 2347 Y C 0.943 176.686 175.900 -0.261 0.000 1.146 2347 Y CA -0.048 57.963 58.100 -0.148 0.000 1.230 2347 Y CB 1.622 40.027 38.460 -0.092 0.000 1.214 2347 Y HN 0.340 nan 8.280 nan 0.000 0.526 2348 G N 0.345 108.838 108.800 -0.512 0.000 2.422 2348 G HA2 -0.115 3.844 3.960 -0.001 0.000 0.607 2348 G HA3 -0.115 3.844 3.960 -0.001 0.000 0.607 2348 G C -1.593 172.881 174.900 -0.710 0.000 1.270 2348 G CA -1.241 43.355 45.100 -0.841 0.000 0.992 2348 G HN -0.042 nan 8.290 nan 0.000 0.499 2349 L N 0.304 121.382 121.223 -0.242 0.000 2.490 2349 L HA 0.419 4.758 4.340 -0.001 0.000 0.274 2349 L C 1.012 177.947 176.870 0.109 0.000 1.201 2349 L CA 0.086 55.007 54.840 0.135 0.000 0.869 2349 L CB 0.423 42.655 42.059 0.289 0.000 1.123 2349 L HN 0.456 nan 8.230 nan 0.000 0.484 2350 L N 6.494 127.816 121.223 0.166 0.000 2.363 2350 L HA 0.274 4.613 4.340 -0.001 0.000 0.286 2350 L C -0.317 176.625 176.870 0.120 0.000 1.106 2350 L CA -0.470 54.434 54.840 0.107 0.000 0.859 2350 L CB 0.076 42.186 42.059 0.086 0.000 1.223 2350 L HN 0.475 nan 8.230 nan 0.000 0.446 2351 V N 0.464 120.439 119.914 0.101 0.000 2.769 2351 V HA 0.457 4.576 4.120 -0.001 0.000 0.312 2351 V C -0.008 176.117 176.094 0.050 0.000 1.061 2351 V CA -1.400 60.969 62.300 0.115 0.000 0.931 2351 V CB 1.801 33.722 31.823 0.162 0.000 1.010 2351 V HN 0.541 nan 8.190 nan 0.000 0.433 2352 K N 2.328 122.753 120.400 0.042 0.000 2.491 2352 K HA 0.392 4.711 4.320 -0.001 0.000 0.279 2352 K C 1.157 177.769 176.600 0.019 0.000 1.026 2352 K CA 1.116 57.412 56.287 0.016 0.000 1.070 2352 K CB 0.239 32.751 32.500 0.019 0.000 0.887 2352 K HN 1.642 nan 8.250 nan 0.000 0.481 2353 G N 2.407 111.208 108.800 0.001 0.000 2.136 2353 G HA2 -0.324 3.635 3.960 -0.001 0.000 0.242 2353 G HA3 -0.324 3.635 3.960 -0.001 0.000 0.242 2353 G C 0.057 174.956 174.900 -0.002 0.000 0.989 2353 G CA 0.475 45.574 45.100 -0.001 0.000 0.682 2353 G HN 0.735 nan 8.290 nan 0.000 0.522 2354 R N -0.577 119.922 120.500 -0.003 0.000 2.615 2354 R HA 0.651 4.991 4.340 -0.001 0.000 0.270 2354 R C 1.600 177.880 176.300 -0.033 0.000 1.081 2354 R CA 0.175 56.270 56.100 -0.007 0.000 1.154 2354 R CB 0.560 30.860 30.300 0.001 0.000 1.063 2354 R HN 0.059 nan 8.270 nan 0.000 0.519 2355 K N 2.032 122.408 120.400 -0.040 0.000 2.097 2355 K HA -0.054 4.266 4.320 -0.001 0.000 0.206 2355 K C 0.232 176.760 176.600 -0.120 0.000 1.049 2355 K CA 1.592 57.840 56.287 -0.066 0.000 0.933 2355 K CB -0.258 32.208 32.500 -0.057 0.000 0.717 2355 K HN 0.675 nan 8.250 nan 0.000 0.442 2356 A N 1.894 124.622 122.820 -0.154 0.000 2.354 2356 A HA 0.228 4.547 4.320 -0.001 0.000 0.269 2356 A C -0.461 177.025 177.584 -0.164 0.000 1.109 2356 A CA -0.619 51.261 52.037 -0.263 0.000 0.800 2356 A CB 0.258 19.038 19.000 -0.367 0.000 1.045 2356 A HN 0.214 nan 8.150 nan 0.000 0.489 2357 K N 0.590 120.885 120.400 -0.174 0.000 2.508 2357 K HA 0.062 4.381 4.320 -0.001 0.000 0.273 2357 K C -0.458 176.105 176.600 -0.062 0.000 0.964 2357 K CA 0.543 56.768 56.287 -0.103 0.000 0.948 2357 K CB 0.186 32.628 32.500 -0.097 0.000 0.917 2357 K HN 0.499 nan 8.250 nan 0.000 0.512 2358 I N 2.798 123.339 120.570 -0.047 0.000 2.560 2358 I HA 0.009 4.178 4.170 -0.001 0.000 0.283 2358 I C -0.165 175.930 176.117 -0.036 0.000 1.115 2358 I CA -1.184 60.096 61.300 -0.032 0.000 1.066 2358 I CB 1.322 39.299 38.000 -0.037 0.000 1.221 2358 I HN 0.637 nan 8.210 nan 0.000 0.450 2359 D N 3.741 124.129 120.400 -0.020 0.000 2.433 2359 D HA 0.174 4.813 4.640 -0.001 0.000 0.255 2359 D C 1.226 177.483 176.300 -0.073 0.000 1.226 2359 D CA -0.241 53.745 54.000 -0.025 0.000 1.015 2359 D CB 0.656 41.476 40.800 0.034 0.000 1.091 2359 D HN 0.411 nan 8.370 nan 0.000 0.527 2360 S N -0.778 114.831 115.700 -0.151 0.000 2.387 2360 S HA -0.292 4.177 4.470 -0.001 0.000 0.230 2360 S C 1.994 176.395 174.600 -0.331 0.000 1.035 2360 S CA 1.065 59.093 58.200 -0.287 0.000 1.014 2360 S CB -1.156 61.786 63.200 -0.430 0.000 0.836 2360 S HN 0.598 nan 8.310 nan 0.000 0.466 2361 Y N 2.103 122.305 120.300 -0.163 0.000 2.314 2361 Y HA 0.064 4.614 4.550 -0.001 0.000 0.293 2361 Y C 2.910 178.790 175.900 -0.032 0.000 1.129 2361 Y CA 1.027 59.030 58.100 -0.162 0.000 1.201 2361 Y CB -0.476 37.739 38.460 -0.408 0.000 0.999 2361 Y HN 0.330 nan 8.280 nan 0.000 0.541 2362 Q N -0.177 119.682 119.800 0.098 0.000 2.311 2362 Q HA -0.147 4.192 4.340 -0.001 0.000 0.203 2362 Q C 2.068 178.096 176.000 0.046 0.000 0.954 2362 Q CA 0.643 56.524 55.803 0.130 0.000 0.885 2362 Q CB -0.032 28.739 28.738 0.055 0.000 0.963 2362 Q HN 0.346 nan 8.270 nan 0.000 0.471 2363 E N 1.487 121.655 120.200 -0.054 0.000 2.086 2363 E HA -0.202 4.147 4.350 -0.001 0.000 0.205 2363 E C -0.844 175.629 176.600 -0.211 0.000 1.027 2363 E CA 1.803 58.129 56.400 -0.124 0.000 0.830 2363 E CB -0.986 28.633 29.700 -0.134 0.000 0.751 2363 E HN 0.258 nan 8.360 nan 0.000 0.456 2364 P HA -0.101 nan 4.420 nan 0.000 0.221 2364 P C 0.555 177.427 177.300 -0.713 0.000 1.145 2364 P CA 1.163 63.921 63.100 -0.570 0.000 0.795 2364 P CB -0.232 30.983 31.700 -0.808 0.000 0.775 2365 F N -2.731 117.111 119.950 -0.180 0.000 2.661 2365 F HA 0.208 4.734 4.527 -0.001 0.000 0.306 2365 F C 0.564 175.832 175.800 -0.886 0.000 1.094 2365 F CA -0.105 57.674 58.000 -0.368 0.000 1.254 2365 F CB -0.431 38.485 39.000 -0.141 0.000 1.040 2365 F HN -0.372 nan 8.300 nan 0.000 0.562 2366 T N 1.993 116.212 114.554 -0.557 0.000 2.762 2366 T HA 0.264 4.614 4.350 -0.001 0.000 0.303 2366 T C -0.157 174.227 174.700 -0.526 0.000 0.977 2366 T CA -0.274 61.561 62.100 -0.441 0.000 0.961 2366 T CB 0.122 68.890 68.868 -0.166 0.000 0.944 2366 T HN 0.078 nan 8.240 nan 0.000 0.481 2367 H N 0.770 119.746 119.070 -0.155 0.000 2.630 2367 H HA 0.468 5.024 4.556 -0.001 0.000 0.343 2367 H C 0.397 175.741 175.328 0.026 0.000 1.232 2367 H CA -1.185 54.757 56.048 -0.177 0.000 1.294 2367 H CB 0.703 30.134 29.762 -0.551 0.000 1.746 2367 H HN 0.384 nan 8.280 nan 0.000 0.593 2368 S N 0.414 116.232 115.700 0.197 0.000 2.533 2368 S HA 0.262 4.731 4.470 -0.001 0.000 0.282 2368 S C 0.436 175.194 174.600 0.262 0.000 1.304 2368 S CA -0.540 57.765 58.200 0.175 0.000 1.063 2368 S CB 0.309 63.585 63.200 0.127 0.000 0.881 2368 S HN 0.734 nan 8.310 nan 0.000 0.493 2369 A N 5.763 128.702 122.820 0.197 0.000 2.584 2369 A HA 0.259 4.578 4.320 -0.001 0.000 0.239 2369 A C -1.075 176.611 177.584 0.171 0.000 1.043 2369 A CA -0.668 51.483 52.037 0.191 0.000 0.756 2369 A CB -0.586 18.484 19.000 0.117 0.000 0.963 2369 A HN 0.606 nan 8.150 nan 0.000 0.511 2370 P HA 0.194 nan 4.420 nan 0.000 0.286 2370 P C 0.346 177.667 177.300 0.035 0.000 1.293 2370 P CA -0.259 62.882 63.100 0.069 0.000 0.770 2370 P CB 0.459 32.123 31.700 -0.060 0.000 1.206 2371 E N -0.538 119.667 120.200 0.008 0.000 2.108 2371 E HA -0.124 4.226 4.350 -0.001 0.000 0.203 2371 E C 0.358 176.960 176.600 0.004 0.000 1.022 2371 E CA 1.663 58.065 56.400 0.004 0.000 0.823 2371 E CB -0.567 29.125 29.700 -0.012 0.000 0.744 2371 E HN 0.298 nan 8.360 nan 0.000 0.456 2372 S N -0.542 115.153 115.700 -0.008 0.000 2.541 2372 S HA 0.407 4.876 4.470 -0.001 0.000 0.280 2372 S C -0.645 173.958 174.600 0.005 0.000 1.112 2372 S CA -0.817 57.383 58.200 -0.001 0.000 0.925 2372 S CB 1.540 64.734 63.200 -0.011 0.000 1.067 2372 S HN 0.021 nan 8.310 nan 0.000 0.479 2373 I N 4.982 125.568 120.570 0.027 0.000 2.363 2373 I HA 0.226 4.395 4.170 -0.001 0.000 0.292 2373 I C -1.779 174.373 176.117 0.058 0.000 1.075 2373 I CA -2.204 59.126 61.300 0.050 0.000 1.333 2373 I CB -0.027 38.008 38.000 0.059 0.000 1.415 2373 I HN 0.380 nan 8.210 nan 0.000 0.502 2374 P HA 0.132 nan 4.420 nan 0.000 0.268 2374 P C -0.254 177.157 177.300 0.185 0.000 1.204 2374 P CA -0.015 63.141 63.100 0.094 0.000 0.768 2374 P CB 1.620 33.367 31.700 0.077 0.000 0.842 2375 D N 0.177 120.667 120.400 0.151 0.000 2.277 2375 