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 1t77_1_B DATA FIRST_RESID 2076 DATA SEQUENCE GPVSLSTPAQ LVAPSVVVKG TLSVTSSELY FEVDEEDPNF KKIDPKILAY DATA SEQUENCE TEGLHGKWLF TEIRSIFSRR YLLQNTALEI FMANRVAVMF NFPDPATVKK DATA SEQUENCE VVNFLPRVGV GTSFGLPQTR RISLASPRQL FKASNMTQRW QHREISNFEY DATA SEQUENCE LMFLNTIAGR SYNDLNQYPV FPWVITNYES EELDLTLPTN FRDLSKPIGA DATA SEQUENCE LNPKRAAFFA ERYESWEDDQ VPKFHYGTHY STASFVLAWL LRIEPFTTYF DATA SEQUENCE LNLQGGKFDH ADRTFSSISR AWRNSQRDTS DIKELIPEFY YLPEMFVNFN DATA SEQUENCE NYNLGVMDDG TVVSDVELPP WAKTSEEFVH INRLALESEF VSCQLHQWID DATA SEQUENCE LIFGYKQQGP EAVRALNVFY YLTYEGAVNL NSITDPVLRE AVEAQIRSFG DATA SEQUENCE QTPSQLLIEP HPPR 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 2076 G HA2 0.000 nan 3.960 nan 0.000 0.244 2076 G HA3 0.000 3.961 3.960 0.001 0.000 0.244 2076 G C 0.000 174.913 174.900 0.021 0.000 0.946 2076 G CA 0.000 45.113 45.100 0.022 0.000 0.502 2077 P HA 0.366 nan 4.420 nan 0.000 0.270 2077 P C 0.180 177.448 177.300 -0.054 0.000 1.242 2077 P CA -0.287 62.797 63.100 -0.026 0.000 0.768 2077 P CB 1.055 32.736 31.700 -0.031 0.000 0.820 2078 V N 1.119 120.996 119.914 -0.061 0.000 2.432 2078 V HA 0.248 4.369 4.120 0.001 0.000 0.271 2078 V C 1.248 177.236 176.094 -0.177 0.000 1.046 2078 V CA 0.354 62.581 62.300 -0.121 0.000 0.945 2078 V CB 1.305 33.064 31.823 -0.106 0.000 0.992 2078 V HN 0.565 nan 8.190 nan 0.000 0.471 2079 S N 4.507 120.039 115.700 -0.280 0.000 2.446 2079 S HA 0.197 4.668 4.470 0.001 0.000 0.225 2079 S C 0.289 174.559 174.600 -0.550 0.000 1.016 2079 S CA 0.760 58.697 58.200 -0.439 0.000 0.943 2079 S CB -0.313 62.496 63.200 -0.652 0.000 0.786 2079 S HN 0.910 nan 8.310 nan 0.000 0.508 2080 L N 0.710 121.658 121.223 -0.460 0.000 2.472 2080 L HA 0.646 4.987 4.340 0.001 0.000 0.260 2080 L C -1.619 175.131 176.870 -0.200 0.000 0.963 2080 L CA -0.018 54.629 54.840 -0.322 0.000 0.829 2080 L CB 2.152 44.002 42.059 -0.347 0.000 1.348 2080 L HN 0.025 nan 8.230 nan 0.000 0.408 2081 S N 1.713 117.340 115.700 -0.122 0.000 2.548 2081 S HA 0.865 5.335 4.470 0.001 0.000 0.276 2081 S C -1.104 173.477 174.600 -0.031 0.000 1.129 2081 S CA -0.565 57.585 58.200 -0.083 0.000 0.931 2081 S CB 1.938 65.098 63.200 -0.066 0.000 1.068 2081 S HN 0.802 nan 8.310 nan 0.000 0.480 2082 T N 2.132 116.691 114.554 0.008 0.000 2.885 2082 T HA 0.598 4.949 4.350 0.001 0.000 0.322 2082 T C -3.231 171.540 174.700 0.117 0.000 1.387 2082 T CA -1.555 60.582 62.100 0.060 0.000 1.041 2082 T CB 1.362 70.270 68.868 0.066 0.000 1.287 2082 T HN 0.232 nan 8.240 nan 0.000 0.491 2083 P HA 0.635 nan 4.420 nan 0.000 0.272 2083 P C -1.283 176.133 177.300 0.194 0.000 1.223 2083 P CA -0.122 63.054 63.100 0.126 0.000 0.784 2083 P CB 0.829 32.587 31.700 0.096 0.000 0.923 2084 A N 1.469 124.392 122.820 0.172 0.000 2.544 2084 A HA 0.508 4.828 4.320 0.001 0.000 0.291 2084 A C -1.852 175.774 177.584 0.070 0.000 1.055 2084 A CA -0.606 51.452 52.037 0.035 0.000 0.651 2084 A CB 0.979 19.933 19.000 -0.077 0.000 1.296 2084 A HN 0.479 nan 8.150 nan 0.000 0.431 2085 Q N -0.163 119.528 119.800 -0.181 0.000 2.365 2085 Q HA 0.603 4.943 4.340 0.001 0.000 0.269 2085 Q C -1.258 174.532 176.000 -0.350 0.000 1.061 2085 Q CA -0.894 54.816 55.803 -0.156 0.000 0.816 2085 Q CB 2.781 31.387 28.738 -0.221 0.000 1.325 2085 Q HN 0.684 nan 8.270 nan 0.000 0.446 2086 L N 2.499 123.508 121.223 -0.357 0.000 2.260 2086 L HA 0.342 4.682 4.340 0.001 0.000 0.289 2086 L C -1.251 175.408 176.870 -0.351 0.000 1.057 2086 L CA -0.271 54.284 54.840 -0.474 0.000 0.811 2086 L CB 1.141 42.996 42.059 -0.340 0.000 1.184 2086 L HN 0.427 nan 8.230 nan 0.000 0.429 2087 V N 6.407 126.052 119.914 -0.448 0.000 2.304 2087 V HA 0.754 4.875 4.120 0.001 0.000 0.269 2087 V C 0.547 176.487 176.094 -0.256 0.000 1.036 2087 V CA -0.034 62.065 62.300 -0.335 0.000 0.840 2087 V CB 0.200 31.797 31.823 -0.377 0.000 1.036 2087 V HN 0.969 nan 8.190 nan 0.000 0.466 2088 A N 6.351 129.069 122.820 -0.170 0.000 2.350 2088 A HA 0.879 5.199 4.320 0.001 0.000 0.318 2088 A C -1.901 175.617 177.584 -0.111 0.000 1.132 2088 A CA -1.848 50.117 52.037 -0.120 0.000 0.811 2088 A CB 1.440 20.396 19.000 -0.072 0.000 1.313 2088 A HN 0.540 nan 8.150 nan 0.000 0.454 2089 P HA -0.172 nan 4.420 nan 0.000 0.216 2089 P C 1.511 178.516 177.300 -0.493 0.000 1.153 2089 P CA 2.319 65.345 63.100 -0.123 0.000 0.858 2089 P CB 0.118 31.852 31.700 0.058 0.000 0.789 2090 S N -0.831 114.533 115.700 -0.560 0.000 2.361 2090 S HA -0.023 4.447 4.470 0.001 0.000 0.214 2090 S C 1.209 175.580 174.600 -0.381 0.000 1.034 2090 S CA 1.555 59.316 58.200 -0.732 0.000 1.025 2090 S CB -1.241 61.849 63.200 -0.183 0.000 0.996 2090 S HN 0.073 nan 8.310 nan 0.000 0.422 2091 V N -2.358 117.449 119.914 -0.179 0.000 3.103 2091 V HA 0.799 4.920 4.120 0.001 0.000 0.311 2091 V C -1.146 174.910 176.094 -0.063 0.000 1.322 2091 V CA -1.151 61.089 62