D HA -0.001 4.639 4.640 -0.001 0.000 0.209 2375 D C 0.873 177.340 176.300 0.279 0.000 0.970 2375 D CA 1.092 55.201 54.000 0.182 0.000 0.874 2375 D CB 0.345 41.210 40.800 0.108 0.000 0.982 2375 D HN 0.540 nan 8.370 nan 0.000 0.504 2376 T N -3.789 110.885 114.554 0.201 0.000 2.888 2376 T HA 0.236 4.585 4.350 -0.001 0.000 0.288 2376 T C 0.537 175.141 174.700 -0.161 0.000 1.063 2376 T CA -0.819 61.376 62.100 0.158 0.000 1.010 2376 T CB 0.836 69.753 68.868 0.081 0.000 1.214 2376 T HN -0.112 nan 8.240 nan 0.000 0.533 2377 F N 0.586 120.219 119.950 -0.528 0.000 2.234 2377 F HA 0.091 4.618 4.527 -0.001 0.000 0.299 2377 F C 2.414 177.984 175.800 -0.382 0.000 1.087 2377 F CA 1.703 59.223 58.000 -0.800 0.000 1.340 2377 F CB -0.119 38.545 39.000 -0.561 0.000 1.031 2377 F HN 0.891 nan 8.300 nan 0.000 0.500 2378 E N -0.068 120.045 120.200 -0.145 0.000 2.110 2378 E HA -0.224 4.125 4.350 -0.001 0.000 0.193 2378 E C 1.645 178.112 176.600 -0.222 0.000 0.988 2378 E CA 1.604 57.910 56.400 -0.157 0.000 0.804 2378 E CB -0.169 29.498 29.700 -0.055 0.000 0.745 2378 E HN 0.390 nan 8.360 nan 0.000 0.458 2379 D N 0.299 120.591 120.400 -0.181 0.000 2.144 2379 D HA -0.127 4.512 4.640 -0.001 0.000 0.200 2379 D C 1.832 177.998 176.300 -0.224 0.000 0.978 2379 D CA 1.163 55.075 54.000 -0.148 0.000 0.833 2379 D CB -0.187 40.576 40.800 -0.063 0.000 0.961 2379 D HN 0.294 nan 8.370 nan 0.000 0.470 2380 A N 0.873 123.486 122.820 -0.346 0.000 1.902 2380 A HA -0.127 4.192 4.320 -0.001 0.000 0.217 2380 A C 2.556 179.850 177.584 -0.482 0.000 1.181 2380 A CA 1.078 52.866 52.037 -0.414 0.000 0.623 2380 A CB -0.704 17.945 19.000 -0.586 0.000 0.818 2380 A HN 0.134 nan 8.150 nan 0.000 0.443 2381 V N 1.066 120.636 119.914 -0.574 0.000 2.343 2381 V HA -0.252 3.867 4.120 -0.001 0.000 0.247 2381 V C 2.260 178.181 176.094 -0.289 0.000 1.051 2381 V CA 2.090 64.120 62.300 -0.450 0.000 1.036 2381 V CB -0.888 30.688 31.823 -0.411 0.000 0.654 2381 V HN 0.569 nan 8.190 nan 0.000 0.451 2382 N N -0.027 118.530 118.700 -0.238 0.000 2.188 2382 N HA -0.020 4.720 4.740 -0.001 0.000 0.184 2382 N C 1.808 177.219 175.510 -0.164 0.000 1.018 2382 N CA 1.446 54.394 53.050 -0.169 0.000 0.858 2382 N CB -0.083 38.325 38.487 -0.131 0.000 0.989 2382 N HN 0.435 nan 8.380 nan 0.000 0.426 2383 I N 0.358 120.814 120.570 -0.190 0.000 2.235 2383 I HA -0.168 4.002 4.170 -0.001 0.000 0.241 2383 I C 1.476 177.452 176.117 -0.235 0.000 1.085 2383 I CA 0.736 61.925 61.300 -0.184 0.000 1.378 2383 I CB -0.026 37.867 38.000 -0.177 0.000 1.076 2383 I HN -0.021 nan 8.210 nan 0.000 0.415 2384 L N 0.350 121.378 121.223 -0.324 0.000 2.313 2384 L HA -0.016 4.323 4.340 -0.001 0.000 0.214 2384 L C 0.884 177.599 176.870 -0.258 0.000 1.119 2384 L CA 0.789 55.389 54.840 -0.399 0.000 0.809 2384 L CB -0.791 40.905 42.059 -0.604 0.000 0.933 2384 L HN 0.117 nan 8.230 nan 0.000 0.449 2385 K N -1.005 119.266 120.400 -0.215 0.000 3.077 2385 K HA -0.155 4.164 4.320 -0.001 0.000 0.264 2385 K C -2.198 174.326 176.600 -0.127 0.000 1.008 2385 K CA 0.347 56.543 56.287 -0.152 0.000 0.740 2385 K CB -1.548 30.887 32.500 -0.108 0.000 1.273 2385 K HN 0.277 nan 8.250 nan 0.000 0.477 2386 P HA -0.016 nan 4.420 nan 0.000 0.269 2386 P C 0.417 177.657 177.300 -0.099 0.000 1.215 2386 P CA 0.330 63.370 63.100 -0.100 0.000 0.780 2386 P CB 1.399 33.033 31.700 -0.110 0.000 0.898 2387 S N -0.152 115.497 115.700 -0.085 0.000 2.503 2387 S HA 0.106 4.575 4.470 -0.001 0.000 0.215 2387 S C 0.551 175.058 174.600 -0.155 0.000 1.003 2387 S CA 0.225 58.361 58.200 -0.105 0.000 0.910 2387 S CB -0.285 62.859 63.200 -0.093 0.000 0.790 2387 S HN 0.514 nan 8.310 nan 0.000 0.514 2388 T N 1.942 116.391 114.554 -0.175 0.000 2.921 2388 T HA 0.652 5.001 4.350 -0.001 0.000 0.297 2388 T C -1.606 172.967 174.700 -0.212 0.000 1.013 2388 T CA -0.351 61.606 62.100 -0.237 0.000 0.990 2388 T CB 1.830 70.502 68.868 -0.326 0.000 1.023 2388 T HN 0.161 nan 8.240 nan 0.000 0.447 2389 I N 3.211 123.662 120.570 -0.198 0.000 2.436 2389 I HA 0.553 4.722 4.170 -0.001 0.000 0.289 2389 I C -1.183 174.922 176.117 -0.020 0.000 1.010 2389 I CA -0.800 60.440 61.300 -0.100 0.000 1.098 2389 I CB 1.128 39.021 38.000 -0.179 0.000 1.266 2389 I HN 0.603 nan 8.210 nan 0.000 0.434 2390 I N 6.906 127.456 120.570 -0.033 0.000 2.411 2390 I HA 0.426 4.595 4.170 -0.001 0.000 0.284 2390 I C 0.468 176.706 176.117 0.202 0.000 1.012 2390 I CA -0.602 60.704 61.300 0.010 0.000 1.119 2390 I CB 1.685 39.432 38.000 -0.422 0.000 1.261 2390 I HN 0.664 nan 8.210 nan 0.000 0.448 2391 G N 4.854 113.749 108.800 0.160 0.000 2.356 2391 G HA2 0.418 4.378 3.960 -0.001 0.000 0.300 2391 G HA3 0.418 4.378 3.960 -0.001 0.000 0.300 2391 G C -0.299 174.547 174.900 -0.089 0.000 1.107 2391 G CA -0.108 44.835 45.100 -0.261 0.000 0.960 2391 G HN 0.440 nan 8.290 nan 0.000 0.418 2392 V N 2.530 122.441 119.914 -0.005 0.000 2.886 2392 V HA 0.460 4.579 4.120 -0.001 0.000 0.368 2392 V C 0.874 176.983 176.094 0.025 0.000 1.313 2392 V CA 0.382 62.710 62.300 0.048 0.000 1.491 2392 V CB 0.371 32.295 31.823 0.168 0.000 1.345 2392 V HN 0.881 nan 8.190 nan 0.000 0.646 2393 A N 0.449 123.244 122.820 -0.041 0.000 2.252 2393 A HA 0.557 4.876 4.320 -0.001 0.000 0.213 2393 A C 1.843 179.405 177.584 -0.036 0.000 1.188 2393 A CA 0.692 52.712 52.037 -0.027 0.000 0.863 2393 A CB -0.026 18.945 19.000 -0.050 0.000 0.893 2393 A HN 1.755 nan 8.150 nan 0.000 0.495 2394 G N -1.048 107.721 108.800 -0.051 0.000 2.321 2394 G HA2 -0.002 3.957 3.960 -0.001 0.000 0.287 2394 G HA3 -0.002 3.957 3.960 -0.001 0.000 0.287 2394 G C 0.595 175.468 174.900 -0.044 0.000 1.018 2394 G CA 0.522 45.596 45.100 -0.043 0.000 0.855 2394 G HN 1.636 nan 8.290 nan 0.000 0.507 2395 A N -0.806 121.980 122.820 -0.057 0.000 2.616 2395 A HA 0.784 5.104 4.320 -0.001 0.000 0.294 2395 A C 1.577 179.133 177.584 -0.047 0.000 1.091 2395 A CA 1.207 53.216 52.037 -0.046 0.000 0.971 2395 A CB 0.023 18.999 19.000 -0.040 0.000 1.222 2395 A HN 2.533 nan 8.150 nan 0.000 0.521 2396 G N 0.076 108.844 108.800 -0.052 0.000 2.627 2396 G HA2 -0.137 3.822 3.960 -0.001 0.000 0.214 2396 G HA3 -0.137 3.822 3.960 -0.001 0.000 0.214 2396 G C -0.358 174.506 174.900 -0.058 0.000 1.331 2396 G CA -0.877 44.200 45.100 -0.039 0.000 0.891 2396 G HN 0.371 nan 8.290 nan 0.000 0.539 2397 R N 0.822 121.307 120.500 -0.026 0.000 4.510 2397 R HA 0.095 4.434 4.340 -0.001 0.000 0.170 2397 R C 1.419 177.713 176.300 -0.011 0.000 1.906 2397 R CA -0.236 55.854 56.100 -0.017 0.000 1.492 2397 R CB -0.724 29.585 30.300 0.016 0.000 1.383 2397 R HN 0.359 nan 8.270 nan 0.000 0.823 2398 L N -0.046 121.134 121.223 -0.072 0.000 2.478 2398 L HA 0.066 4.405 4.340 -0.001 0.000 0.223 2398 L C 0.985 177.935 176.870 0.133 0.000 1.140 2398 L CA 0.911 55.734 54.840 -0.027 0.000 0.842 2398 L CB -0.527 41.463 42.059 -0.116 0.000 0.953 2398 L HN 0.312 nan 8.230 nan 0.000 0.452 2399 F N 1.796 121.699 119.950 -0.078 0.000 2.626 2399 F HA 0.065 4.591 4.527 -0.001 0.000 0.353 2399 F C 1.233 177.024 175.800 -0.015 0.000 1.230 2399 F CA -0.901 57.071 58.000 -0.046 0.000 1.298 2399 F CB 0.089 39.075 39.000 -0.023 0.000 1.670 2399 F HN 0.056 nan 8.300 nan 0.000 0.633 2400 T N -1.041 113.613 114.554 0.168 0.000 2.795 2400 T HA 0.022 4.371 4.350 -0.001 0.000 0.314 2400 T C -1.703 173.026 174.700 0.048 0.000 1.069 2400 T CA -1.339 60.812 62.100 0.084 0.000 1.071 2400 T CB 1.052 69.958 68.868 0.064 0.000 0.988 2400 T HN 0.122 nan 8.240 nan 0.000 0.543 2401 P HA -0.077 nan 4.420 nan 0.000 0.217 2401 P C 1.092 178.382 177.300 -0.016 0.000 1.148 2401 P CA 0.988 64.084 63.100 -0.007 0.000 0.828 2401 P CB 0.017 31.711 31.700 -0.010 0.000 0.783 2402 D N -1.259 119.136 120.400 -0.008 0.000 2.149 2402 D HA -0.082 4.557 4.640 -0.001 0.000 0.201 2402 D C 2.012 178.292 176.300 -0.033 0.000 0.972 2402 D CA 0.886 54.875 54.000 -0.019 0.000 0.835 2402 D CB -0.636 40.157 40.800 -0.012 0.000 0.966 2402 D HN -0.015 nan 8.370 nan 0.000 0.476 2403 V N 1.389 121.294 119.914 -0.015 0.000 2.295 2403 V HA -0.215 3.904 4.120 -0.001 0.000 0.246 2403 V C 2.531 178.566 176.094 -0.098 0.000 1.049 2403 V CA 1.142 63.420 62.300 -0.036 0.000 1.024 2403 V CB -0.317 31.528 31.823 0.036 0.000 0.648 2403 V HN 0.188 nan 8.190 nan 0.000 0.447 2404 I N -0.558 119.961 120.570 -0.085 0.000 2.252 2404 I HA -0.223 3.947 4.170 -0.001 0.000 0.245 2404 I C 2.763 178.826 176.117 -0.091 0.000 1.102 2404 I CA 1.513 62.750 61.300 -0.104 0.000 1.385 2404 I CB -0.464 37.488 38.000 -0.080 0.000 1.064 2404 I HN 0.219 nan 8.210 nan 0.000 0.414 2405 R N 1.072 121.530 120.500 -0.070 0.000 2.096 2405 R HA -0.024 4.316 4.340 -0.001 0.000 0.235 2405 R C 1.401 177.659 176.300 -0.070 0.000 1.127 2405 R CA 0.859 56.921 56.100 -0.063 0.000 0.968 2405 R CB -0.429 29.842 30.300 -0.048 0.000 0.861 2405 R HN 0.321 nan 8.270 nan 0.000 0.440 2409 S N -0.041 115.626 115.700 -0.055 0.000 2.406 2409 S HA 0.053 4.522 4.470 -0.001 0.000 0.228 2409 S C 1.808 176.379 174.600 -0.049 0.000 1.020 2409 S CA 1.494 59.666 58.200 -0.048 0.000 0.965 2409 S CB -0.384 62.786 63.200 -0.050 0.000 0.798 2409 S HN 0.460 nan 8.310 nan 0.000 0.488 2410 I N 1.115 121.648 120.570 -0.061 0.000 2.480 2410 I HA 0.067 4.236 4.170 -0.001 0.000 0.251 2410 I C 0.336 176.422 176.117 -0.051 0.000 1.124 2410 I CA 0.405 61.668 61.300 -0.062 0.000 1.444 2410 I CB -0.042 37.908 38.000 -0.083 0.000 1.098 2410 I HN 0.256 nan 8.210 nan 0.000 0.428 2411 N N 0.512 119.180 118.700 -0.053 0.000 2.319 2411 N HA 0.095 4.834 4.740 -0.001 0.000 0.305 2411 N C 0.469 175.962 175.510 -0.030 0.000 1.103 2411 N CA -0.258 52.767 53.050 -0.041 0.000 0.815 2411 N CB 2.300 40.755 38.487 -0.053 0.000 1.288 2411 N HN -0.089 nan 8.380 nan 0.000 0.493 2412 E N 0.978 121.168 120.200 -0.016 0.000 2.076 2412 E HA 0.006 4.356 4.350 -0.001 0.000 0.190 2412 E C -0.269 176.331 176.600 -0.000 0.000 0.979 2412 E CA 1.452 57.849 56.400 -0.005 0.000 0.807 2412 E CB 0.386 30.088 29.700 0.004 0.000 0.761 2412 E HN 0.310 nan 8.360 nan 0.000 0.454 2413 R N 1.315 121.815 120.500 -0.001 0.000 2.564 2413 R HA 0.314 4.653 4.340 -0.001 0.000 0.282 2413 R C -2.471 173.821 176.300 -0.013 0.000 1.573 2413 R CA -2.113 53.992 56.100 0.008 0.000 1.588 2413 R CB 0.727 31.042 30.300 0.025 0.000 1.154 2413 R HN 0.204 nan 8.270 nan 0.000 0.606 2414 P HA 0.068 nan 4.420 nan 0.000 0.271 2414 P C -0.088 177.190 177.300 -0.037 0.000 1.216 2414 P CA -0.142 62.926 63.100 -0.053 0.000 0.776 2414 P CB 1.276 32.936 31.700 -0.067 0.000 0.881 2415 V N 5.408 125.275 119.914 -0.077 0.000 2.350 2415 V HA 0.322 4.441 4.120 -0.001 0.000 0.276 2415 V C 0.593 176.653 176.094 -0.057 0.000 1.028 2415 V CA -0.312 61.946 62.300 -0.071 0.000 0.860 2415 V CB 0.571 32.262 31.823 -0.220 0.000 0.990 2415 V HN 0.396 nan 8.190 nan 0.000 0.453 2416 I N 5.732 126.382 120.570 0.132 0.000 2.411 2416 I HA 0.465 4.634 4.170 -0.001 0.000 0.284 2416 I C -1.145 175.238 176.117 0.444 0.000 1.012 2416 I CA -0.220 61.206 61.300 0.210 0.000 1.119 2416 I CB 1.535 39.648 38.000 0.188 0.000 1.261 2416 I HN 0.353 nan 8.210 nan 0.000 0.448 2417 F N 4.750 124.709 119.950 0.015 0.000 2.449 2417 F HA 0.589 5.115 4.527 -0.001 0.000 0.342 2417 F C 0.413 176.215 175.800 0.004 0.000 1.127 2417 F CA -1.472 56.463 58.000 -0.108 0.000 0.975 2417 F CB 1.989 40.953 39.000 -0.060 0.000 1.146 2417 F HN 0.405 nan 8.300 nan 0.000 0.444 2418 A N 5.634 128.434 122.820 -0.032 0.000 2.644 2418 A HA 0.539 4.859 4.320 -0.001 0.000 0.343 2418 A C 0.431 177.982 177.584 -0.053 0.000 1.324 2418 A CA -0.323 51.686 52.037 -0.047 0.000 0.846 2418 A CB -0.239 18.812 19.000 0.086 0.000 1.128 2418 A HN 0.837 nan 8.150 nan 0.000 0.484 2419 L N 0.746 121.956 121.223 -0.022 0.000 2.509 2419 L HA 0.054 4.393 4.340 -0.001 0.000 0.222 2419 L C 0.915 177.782 176.870 -0.004 0.000 1.123 2419 L CA 0.140 54.981 54.840 0.002 0.000 0.856 2419 L CB -0.269 41.834 42.059 0.073 0.000 0.985 2419 L HN 0.506 nan 8.230 nan 0.000 0.456 2420 S N 0.936 116.619 115.700 -0.030 0.000 2.568 2420 S HA 0.170 4.639 4.470 -0.001 0.000 0.282 2420 S C 0.134 174.715 174.600 -0.030 0.000 1.338 2420 S CA -0.208 57.972 58.200 -0.033 0.000 1.045 2420 S CB 0.443 63.607 63.200 -0.059 0.000 0.873 2420 S HN 0.281 nan 8.310 nan 0.000 0.516 2421 N N 2.112 120.785 118.700 -0.044 0.000 2.312 2421 N HA 0.517 5.256 4.740 -0.001 0.000 0.296 2421 N C -2.731 172.737 175.510 -0.070 0.000 1.193 2421 N CA -1.422 51.587 53.050 -0.068 0.000 0.773 2421 N CB 1.976 40.402 38.487 -0.101 0.000 1.435 2421 N HN 0.295 nan 8.380 nan 0.000 0.484 2422 P HA 0.167 nan 4.420 nan 0.000 0.312 2422 P C 0.542 177.801 177.300 -0.069 0.000 1.308 2422 P CA 0.004 63.047 63.100 -0.095 0.000 0.743 2422 P CB 0.411 32.052 31.700 -0.099 0.000 1.364 2423 T N 0.181 114.680 114.554 -0.091 0.000 2.620 2423 T HA -0.260 4.090 4.350 -0.001 0.000 0.267 2423 T C 1.938 176.657 174.700 0.031 0.000 1.044 2423 T CA 2.706 64.768 62.100 -0.064 0.000 1.161 2423 T CB -1.325 67.472 68.868 -0.119 0.000 0.862 2423 T HN 0.537 nan 8.240 nan 0.000 0.438 2424 A N 1.199 124.025 122.820 0.010 0.000 2.024 2424 A HA -0.126 4.193 4.320 -0.001 0.000 0.220 2424 A C 2.244 179.838 177.584 0.015 0.000 1.164 2424 A CA 1.161 53.212 52.037 0.023 0.000 0.643 2424 A CB -0.352 18.650 19.000 0.004 0.000 0.806 2424 A HN 0.403 nan 8.150 nan 0.000 0.451 2425 Q N -0.331 119.467 119.800 -0.003 0.000 2.403 2425 Q HA 0.321 4.660 4.340 -0.001 0.000 0.203 2425 Q C 0.824 176.811 176.000 -0.021 0.000 0.932 2425 Q CA 0.595 56.387 55.803 -0.019 0.000 0.945 2425 Q CB -0.776 27.942 28.738 -0.033 0.000 1.045 2425 Q HN 0.593 nan 8.270 nan 0.000 0.511 2426 A N 1.262 124.097 122.820 0.024 0.000 2.498 2426 A HA 0.050 4.370 4.320 -0.001 0.000 0.239 2426 A C 0.778 178.352 177.584 -0.016 0.000 1.068 2426 A CA -0.126 51.939 52.037 0.047 0.000 0.766 2426 A CB 0.393 19.526 19.000 0.221 0.000 1.003 2426 A HN 0.043 nan 8.150 nan 0.000 0.497 2427 E N -0.203 119.910 120.200 -0.145 0.000 2.268 2427 E HA 0.019 4.368 4.350 -0.001 0.000 0.195 2427 E C 0.588 177.144 176.600 -0.073 0.000 0.995 2427 E CA 1.480 57.691 56.400 -0.315 0.000 0.836 2427 E CB -0.414 28.668 29.700 -1.031 0.000 0.763 2427 E HN 0.927 nan 8.360 nan 0.000 0.491 2428 C N -3.210 116.129 119.300 0.065 0.000 3.231 2428 C HA 0.613 5.072 4.460 -0.001 0.000 0.343 2428 C C -0.108 174.887 174.990 0.008 0.000 1.349 2428 C CA -0.671 58.398 59.018 0.085 0.000 1.209 2428 C CB 0.934 28.781 27.740 0.178 0.000 1.475 2428 C HN 0.234 nan 8.230 nan 0.000 0.460 2429 T N -0.538 113.861 114.554 -0.258 0.000 2.936 2429 T HA 0.687 5.036 4.350 -0.001 0.000 0.282 2429 T C 1.184 175.253 174.700 -1.052 0.000 1.003 2429 T CA 0.212 61.821 62.100 -0.819 0.000 1.005 2429 T CB 1.470 69.954 68.868 -0.641 0.000 1.097 2429 T HN 2.196 nan 8.240 nan 0.000 0.532 2430 A N 0.216 122.194 122.820 -1.403 0.000 1.877 2430 A HA -0.056 4.263 4.320 -0.001 0.000 0.216 2430 A C 2.256 179.442 177.584 -0.663 0.000 1.186 2430 A CA 1.906 53.222 52.037 -1.202 0.000 0.620 2430 A CB -1.249 17.517 19.000 -0.390 0.000 0.822 2430 A HN 1.045 nan 8.150 nan 0.000 0.443 2431 E N -0.172 119.788 120.200 -0.400 0.000 2.097 2431 E HA -0.259 4.091 4.350 -0.001 0.000 0.196 2431 E C 1.924 178.393 176.600 -0.217 0.000 1.000 2431 E CA 1.648 57.936 56.400 -0.186 0.000 0.804 2431 E CB -0.132 29.495 29.700 -0.123 0.000 0.740 2431 E HN 0.769 nan 8.360 nan 0.000 0.454 2432 E N -0.010 120.015 120.200 -0.292 0.000 2.072 2432 E HA -0.184 4.165 4.350 -0.001 0.000 0.191 2432 E C 2.024 178.465 176.600 -0.265 0.000 0.985 2432 E CA 0.921 57.188 56.400 -0.222 0.000 0.801 2432 E CB -0.140 29.451 29.700 -0.181 0.000 0.750 2432 E HN 0.340 nan 8.360 nan 0.000 0.452 2433 A N 0.740 123.284 122.820 -0.460 0.000 1.845 2433 A HA -0.192 4.127 4.320 -0.001 0.000 0.215 2433 A C 1.958 179.277 177.584 -0.442 0.000 1.195 2433 A CA 1.348 53.088 52.037 -0.495 0.000 0.616 2433 A CB -1.039 17.450 19.000 -0.853 0.000 0.832 2433 A HN 0.297 nan 8.150 nan 0.000 0.443 2434 Y N 0.910 120.976 120.300 -0.390 0.000 2.181 2434 Y HA -0.229 4.320 4.550 -0.001 0.000 0.288 2434 Y C 3.212 178.932 175.900 -0.299 0.000 1.146 2434 Y CA 1.789 59.644 58.100 -0.408 0.000 1.164 2434 Y CB -0.526 37.646 38.460 -0.480 0.000 0.982 2434 Y HN 0.555 nan 8.280 nan 0.000 0.515 2435 T N -1.953 112.560 114.554 -0.068 0.000 2.770 2435 T HA -0.142 4.207 4.350 -0.001 0.000 0.263 2435 T C 1.669 176.329 174.700 -0.066 0.000 1.039 2435 T CA 0.964 63.031 62.100 -0.054 0.000 1.142 2435 T CB -0.681 68.161 68.868 -0.043 0.000 0.868 2435 T HN 0.072 nan 8.240 nan 0.000 0.435 2436 L N 2.669 123.839 121.223 -0.088 0.000 2.456 2436 L HA 0.144 4.483 4.340 -0.001 0.000 0.224 2436 L C 2.482 179.307 176.870 -0.076 0.000 1.148 2436 L CA 1.720 56.514 54.840 -0.076 0.000 0.825 2436 L CB -1.000 41.010 42.059 -0.081 0.000 0.937 2436 L HN 0.745 nan 8.230 nan 0.000 0.450 2437 T N -5.447 109.052 114.554 -0.092 0.000 3.129 2437 T HA 0.142 4.491 4.350 -0.001 0.000 0.267 2437 T C 0.505 175.167 174.700 -0.062 0.000 1.018 2437 T CA -0.245 61.807 62.100 -0.079 0.000 0.903 2437 T CB 0.024 68.834 68.868 -0.096 0.000 1.067 2437 T HN 0.301 nan 8.240 nan 0.000 0.549 2438 E N 0.762 120.928 120.200 -0.057 0.000 2.586 2438 E HA -0.225 4.124 4.350 -0.001 0.000 0.259 2438 E C 1.000 177.573 176.600 -0.044 0.000 1.107 2438 E CA 0.585 56.967 56.400 -0.031 0.000 0.754 2438 E CB -2.107 27.589 29.700 -0.007 0.000 1.335 2438 E HN 1.137 nan 8.360 nan 0.000 0.411 2439 G N 0.134 108.838 108.800 -0.160 0.000 2.160 2439 G HA2 -0.397 3.562 3.960 -0.001 0.000 0.251 2439 G HA3 -0.397 3.562 3.960 -0.001 0.000 0.251 2439 G C 0.786 175.608 174.900 -0.130 0.000 1.008 2439 G CA 0.734 45.590 45.100 -0.407 0.000 0.724 2439 G HN 0.403 nan 8.290 nan 0.000 0.514 2440 R N -0.709 119.762 120.500 -0.048 0.000 2.254 2440 R HA 0.191 4.530 4.340 -0.001 0.000 0.195 2440 R C 2.125 178.440 176.300 0.026 0.000 0.957 2440 R CA 0.810 56.920 56.100 0.017 0.000 1.024 2440 R CB -0.091 30.214 30.300 0.007 0.000 0.952 2440 R HN 0.783 nan 8.270 nan 0.000 0.484 2441 C N -0.230 119.064 119.300 -0.010 0.000 2.500 2441 C HA 0.522 4.981 4.460 -0.001 0.000 0.367 2441 C C 0.383 175.433 174.990 0.101 0.000 1.283 2441 C CA -1.188 57.834 59.018 0.007 0.000 2.456 2441 C CB 0.040 27.740 27.740 -0.066 0.000 2.457 2441 C HN 0.175 nan 8.230 nan 0.000 0.632 2442 L N 2.098 123.401 121.223 0.134 0.000 2.319 2442 L HA 0.527 4.866 4.340 -0.001 0.000 0.281 2442 L C -0.496 176.541 176.870 0.279 0.000 1.005 2442 L CA -0.083 54.893 54.840 0.226 0.000 0.828 2442 L CB 0.978 43.154 42.059 0.194 0.000 1.227 2442 L HN 0.798 nan 8.230 nan 0.000 0.415 2443 F N 3.361 123.340 119.950 0.049 0.000 2.538 2443 F HA 0.841 5.367 4.527 -0.001 0.000 0.325 2443 F C -0.407 175.360 175.800 -0.054 0.000 1.066 2443 F CA -0.466 57.508 58.000 -0.044 0.000 0.946 2443 F CB 1.846 40.595 39.000 -0.418 0.000 1.199 2443 F HN 0.430 nan 8.300 nan 0.000 0.473 2444 A N 2.782 124.906 122.820 -1.160 0.000 2.547 2444 A HA 0.692 5.012 4.320 -0.001 0.000 0.297 2444 A C -1.394 175.523 177.584 -1.112 0.000 1.056 2444 A CA -0.144 51.325 52.037 -0.948 0.000 0.688 2444 A CB 1.281 19.551 19.000 -1.216 0.000 1.282 2444 A HN 1.121 nan 8.150 nan 0.000 0.400 2445 S N 0.136 115.551 115.700 -0.476 0.000 2.632 2445 S HA 0.724 5.193 4.470 -0.001 0.000 0.289 2445 S C 0.841 175.395 174.600 -0.077 0.000 1.115 2445 S CA -0.009 58.081 58.200 -0.183 0.000 0.889 2445 S CB 1.406 64.802 63.200 0.326 0.000 1.116 2445 S HN 1.793 nan 8.310 nan 0.000 0.486 2446 G N 0.619 109.402 108.800 -0.028 0.000 2.408 2446 G HA2 0.204 4.163 3.960 -0.001 0.000 0.215 2446 G HA3 0.204 4.163 3.960 -0.001 0.000 0.215 2446 G C 0.379 175.258 174.900 -0.035 0.000 1.156 2446 G CA 0.227 45.311 45.100 -0.026 0.000 0.793 2446 G HN 0.691 nan 8.290 nan 0.000 0.535 2447 S N 1.084 116.744 115.700 -0.067 0.000 2.654 2447 S HA 0.528 4.997 4.470 -0.001 0.000 0.283 2447 S C -2.526 171.918 174.600 -0.260 0.000 1.180 2447 S CA -0.993 57.102 58.200 -0.176 0.000 1.021 2447 S CB 2.246 65.290 63.200 -0.259 0.000 1.018 2447 S HN 0.082 nan 8.310 nan 0.000 0.532 2448 P HA 0.347 nan 4.420 nan 0.000 0.276 2448 P C -1.342 175.709 177.300 -0.414 0.000 1.230 2448 P CA -0.057 62.927 63.100 -0.193 0.000 0.776 2448 P CB 0.197 31.851 31.700 -0.078 0.000 0.888 2449 F N 0.786 120.811 119.950 0.126 0.000 2.569 2449 F HA 0.470 4.996 4.527 -0.001 0.000 0.312 2449 F C 1.128 177.003 175.800 0.125 0.000 1.109 2449 F CA -0.619 57.457 58.000 0.126 0.000 0.919 2449 F CB 2.219 41.318 39.000 0.165 0.000 1.211 2449 F HN 0.318 nan 8.300 nan 0.000 0.446 2450 G N 2.086 111.060 108.800 0.291 0.000 2.621 2450 G HA2 0.499 4.458 3.960 -0.001 0.000 0.271 2450 G HA3 0.499 4.458 3.960 -0.001 0.000 0.271 2450 G C -2.723 172.291 174.900 0.190 0.000 1.236 2450 G CA -1.413 43.804 45.100 0.194 0.000 0.958 2450 G HN 0.302 nan 8.290 nan 0.000 0.512 2451 P HA 0.201 nan 4.420 nan 0.000 0.267 2451 P C -0.569 176.785 177.300 0.090 0.000 1.201 2451 P CA -0.158 63.002 63.100 0.102 0.000 0.775 2451 P CB 0.836 32.571 31.700 0.057 0.000 0.854 2452 V N 2.969 122.924 119.914 0.068 0.000 2.487 2452 V HA 0.333 4.452 4.120 -0.001 0.000 0.298 2452 V C 0.114 176.246 176.094 0.064 0.000 1.028 2452 V CA -0.515 61.824 62.300 0.065 0.000 0.860 2452 V CB 1.493 33.368 31.823 0.088 0.000 0.991 2452 V HN 0.417 nan 8.190 nan 0.000 0.427 2453 K N 5.571 126.003 120.400 0.055 0.000 2.265 2453 K HA 0.622 4.941 4.320 -0.001 0.000 0.267 2453 K C -0.811 175.828 176.600 0.065 0.000 0.994 2453 K CA -0.590 55.727 56.287 0.050 0.000 0.860 2453 K CB 1.027 33.540 32.500 0.021 0.000 1.099 2453 K HN 0.613 nan 8.250 nan 0.000 0.448 2454 L N 2.899 124.182 121.223 0.101 0.000 2.466 2454 L HA 0.128 4.467 4.340 -0.001 0.000 0.257 2454 L C 1.718 178.620 176.870 0.053 0.000 1.189 2454 L CA -0.439 54.454 54.840 0.087 0.000 0.813 2454 L CB 0.846 42.988 42.059 0.139 0.000 1.118 2454 L HN 0.785 nan 8.230 nan 0.000 0.471 2455 T N 0.038 114.616 114.554 0.039 0.000 2.822 2455 T HA -0.173 4.176 4.350 -0.001 0.000 0.270 2455 T C 1.044 175.759 174.700 0.025 0.000 1.064 2455 T CA 1.864 63.980 62.100 0.026 0.000 1.131 2455 T CB -0.367 68.512 68.868 0.019 0.000 0.858 2455 T HN 0.806 nan 8.240 nan 0.000 0.483 2456 D N -0.381 120.040 120.400 0.035 0.000 2.340 2456 D HA 0.263 4.902 4.640 -0.001 0.000 0.220 2456 D C 1.435 177.747 176.300 0.019 0.000 1.039 2456 D CA 0.728 54.745 54.000 0.029 0.000 0.866 2456 D CB -0.486 40.336 40.800 0.038 0.000 0.913 2456 D HN 0.404 nan 8.370 nan 0.000 0.523 2457 G N -0.003 108.808 108.800 0.018 0.000 2.234 2457 G HA2 -0.319 3.641 3.960 -0.001 0.000 0.235 2457 G HA3 -0.319 3.641 3.960 -0.001 0.000 0.235 2457 G C 0.361 175.245 174.900 -0.026 0.000 0.997 2457 G CA -0.215 44.884 45.100 -0.003 0.000 0.623 2457 G HN 0.436 nan 8.290 nan 0.000 0.514 2458 R N 0.140 120.629 120.500 -0.017 0.000 2.570 2458 R HA 0.458 4.797 4.340 -0.001 0.000 0.277 2458 R C 0.006 176.205 176.300 -0.169 0.000 1.039 2458 R CA 0.190 56.217 56.100 -0.122 0.000 1.065 2458 R CB 1.104 31.364 30.300 -0.067 0.000 0.964 2458 R HN 0.130 nan 8.270 nan 0.000 0.428 2459 V N 4.783 124.479 119.914 -0.362 0.000 2.384 2459 V HA 0.380 4.499 4.120 -0.001 0.000 0.287 2459 V C -0.690 175.071 176.094 -0.555 0.000 1.020 2459 V CA -0.568 61.558 62.300 -0.290 0.000 0.850 2459 V CB 0.923 32.640 31.823 -0.176 0.000 0.987 2459 V HN 0.511 nan 8.190 nan 0.000 0.436 2460 F N 1.703 121.479 119.950 -0.290 0.000 2.467 2460 F HA 0.531 5.057 4.527 -0.001 0.000 0.336 2460 F C 0.659 176.293 175.800 -0.277 0.000 1.123 2460 F CA -0.526 57.203 58.000 -0.451 0.000 0.964 2460 F CB 2.158 40.436 39.000 -1.204 0.000 1.136 2460 F HN 0.318 nan 8.300 nan 0.000 0.447 2461 T N 5.230 119.809 114.554 0.041 0.000 2.853 2461 T HA 0.293 4.643 4.350 -0.001 0.000 0.317 2461 T C -2.588 172.269 174.700 0.262 0.000 1.059 2461 T CA -1.460 60.719 62.100 0.132 0.000 0.954 2461 T CB 0.683 69.607 68.868 0.094 0.000 0.994 2461 T HN 0.221 nan 8.240 nan 0.000 0.479 2462 P HA 0.326 nan 4.420 nan 0.000 0.275 2462 P C 0.200 177.718 177.300 0.364 0.000 1.228 2462 P CA -0.212 63.198 63.100 0.516 0.000 0.786 2462 P CB 1.020 33.131 31.700 0.684 0.000 0.927 2463 G N 1.498 110.491 108.800 0.323 0.000 2.462 2463 G HA2 0.311 4.271 3.960 -0.001 0.000 0.319 2463 G HA3 0.311 4.271 3.960 -0.001 0.000 0.319 2463 G C -1.010 173.990 174.900 0.166 0.000 1.171 2463 G CA -0.510 44.763 45.100 0.289 0.000 0.920 2463 G HN 0.554 nan 8.290 nan 0.000 0.499 2464 Q N 0.187 120.025 119.800 0.064 0.000 2.400 2464 Q HA 0.436 4.775 4.340 -0.001 0.000 0.255 2464 Q C 0.352 176.126 176.000 -0.377 0.000 1.008 2464 Q CA -0.662 55.109 55.803 -0.053 0.000 0.841 2464 Q CB 0.908 29.677 28.738 0.053 0.000 1.220 2464 Q HN 0.585 nan 8.270 nan 0.000 0.474 2465 G N 4.404 112.955 108.800 -0.415 0.000 3.101 2465 G HA2 0.022 3.981 3.960 -0.001 0.000 0.272 2465 G HA3 0.022 3.981 3.960 -0.001 0.000 0.272 2465 G C -0.354 174.459 174.900 -0.145 0.000 0.801 2465 G CA -0.227 44.588 45.100 -0.474 0.000 1.978 2465 G HN 0.525 nan 8.290 nan 0.000 0.591 2466 N N 1.164 119.828 118.700 -0.060 0.000 2.314 2466 N HA 0.041 4.780 4.740 -0.001 0.000 0.304 2466 N C 1.025 176.637 175.510 0.171 0.000 1.073 2466 N CA -0.641 52.466 53.050 0.095 0.000 0.822 2466 N CB 1.353 39.921 38.487 0.136 0.000 1.280 2466 N HN 0.261 nan 8.380 nan 0.000 0.489 2467 N N 2.027 120.879 118.700 0.254 0.000 2.635 2467 N HA -0.137 4.602 4.740 -0.001 0.000 0.191 2467 N C 1.365 177.005 175.510 0.216 0.000 1.155 2467 N CA 0.445 53.689 53.050 0.323 0.000 0.927 2467 N CB -0.148 38.606 38.487 0.444 0.000 0.976 2467 N HN 0.271 nan 8.380 nan 0.000 0.448 2468 V N -0.507 119.442 119.914 0.058 0.000 2.720 2468 V HA -0.192 3.927 4.120 -0.001 0.000 0.256 2468 V C 1.135 176.885 176.094 -0.574 0.000 1.082 2468 V CA 1.355 63.345 62.300 -0.517 0.000 1.101 2468 V CB -0.743 30.805 31.823 -0.458 0.000 0.693 2468 V HN 0.342 nan 8.190 nan 0.000 0.479 2469 Y N -1.056 119.091 120.300 -0.254 0.000 2.439 2469 Y HA -0.026 4.523 4.550 -0.001 0.000 0.292 2469 Y C 2.106 177.908 175.900 -0.165 0.000 1.130 2469 Y CA 1.086 59.075 58.100 -0.185 0.000 1.254 2469 Y CB 0.323 38.725 38.460 -0.097 0.000 1.000 2469 Y HN 0.244 nan 8.280 nan 0.000 0.554 2470 I N -1.543 119.026 120.570 -0.002 0.000 2.900 2470 I HA -0.134 4.035 4.170 -0.001 0.000 0.251 2470 I C 2.190 178.291 176.117 -0.028 0.000 1.102 2470 I CA 0.715 62.035 61.300 0.033 0.000 1.457 2470 I CB -1.487 36.628 38.000 0.191 0.000 1.285 2470 I HN 0.181 nan 8.210 nan 0.000 0.459 2471 F N 2.176 122.187 119.950 0.102 0.000 2.202 2471 F HA -0.022 4.504 4.527 -0.001 0.000 0.301 2471 F C -0.776 174.947 175.800 -0.128 0.000 1.082 2471 F CA 0.848 58.897 58.000 0.082 0.000 1.313 2471 F CB -2.819 36.381 39.000 0.333 0.000 1.024 2471 F HN 0.088 nan 8.300 nan 0.000 0.495 2472 P HA -0.014 nan 4.420 nan 0.000 0.215 2472 P C 2.090 179.234 177.300 -0.259 0.000 1.157 2472 P CA 2.287 65.165 63.100 -0.370 0.000 0.863 2472 P CB -0.406 31.051 31.700 -0.405 0.000 0.787 2473 G N -0.464 108.218 108.800 -0.198 0.000 2.402 2473 G HA2 -0.181 3.778 3.960 -0.001 0.000 0.216 2473 G HA3 -0.181 3.778 3.960 -0.001 0.000 0.216 2473 G C 1.604 176.420 174.900 -0.139 0.000 1.162 2473 G CA 0.560 45.578 45.100 -0.138 0.000 0.777 2473 G HN 0.129 nan 8.290 nan 0.000 0.539 2474 V N 1.603 121.416 119.914 -0.169 0.000 2.307 2474 V HA -0.113 4.006 4.120 -0.001 0.000 0.245 2474 V C 3.331 179.323 176.094 -0.169 0.000 1.045 2474 V CA 1.973 64.133 62.300 -0.233 0.000 1.024 2474 V CB -0.873 30.710 31.823 -0.401 0.000 0.651 2474 V HN 0.457 nan 8.190 nan 0.000 0.449 2475 A N -0.060 122.678 122.820 -0.136 0.000 1.908 2475 A HA -0.224 4.095 4.320 -0.001 0.000 0.218 2475 A C 2.182 179.720 177.584 -0.076 0.000 1.181 2475 A CA 2.212 54.201 52.037 -0.078 0.000 0.627 2475 A CB -0.630 18.188 19.000 -0.303 0.000 0.818 2475 A HN 0.454 nan 8.150 nan 0.000 0.445 2476 L N -0.237 120.913 121.223 -0.122 0.000 2.017 2476 L HA -0.091 4.248 4.340 -0.001 0.000 0.208 2476 L C 2.682 179.537 176.870 -0.024 0.000 1.073 2476 L CA 2.339 57.136 54.840 -0.072 0.000 0.745 2476 L CB -0.863 41.145 42.059 -0.084 0.000 0.894 2476 L HN 0.349 nan 8.230 nan 0.000 0.432 2477 A N -1.175 121.629 122.820 -0.027 0.000 1.877 2477 A HA -0.150 4.170 4.320 -0.001 0.000 0.216 2477 A C 2.285 179.889 177.584 0.034 0.000 1.186 2477 A CA 2.030 54.078 52.037 0.019 0.000 0.620 2477 A CB -1.190 17.807 19.000 -0.004 0.000 0.822 2477 A HN 0.303 nan 8.150 nan 0.000 0.443 2478 V N 0.328 120.246 119.914 0.005 0.000 2.287 2478 V HA -0.306 3.814 4.120 -0.001 0.000 0.248 2478 V C 2.453 178.585 176.094 0.063 0.000 1.053 2478 V CA 2.203 64.523 62.300 0.033 0.000 1.027 2478 V CB -0.692 31.157 31.823 0.044 0.000 0.646 2478 V HN 0.577 nan 8.190 nan 0.000 0.447 2479 I N -0.527 120.079 120.570 0.060 0.000 2.113 2479 I HA -0.278 3.892 4.170 -0.001 0.000 0.238 2479 I C 2.339 178.504 176.117 0.080 0.000 1.070 2479 I CA 1.717 63.055 61.300 0.063 0.000 1.332 2479 I CB -0.423 37.602 38.000 0.041 0.000 1.044 2479 I HN 0.241 nan 8.210 nan 0.000 0.402 2480 L N -0.124 121.150 121.223 0.085 0.000 2.127 2480 L HA -0.252 4.088 4.340 -0.001 0.000 0.211 2480 L C 2.295 179.327 176.870 0.269 0.000 1.089 2480 L CA 1.046 55.979 54.840 0.155 0.000 0.757 2480 L CB -0.627 41.509 42.059 0.128 0.000 0.899 2480 L HN 0.443 nan 8.230 nan 0.000 0.434 2481 C N -0.342 119.065 119.300 0.178 0.000 2.626 2481 C HA 0.106 4.565 4.460 -0.001 0.000 0.266 2481 C C 1.127 176.154 174.990 0.061 0.000 1.317 2481 C CA -0.292 58.774 59.018 0.079 0.000 1.716 2481 C CB -1.785 25.906 27.740 -0.082 0.000 1.819 2481 C HN 0.637 nan 8.230 nan 0.000 0.578 2482 N N 0.354 119.123 118.700 0.115 0.000 2.735 2482 N HA -0.145 4.594 4.740 -0.001 0.000 0.248 2482 N C -0.338 175.268 175.510 0.162 0.000 1.083 2482 N CA 0.253 53.385 53.050 0.137 0.000 0.703 2482 N CB -0.953 37.642 38.487 0.179 0.000 1.005 2482 N HN 0.458 nan 8.380 nan 0.000 0.550 2483 T N -0.238 114.388 114.554 0.120 0.000 2.926 2483 T HA 0.097 4.447 4.350 -0.001 0.000 0.307 2483 T C 1.561 176.301 174.700 0.067 0.000 1.059 2483 T CA 0.089 62.276 62.100 0.145 0.000 1.122 2483 T CB 1.134 70.058 68.868 0.092 0.000 0.972 2483 T HN 0.217 nan 8.240 nan 0.000 0.545 2484 R N 0.666 121.168 120.500 0.003 0.000 2.146 2484 R HA 0.145 4.484 4.340 -0.001 0.000 0.206 2484 R C 0.033 175.989 176.300 -0.574 0.000 1.049 2484 R CA 0.575 56.480 56.100 -0.326 0.000 1.029 2484 R CB 0.237 30.246 30.300 -0.485 0.000 0.949 2484 R HN 0.665 nan 8.270 nan 0.000 0.471 2485 H N -0.984 118.165 119.070 0.132 0.000 2.851 2485 H HA 0.406 4.962 4.556 -0.001 0.000 0.372 2485 H C -1.087 174.342 175.328 0.168 0.000 1.158 2485 H CA -0.718 55.420 56.048 0.149 0.000 1.159 2485 H CB 2.181 32.016 29.762 0.122 0.000 1.757 2485 H HN -0.107 nan 8.280 nan 0.000 0.546 2486 I N 2.359 123.118 120.570 0.315 0.000 2.328 2486 I HA 0.246 4.415 4.170 -0.001 0.000 0.287 2486 I C 0.097 176.390 176.117 0.293 0.000 1.012 2486 I CA -0.585 60.876 61.300 0.269 0.000 1.195 2486 I CB 1.052 39.236 38.000 0.305 0.000 1.350 2486 I HN 0.572 nan 8.210 nan 0.000 0.464 2487 S N 2.966 118.813 115.700 0.245 0.000 2.632 2487 S HA 0.233 4.702 4.470 -0.001 0.000 0.271 2487 S C 0.695 175.465 174.600 0.282 0.000 1.260 2487 S CA -0.741 57.601 58.200 0.237 0.000 1.010 2487 S CB 1.592 64.915 63.200 0.205 0.000 0.965 2487 S HN 0.542 nan 8.310 nan 0.000 0.534 2488 D N 1.579 122.136 120.400 0.262 0.000 2.182 2488 D HA -0.124 4.515 4.640 -0.001 0.000 0.201 2488 D C 2.182 178.632 176.300 0.250 0.000 0.986 2488 D CA 1.777 55.953 54.000 0.293 0.000 0.847 2488 D CB -0.517 40.398 40.800 0.193 0.000 0.942 2488 D HN 0.748 nan 8.370 nan 0.000 0.467 2489 S N 0.144 115.948 115.700 0.172 0.000 2.419 2489 S HA -0.113 4.357 4.470 -0.001 0.000 0.233 2489 S C 2.196 176.725 174.600 -0.117 0.000 1.016 2489 S CA 0.678 58.928 58.200 0.084 0.000 0.974 2489 S CB -0.519 62.791 63.200 0.183 0.000 0.786 2489 S HN 0.081 nan 8.310 nan 0.000 0.492 2490 V N 0.798 120.663 119.914 -0.081 0.000 2.343 2490 V HA -0.108 4.011 4.120 -0.001 0.000 0.247 2490 V C 2.176 178.005 176.094 -0.441 0.000 1.051 2490 V CA 1.864 63.961 62.300 -0.338 0.000 1.036 2490 V CB -1.064 30.581 31.823 -0.296 0.000 0.654 2490 V HN 0.503 nan 8.190 nan 0.000 0.451 2491 F N -0.810 119.074 119.950 -0.110 0.000 2.325 2491 F HA -0.065 4.461 4.527 -0.001 0.000 0.299 2491 F C 2.028 177.787 175.800 -0.068 0.000 1.090 2491 F CA 1.149 59.100 58.000 -0.080 0.000 1.392 2491 F CB -0.469 38.513 39.000 -0.031 0.000 1.053 2491 F HN 0.101 nan 8.300 nan 0.000 0.521 2492 L N 0.421 121.678 121.223 0.057 0.000 2.056 2492 L HA -0.164 4.176 4.340 -0.001 0.000 0.207 2492 L C 2.349 179.173 176.870 -0.077 0.000 1.078 2492 L CA 1.738 56.590 54.840 0.019 0.000 0.749 2492 L CB -0.655 41.416 42.059 0.019 0.000 0.901 2492 L HN 0.045 nan 8.230 nan 0.000 0.433 2493 E N -0.193 119.865 120.200 -0.237 0.000 2.106 2493 E HA -0.153 4.196 4.350 -0.001 0.000 0.192 2493 E C 2.067 178.556 176.600 -0.184 0.000 0.984 2493 E CA 1.391 57.607 56.400 -0.307 0.000 0.806 2493 E CB -0.269 29.008 29.700 -0.706 0.000 0.750 2493 E HN 0.522 nan 8.360 nan 0.000 0.458 2494 A N 0.790 123.502 122.820 -0.180 0.000 1.898 2494 A HA 0.011 4.331 4.320 -0.001 0.000 0.216 2494 A C 2.454 180.025 177.584 -0.023 0.000 1.181 2494 A CA 1.902 53.872 52.037 -0.112 0.000 0.620 2494 A CB -1.022 17.892 19.000 -0.143 0.000 0.819 2494 A HN 0.381 nan 8.150 nan 0.000 0.442 2495 A N -0.011 122.818 122.820 0.015 0.000 1.883 2495 A HA -0.207 4.113 4.320 -0.001 0.000 0.217 2495 A C 2.120 179.718 177.584 0.022 0.000 1.186 2495 A CA 1.982 54.051 52.037 0.053 0.000 0.624 2495 A CB -0.463 18.586 19.000 0.081 0.000 0.822 2495 A HN 0.552 nan 8.150 nan 0.000 0.444 2496 K N -0.459 119.940 120.400 -0.001 0.000 2.057 2496 K HA -0.006 4.314 4.320 -0.001 0.000 0.206 2496 K C 2.299 178.896 176.600 -0.007 0.000 1.050 2496 K CA 1.057 57.341 56.287 -0.004 0.000 0.935 2496 K CB -0.312 32.183 32.500 -0.009 0.000 0.715 2496 K HN 0.440 nan 8.250 nan 0.000 0.439 2497 A N 1.349 124.160 122.820 -0.016 0.000 1.933 2497 A HA -0.151 4.168 4.320 -0.001 0.000 0.218 2497 A C 2.069 179.653 177.584 0.000 0.000 1.175 2497 A CA 1.130 53.161 52.037 -0.009 0.000 0.628 2497 A CB -0.460 18.528 19.000 -0.020 0.000 0.814 2497 A HN 0.234 nan 8.150 nan 0.000 0.444 2498 L N -0.560 120.667 121.223 0.006 0.000 2.005 2498 L HA -0.090 4.249 4.340 -0.001 0.000 0.207 2498 L C 2.534 179.397 176.870 -0.013 0.000 1.072 2498 L CA 2.957 57.806 54.840 0.014 0.000 0.744 2498 L CB -1.304 40.779 42.059 0.041 0.000 0.895 2498 L HN 0.365 nan 8.230 nan 0.000 0.433 2499 T N -1.418 113.121 114.554 -0.025 0.000 2.833 2499 T HA -0.155 4.194 4.350 -0.001 0.000 0.269 2499 T C 2.015 176.697 174.700 -0.030 0.000 1.054 2499 T CA 1.599 63.667 62.100 -0.053 0.000 1.135 2499 T CB -0.512 68.325 68.868 -0.052 0.000 0.869 2499 T HN 0.700 nan 8.240 nan 0.000 0.466 2500 S N 0.127 115.819 115.700 -0.013 0.000 2.584 2500 S HA -0.015 4.455 4.470 -0.001 0.000 0.240 2500 S C 1.695 176.295 174.600 -0.001 0.000 0.975 2500 S CA 0.615 58.813 58.200 -0.004 0.000 0.949 2500 S CB -0.418 62.784 63.200 0.002 0.000 0.761 2500 S HN 0.714 nan 8.310 nan 0.000 0.536 2501 Q N -0.164 119.635 119.800 -0.003 0.000 2.282 2501 Q HA 0.391 4.730 4.340 -0.001 0.000 0.206 2501 Q C -0.077 175.925 176.000 0.004 0.000 0.878 2501 Q CA -0.224 55.583 55.803 0.006 0.000 0.944 2501 Q CB 0.327 29.075 28.738 0.016 0.000 1.100 2501 Q HN 0.519 nan 8.270 nan 0.000 0.509 2502 L N 3.005 124.222 121.223 -0.009 0.000 2.418 2502 L HA 0.093 4.433 4.340 -0.001 0.000 0.274 2502 L C 0.387 177.256 176.870 -0.001 0.000 1.135 2502 L CA -0.143 54.691 54.840 -0.010 0.000 0.870 2502 L CB 0.737 42.774 42.059 -0.038 0.000 1.154 2502 L HN 0.127 nan 8.230 nan 0.000 0.462 2503 T N -0.734 113.824 114.554 0.008 0.000 2.910 2503 T HA 0.119 4.468 4.350 -0.001 0.000 0.293 2503 T C 0.905 175.610 174.700 0.008 0.000 1.015 2503 T CA -0.938 61.167 62.100 0.008 0.000 1.094 2503 T CB 1.161 70.036 68.868 0.011 0.000 0.968 2503 T HN 0.538 nan 8.240 nan 0.000 0.521 2504 D N 1.925 122.330 120.400 0.008 0.000 2.133 2504 D HA -0.155 4.484 4.640 -0.001 0.000 0.195 2504 D C 1.734 178.040 176.300 0.010 0.000 0.997 2504 D CA 1.589 55.594 54.000 0.009 0.000 0.840 2504 D CB -0.039 40.766 40.800 0.008 0.000 0.947 2504 D HN 0.749 nan 8.370 nan 0.000 0.452 2505 E N 1.100 121.304 120.200 0.008 0.000 2.118 2505 E HA -0.170 4.179 4.350 -0.001 0.000 0.195 2505 E C 1.970 178.576 176.600 0.009 0.000 0.992 2505 E CA 0.928 57.331 56.400 0.005 0.000 0.804 2505 E CB -0.261 29.441 29.700 0.003 0.000 0.741 2505 E HN 0.479 nan 8.360 nan 0.000 0.458 2506 E N 0.090 120.300 120.200 0.016 0.000 2.158 2506 E HA -0.049 4.300 4.350 -0.001 0.000 0.191 2506 E C 1.981 178.602 176.600 0.035 0.000 0.982 2506 E CA 0.353 56.770 56.400 0.027 0.000 0.823 2506 E CB -0.054 29.666 29.700 0.033 0.000 0.766 2506 E HN 0.186 nan 8.360 nan 0.000 0.468 2507 L N 0.857 122.097 121.223 0.028 0.000 2.017 2507 L HA -0.199 4.141 4.340 -0.001 0.000 0.208 2507 L C 2.583 179.484 176.870 0.052 0.000 1.073 2507 L CA 1.214 56.076 54.840 0.037 0.000 0.745 2507 L CB -0.448 41.626 42.059 0.025 0.000 0.894 2507 L HN 0.148 nan 8.230 nan 0.000 0.432 2508 A N -0.643 122.196 122.820 0.032 0.000 1.917 2508 A HA -0.291 4.029 4.320 -0.001 0.000 0.219 2508 A C 2.197 179.784 177.584 0.006 0.000 1.182 2508 A CA 1.798 53.848 52.037 0.021 0.000 0.633 2508 A CB -0.559 18.440 19.000 -0.001 0.000 0.819 2508 A HN 0.532 nan 8.150 nan 0.000 0.448 2509 Q N -2.104 117.696 119.800 0.000 0.000 2.291 2509 Q HA 0.082 4.421 4.340 -0.001 0.000 0.206 2509 Q C 1.274 177.295 176.000 0.034 0.000 0.976 2509 Q CA 0.817 56.603 55.803 -0.028 0.000 0.875 2509 Q CB -0.122 28.612 28.738 -0.006 0.000 0.927 2509 Q HN 0.987 nan 8.270 nan 0.000 0.450 2510 G N 0.708 109.581 108.800 0.121 0.000 2.175 2510 G HA2 -0.195 3.764 3.960 -0.001 0.000 0.182 2510 G HA3 -0.195 3.764 3.960 -0.001 0.000 0.182 2510 G C -0.260 174.781 174.900 0.235 0.000 1.003 2510 G CA -0.602 44.646 45.100 0.247 0.000 0.666 2510 G HN 0.120 nan 8.290 nan 0.000 0.506 2511 R N 0.140 120.733 120.500 0.154 0.000 2.234 2511 R HA 0.547 4.886 4.340 -0.001 0.000 0.324 2511 R C 1.135 177.476 176.300 0.069 0.000 1.054 2511 R CA -0.375 55.810 56.100 0.142 0.000 0.912 2511 R CB 0.618 30.987 30.300 0.115 0.000 1.030 2511 R HN 0.234 nan 8.270 nan 0.000 0.455 2512 L N 3.283 124.522 121.223 0.026 0.000 2.640 2512 L HA 0.233 4.573 4.340 -0.001 0.000 0.230 2512 L C -0.540 175.969 176.870 -0.603 0.000 1.123 2512 L CA 0.160 54.864 54.840 -0.226 0.000 0.900 2512 L CB 0.118 42.030 42.059 -0.244 0.000 1.146 2512 L HN 0.580 nan 8.230 nan 0.000 0.484 2513 Y N -1.679 118.568 120.300 -0.088 0.000 2.588 2513 Y HA 0.434 4.984 4.550 -0.001 0.000 0.343 2513 Y C -2.439 173.382 175.900 -0.132 0.000 1.065 2513 Y CA -2.708 55.255 58.100 -0.229 0.000 1.038 2513 Y CB 0.963 39.130 38.460 -0.487 0.000 1.297 2513 Y HN -0.221 nan 8.280 nan 0.000 0.467 2514 P HA 0.132 nan 4.420 nan 0.000 0.269 2514 P C -2.629 174.790 177.300 0.198 0.000 1.215 2514 P CA -1.045 62.111 63.100 0.095 0.000 0.780 2514 P CB 0.087 31.846 31.700 0.098 0.000 0.898 2515 P HA -0.031 nan 4.420 nan 0.000 0.264 2515 P C 0.808 178.219 177.300 0.184 0.000 1.193 2515 P CA 0.019 63.216 63.100 0.161 0.000 0.763 2515 P CB 0.276 32.035 31.700 0.098 0.000 0.810 2516 L N 4.988 126.316 121.223 0.176 0.000 2.129 2516 L HA -0.240 4.099 4.340 -0.001 0.000 0.212 2516 L C 2.130 179.005 176.870 0.008 0.000 1.087 2516 L CA 2.184 57.058 54.840 0.058 0.000 0.757 2516 L CB -1.327 40.739 42.059 0.011 0.000 0.896 2516 L HN 0.446 nan 8.230 nan 0.000 0.434 2517 A N -0.900 121.940 122.820 0.033 0.000 2.024 2517 A HA -0.227 4.092 4.320 -0.001 0.000 0.220 2517 A C 1.743 179.332 177.584 0.008 0.000 1.164 2517 A CA 2.020 54.065 52.037 0.013 0.000 0.643 2517 A CB -0.794 18.219 19.000 0.022 0.000 0.806 2517 A HN 0.645 nan 8.150 nan 0.000 0.451 2518 N N -0.900 117.818 118.700 0.030 0.000 2.320 2518 N HA 0.214 4.954 4.740 -0.001 0.000 0.237 2518 N C 0.888 176.411 175.510 0.022 0.000 1.129 2518 N CA -0.201 52.865 53.050 0.026 0.000 0.854 2518 N CB 0.164 38.677 38.487 0.043 0.000 1.083 2518 N HN 0.386 nan 8.380 nan 0.000 0.504 2519 I N 0.851 121.412 120.570 -0.015 0.000 2.248 2519 I HA -0.329 3.840 4.170 -0.001 0.000 0.248 2519 I C 1.746 177.825 176.117 -0.064 0.000 1.107 2519 I CA 1.798 63.056 61.300 -0.070 0.000 1.373 2519 I CB 0.084 37.968 38.000 -0.192 0.000 1.055 2519 I HN 0.199 nan 8.210 nan 0.000 0.418 2520 Q N 0.479 120.247 119.800 -0.053 0.000 1.993 2520 Q HA -0.257 4.082 4.340 -0.001 0.000 0.202 2520 Q C 2.143 178.124 176.000 -0.031 0.000 0.984 2520 Q CA 2.330 58.105 55.803 -0.048 0.000 0.837 2520 Q CB -0.579 28.137 28.738 -0.038 0.000 0.902 2520 Q HN 0.781 nan 8.270 nan 0.000 0.423 2521 E N 0.069 120.260 120.200 -0.016 0.000 2.150 2521 E HA -0.138 4.211 4.350 -0.001 0.000 0.193 2521 E C 1.774 178.375 176.600 0.003 0.000 0.985 2521 E CA 1.287 57.683 56.400 -0.007 0.000 0.814 2521 E CB -0.228 29.472 29.700 -0.001 0.000 0.752 2521 E HN 0.134 nan 8.360 nan 0.000 0.466 2522 V N 1.138 121.064 119.914 0.019 0.000 2.358 2522 V HA -0.236 3.883 4.120 -0.001 0.000 0.246 2522 V C 2.387 178.494 176.094 0.020 0.000 1.047 2522 V CA 1.954 64.280 62.300 0.043 0.000 1.035 2522 V CB -0.361 31.529 31.823 0.112 0.000 0.658 2522 V HN 0.337 nan 8.190 nan 0.000 0.452 2523 S N -0.068 115.624 115.700 -0.014 0.000 2.368 2523 S HA -0.078 4.391 4.470 -0.001 0.000 0.224 2523 S C 1.930 176.503 174.600 -0.047 0.000 1.029 2523 S CA 1.146 59.315 58.200 -0.052 0.000 0.988 2523 S CB -0.220 62.917 63.200 -0.104 0.000 0.838 2523 S HN 0.383 nan 8.310 nan 0.000 0.462 2524 I N 2.763 123.311 120.570 -0.036 0.000 2.226 2524 I HA -0.128 4.042 4.170 -0.001 0.000 0.245 2524 I C 1.829 177.937 176.117 -0.014 0.000 1.100 2524 I CA 1.191 62.474 61.300 -0.029 0.000 1.374 2524 I CB -1.537 36.448 38.000 -0.025 0.000 1.057 2524 I HN 0.251 nan 8.210 nan 0.000 0.413 2525 N N 1.010 119.707 118.700 -0.006 0.000 2.244 2525 N HA -0.072 4.667 4.740 -0.001 0.000 0.183 2525 N C 1.961 177.471 175.510 0.001 0.000 1.016 2525 N CA 1.022 54.074 53.050 0.003 0.000 0.866 2525 N CB -0.190 38.302 38.487 0.009 0.000 0.980 2525 N HN 0.374 nan 8.380 nan 0.000 0.430 2526 I N 0.698 121.262 120.570 -0.009 0.000 2.315 2526 I HA -0.171 3.998 4.170 -0.001 0.000 0.248 2526 I C 2.208 178.307 176.117 -0.030 0.000 1.117 2526 I CA 0.681 61.968 61.300 -0.022 0.000 1.404 2526 I CB -0.217 37.764 38.000 -0.031 0.000 1.071 2526 I HN 0.047 nan 8.210 nan 0.000 0.419 2527 A N 1.216 124.019 122.820 -0.029 0.000 1.902 2527 A HA -0.157 4.162 4.320 -0.001 0.000 0.217 2527 A C 2.289 179.888 177.584 0.025 0.000 1.181 2527 A CA 1.393 53.419 52.037 -0.018 0.000 0.623 2527 A CB -0.734 18.251 19.000 -0.026 0.000 0.818 2527 A HN 0.345 nan 8.150 nan 0.000 0.443 2528 I N -0.368 120.220 120.570 0.031 0.000 2.142 2528 I HA -0.271 3.898 4.170 -0.001 0.000 0.240 2528 I C 2.370 178.526 176.117 0.065 0.000 1.078 2528 I CA 1.402 62.737 61.300 0.058 0.000 1.343 2528 I CB -0.272 37.754 38.000 0.043 0.000 1.046 2528 I HN 0.196 nan 8.210 nan 0.000 0.405 2529 K N 0.488 120.914 120.400 0.042 0.000 2.097 2529 K HA -0.099 4.221 4.320 -0.001 0.000 0.206 2529 K C 2.106 178.748 176.600 0.069 0.000 1.049 2529 K CA 1.159 57.474 56.287 0.048 0.000 0.933 2529 K CB -0.545 31.966 32.500 0.020 0.000 0.717 2529 K HN 0.243 nan 8.250 nan 0.000 0.442 2530 V N 1.789 121.724 119.914 0.035 0.000 2.548 2530 V HA -0.190 3.930 4.120 -0.001 0.000 0.249 2530 V C 2.667 178.832 176.094 0.118 0.000 1.055 2530 V CA 2.159 64.481 62.300 0.037 0.000 1.065 2530 V CB -0.897 30.888 31.823 -0.063 0.000 0.681 2530 V HN 0.520 nan 8.190 nan 0.000 0.462 2531 T N -1.602 113.026 114.554 0.124 0.000 2.777 2531 T HA -0.208 4.141 4.350 -0.001 0.000 0.266 2531 T C 1.654 176.499 174.700 0.241 0.000 1.040 2531 T CA 1.583 63.797 62.100 0.189 0.000 1.141 2531 T CB -0.389 68.635 68.868 0.261 0.000 0.868 2531 T HN 0.554 nan 8.240 nan 0.000 0.444 2532 E N 0.023 120.336 120.200 0.188 0.000 2.118 2532 E HA -0.127 4.222 4.350 -0.001 0.000 0.195 2532 E C 1.878 178.570 176.600 0.155 0.000 0.992 2532 E CA 1.314 57.808 56.400 0.156 0.000 0.804 2532 E CB -0.330 29.433 29.700 0.104 0.000 0.741 2532 E HN 0.696 nan 8.360 nan 0.000 0.458 2533 Y N 1.233 121.558 120.300 0.042 0.000 2.163 2533 Y HA -0.162 4.387 4.550 -0.001 0.000 0.288 2533 Y C 1.946 177.847 175.900 0.001 0.000 1.136 2533 Y CA 1.261 59.370 58.100 0.016 0.000 1.147 2533 Y CB -0.100 38.356 38.460 -0.006 0.000 0.987 2533 Y HN -0.069 nan 8.280 nan 0.000 0.509 2534 L N -1.248 120.025 121.223 0.083 0.000 2.046 2534 L HA -0.274 4.065 4.340 -0.001 0.000 0.208 2534 L C 2.103 178.836 176.870 -0.228 0.000 1.077 2534 L CA 1.646 56.439 54.840 -0.079 0.000 0.747 2534 L CB -0.774 41.239 42.059 -0.077 0.000 0.896 2534 L HN 0.256 nan 8.230 nan 0.000 0.432 2535 Y N -0.532 119.699 120.300 -0.115 0.000 2.263 2535 Y HA -0.148 4.402 4.550 -0.001 0.000 0.292 2535 Y C 2.556 178.354 175.900 -0.171 0.000 1.130 2535 Y CA 0.968 58.977 58.100 -0.150 0.000 1.179 2535 Y CB -0.246 38.142 38.460 -0.119 0.000 0.998 2535 Y HN 0.119 nan 8.280 nan 0.000 0.532 2536 A N -0.349 122.453 122.820 -0.030 0.000 2.168 2536 A HA -0.084 4.235 4.320 -0.001 0.000 0.215 2536 A C 1.206 178.678 177.584 -0.187 0.000 1.152 2536 A CA 1.218 53.196 52.037 -0.099 0.000 0.716 2536 A CB -0.292 18.645 19.000 -0.104 0.000 0.794 2536 A HN 0.418 nan 8.150 nan 0.000 0.465 2537 N N -0.342 118.196 118.700 -0.270 0.000 2.351 2537 N HA 0.172 4.912 4.740 -0.001 0.000 0.254 2537 N C -0.686 174.708 175.510 -0.193 0.000 1.241 2537 N CA -0.125 52.765 53.050 -0.267 0.000 0.883 2537 N CB 0.604 38.819 38.487 -0.453 0.000 1.202 2537 N HN 0.131 nan 8.380 nan 0.000 0.512 2541 F N 1.189 121.049 119.950 -0.150 0.000 2.683 2541 F HA 0.313 4.839 4.527 -0.001 0.000 0.306 2541 F C 1.178 177.043 175.800 0.109 0.000 1.102 2541 F CA -0.254 57.744 58.000 -0.003 0.000 1.244 2541 F CB 0.695 39.705 39.000 0.017 0.000 1.029 2541 F HN 0.559 nan 8.300 nan 0.000 0.545 2542 R N 2.189 122.799 120.500 0.183 0.000 2.298 2542 R HA 0.178 4.518 4.340 -0.001 0.000 0.310 2542 R C -1.268 175.201 176.300 0.282 0.000 1.068 2542 R CA -0.022 56.215 56.100 0.228 0.000 0.957 2542 R CB 0.195 30.624 30.300 0.215 0.000 1.003 2542 R HN 0.341 nan 8.270 nan 0.000 0.454 2543 Y N 3.389 123.769 120.300 0.133 0.000 2.499 2543 Y HA 0.689 5.239 4.550 -0.001 0.000 0.347 2543 Y C -2.459 173.476 175.900 0.058 0.000 0.987 2543 Y CA -2.456 55.697 58.100 0.088 0.000 1.044 2543 Y CB 0.914 39.423 38.460 0.082 0.000 1.245 2543 Y HN 0.489 nan 8.280 nan 0.000 0.461 2544 P HA 0.149 nan 4.420 nan 0.000 0.276 2544 P C -1.162 176.126 177.300 -0.020 0.000 1.261 2544 P CA -0.551 62.631 63.100 0.136 0.000 0.800 2544 P CB 1.242 32.992 31.700 0.083 0.000 1.066 2545 E N 1.756 121.913 120.200 -0.072 0.000 2.324 2545 E HA 0.135 4.484 4.350 -0.001 0.000 0.271 2545 E C -1.725 174.606 176.600 -0.449 0.000 1.028 2545 E CA -1.730 54.436 56.400 -0.390 0.000 0.890 2545 E CB 0.219 29.666 29.700 -0.422 0.000 1.004 2545 E HN 0.264 nan 8.360 nan 0.000 0.431 2546 P HA 0.015 nan 4.420 nan 0.000 0.271 2546 P C 0.014 177.111 177.300 -0.337 0.000 1.216 2546 P CA -0.025 62.808 63.100 -0.445 0.000 0.776 2546 P CB 1.234 32.568 31.700 -0.611 0.000 0.881 2547 E N 0.833 120.919 120.200 -0.191 0.000 2.015 2547 E HA -0.122 4.227 4.350 -0.001 0.000 0.191 2547 E C 0.344 176.877 176.600 -0.110 0.000 0.991 2547 E CA 1.260 57.579 56.400 -0.135 0.000 0.802 2547 E CB -0.060 29.592 29.700 -0.080 0.000 0.759 2547 E HN 0.542 nan 8.360 nan 0.000 0.447 2548 D N 0.590 120.948 120.400 -0.069 0.000 2.479 2548 D HA 0.050 4.689 4.640 -0.001 0.000 0.218 2548 D C 0.383 176.687 176.300 0.008 0.000 1.131 2548 D CA -0.136 53.848 54.000 -0.026 0.000 0.916 2548 D CB 0.774 41.572 40.800 -0.003 0.000 1.022 2548 D HN -0.220 nan 8.370 nan 0.000 0.515 2549 K N 2.086 122.485 120.400 -0.003 0.000 2.103 2549 K HA -0.098 4.222 4.320 -0.001 0.000 0.207 2549 K C 1.815 178.492 176.600 0.129 0.000 1.048 2549 K CA 1.294 57.624 56.287 0.072 0.000 0.930 2549 K CB -0.206 32.327 32.500 0.054 0.000 0.716 2549 K HN 0.437 nan 8.250 nan 0.000 0.444 2550 A N 0.874 123.735 122.820 0.070 0.000 1.902 2550 A HA -0.221 4.098 4.320 -0.001 0.000 0.217 2550 A C 2.137 179.751 177.584 0.051 0.000 1.181 2550 A CA 1.925 53.993 52.037 0.052 0.000 0.623 2550 A CB -0.419 18.598 19.000 0.029 0.000 0.818 2550 A HN 0.308 nan 8.150 nan 0.000 0.443 2551 K N -1.934 118.500 120.400 0.057 0.000 2.097 2551 K HA -0.173 4.146 4.320 -0.001 0.000 0.205 2551 K C 1.928 178.572 176.600 0.073 0.000 1.050 2551 K CA 1.457 57.773 56.287 0.048 0.000 0.938 2551 K CB -0.393 32.132 32.500 0.041 0.000 0.718 2551 K HN 0.474 nan 8.250 nan 0.000 0.442 2552 Y N 1.070 121.360 120.300 -0.016 0.000 2.128 2552 Y HA -0.255 4.294 4.550 -0.001 0.000 0.284 2552 Y C 1.794 177.696 175.900 0.004 0.000 1.154 2552 Y CA 1.637 59.731 58.100 -0.009 0.000 1.149 2552 Y CB -0.439 38.013 38.460 -0.015 0.000 0.976 2552 Y HN -0.144 nan 8.280 nan 0.000 0.505 2553 V N 0.684 120.559 119.914 -0.065 0.000 2.270 2553 V HA -0.285 3.834 4.120 -0.001 0.000 0.245 2553 V C 2.266 178.286 176.094 -0.125 0.000 1.043 2553 V CA 2.344 64.559 62.300 -0.142 0.000 1.014 2553 V CB -0.582 31.236 31.823 -0.009 0.000 0.645 2553 V HN 0.316 nan 8.190 nan 0.000 0.447 2554 K N -0.144 120.218 120.400 -0.063 0.000 2.147 2554 K HA -0.190 4.130 4.320 -0.001 0.000 0.205 2554 K C 2.027 178.586 176.600 -0.069 0.000 1.049 2554 K CA 1.483 57.737 56.287 -0.055 0.000 0.936 2554 K CB -0.166 32.316 32.500 -0.030 0.000 0.722 2554 K HN 0.563 nan 8.250 nan 0.000 0.446 2555 E N 0.326 120.478 120.200 -0.081 0.000 2.274 2555 E HA -0.109 4.241 4.350 -0.001 0.000 0.194 2555 E C 1.311 177.853 176.600 -0.097 0.000 0.996 2555 E CA 0.661 57.015 56.400 -0.076 0.000 0.840 2555 E CB 0.171 29.836 29.700 -0.059 0.000 0.772 2555 E HN 0.206 nan 8.360 nan 0.000 0.491 2556 R N 0.811 121.225 120.500 -0.144 0.000 2.393 2556 R HA 0.055 4.394 4.340 -0.001 0.000 0.244 2556 R C 0.262 176.523 176.300 -0.065 0.000 0.920 2556 R CA 0.065 56.089 56.100 -0.126 0.000 1.076 2556 R CB 0.592 30.757 30.300 -0.224 0.000 1.119 2556 R HN 0.037 nan 8.270 nan 0.000 0.524 2557 T N -2.052 112.471 114.554 -0.052 0.000 2.869 2557 T HA 0.092 4.442 4.350 -0.001 0.000 0.295 2557 T C -0.241 174.484 174.700 0.043 0.000 0.987 2557 T CA -0.779 61.320 62.100 -0.002 0.000 1.109 2557 T CB 1.215 70.071 68.868 -0.020 0.000 0.932 2557 T HN 0.245 nan 8.240 nan 0.000 0.518 2558 W N 3.202 124.442 121.300 -0.101 0.000 2.190 2558 W HA 0.509 5.168 4.660 -0.001 0.000 0.330 2558 W C -0.084 176.372 176.519 -0.105 0.000 1.299 2558 W CA -0.634 56.652 57.345 -0.099 0.000 1.215 2558 W CB 0.535 29.923 29.460 -0.119 0.000 1.147 2558 W HN 0.584 nan 8.180 nan 0.000 0.563 2559 R N 2.091 122.091 120.500 -0.834 0.000 2.664 2559 R HA 0.227 4.567 4.340 -0.001 0.000 0.286 2559 R C 1.093 176.581 176.300 -1.352 0.000 0.967 2559 R CA -0.093 55.541 56.100 -0.778 0.000 0.933 2559 R CB 1.721 31.744 30.300 -0.462 0.000 1.146 2559 R HN 0.502 nan 8.270 nan 0.000 0.468 2560 S N 0.530 115.758 115.700 -0.786 0.000 2.603 2560 S HA 0.003 4.473 4.470 -0.001 0.000 0.220 2560 S C 0.032 174.347 174.600 -0.475 0.000 0.967 2560 S CA -0.133 57.714 58.200 -0.589 0.000 0.920 2560 S CB -0.220 62.882 63.200 -0.163 0.000 0.773 2560 S HN 0.520 nan 8.310 nan 0.000 0.529 2561 E N 1.286 121.223 120.200 -0.439 0.000 2.383 2561 E HA 0.114 4.464 4.350 -0.001 0.000 0.264 2561 E C -0.769 175.666 176.600 -0.275 0.000 1.050 2561 E CA -0.546 55.649 56.400 -0.340 0.000 0.896 2561 E CB 0.223 29.789 29.700 -0.225 0.000 0.982 2561 E HN 0.538 nan 8.360 nan 0.000 0.424 2562 Y N 1.031 121.252 120.300 -0.133 0.000 2.511 2562 Y HA -0.021 4.528 4.550 -0.001 0.000 0.332 2562 Y C 0.930 176.771 175.900 -0.099 0.000 1.177 2562 Y CA 0.011 58.044 58.100 -0.113 0.000 1.422 2562 Y CB 0.644 39.039 38.460 -0.109 0.000 1.271 2562 Y HN 0.323 nan 8.280 nan 0.000 0.550 2563 D N 0.846 121.313 120.400 0.112 0.000 2.332 2563 D HA 0.089 4.728 4.640 -0.001 0.000 0.252 2563 D C -0.540 175.790 176.300 0.050 0.000 1.050 2563 D CA -0.425 53.603 54.000 0.047 0.000 0.970 2563 D CB 1.767 42.589 40.800 0.037 0.000 1.141 2563 D HN 0.366 nan 8.370 nan 0.000 0.485 2564 S N 0.279 116.002 115.700 0.039 0.000 2.523 2564 S HA 0.213 4.682 4.470 -0.001 0.000 0.275 2564 S C 0.845 175.479 174.600 0.056 0.000 1.281 2564 S CA -0.589 57.636 58.200 0.042 0.000 1.050 2564 S CB 0.151 63.372 63.200 0.036 0.000 0.937 2564 S HN 0.330 nan 8.310 nan 0.000 0.492 2565 L N 4.890 126.157 121.223 0.073 0.000 2.700 2565 L HA 0.337 4.676 4.340 -0.001 0.000 0.234 2565 L C 0.015 176.924 176.870 0.066 0.000 1.156 2565 L CA -0.136 54.757 54.840 0.087 0.000 0.946 2565 L CB -0.204 41.942 42.059 0.145 0.000 1.216 2565 L HN 0.471 nan 8.230 nan 0.000 0.493 2566 L N 2.855 124.111 121.223 0.054 0.000 2.380 2566 L HA 0.236 4.576 4.340 -0.001 0.000 0.273 2566 L C -1.469 175.424 176.870 0.040 0.000 1.138 2566 L CA -1.448 53.417 54.840 0.041 0.000 0.832 2566 L CB 0.562 42.643 42.059 0.037 0.000 1.124 2566 L HN -0.016 nan 8.230 nan 0.000 0.454 2567 P HA 0.034 nan 4.420 nan 0.000 0.274 2567 P C -0.902 176.429 177.300 0.052 0.000 1.231 2567 P CA -0.516 62.603 63.100 0.033 0.000 0.790 2567 P CB 0.826 32.531 31.700 0.010 0.000 0.951 2568 D N 1.594 122.044 120.400 0.083 0.000 2.348 2568 D HA 0.129 4.768 4.640 -0.001 0.000 0.259 2568 D C -0.557 175.848 176.300 0.175 0.000 1.296 2568 D CA 0.157 54.249 54.000 0.154 0.000 0.931 2568 D CB 0.040 40.962 40.800 0.203 0.000 1.067 2568 D HN -0.038 nan 8.370 nan 0.000 0.503 2569 V N 6.033 126.027 119.914 0.133 0.000 2.398 2569 V HA 0.495 4.615 4.120 -0.001 0.000 0.286 2569 V C -0.396 175.778 176.094 0.134 0.000 1.026 2569 V CA -0.602 61.709 62.300 0.018 0.000 0.868 2569 V CB 0.806 32.618 31.823 -0.020 0.000 0.982 2569 V HN 0.429 nan 8.190 nan 0.000 0.443 2570 Y N 1.756 122.038 120.300 -0.031 0.000 2.677 2570 Y HA 0.816 5.365 4.550 -0.001 0.000 0.334 2570 Y C -0.905 174.985 175.900 -0.017 0.000 1.196 2570 Y CA -1.441 56.659 58.100 -0.001 0.000 1.059 2570 Y CB 1.392 39.876 38.460 0.041 0.000 1.315 2570 Y HN 0.484 nan 8.280 nan 0.000 0.455 2571 E N 1.102 121.405 120.200 0.170 0.000 2.242 2571 E HA 0.360 4.709 4.350 -0.001 0.000 0.275 2571 E C -1.731 175.080 176.600 0.351 0.000 1.002 2571 E CA -0.599 55.870 56.400 0.115 0.000 0.841 2571 E CB 0.679 30.436 29.700 0.096 0.000 1.109 2571 E HN 0.590 nan 8.360 nan 0.000 0.394 2572 W N 4.811 126.147 121.300 0.060 0.000 2.365 2572 W HA 0.352 5.011 4.660 -0.001 0.000 0.316 2572 W C -1.519 175.032 176.519 0.054 0.000 1.164 2572 W CA -2.386 55.005 57.345 0.077 0.000 1.204 2572 W CB -0.017 29.466 29.460 0.038 0.000 1.213 2572 W HN 0.498 nan 8.180 nan 0.000 0.539 2573 P HA 0.000 nan 4.420 nan 0.000 0.216 2573 P CA 0.000 63.164 63.100 0.106 0.000 0.800 2573 P CB 0.000 31.727 31.700 0.046 0.000 0.726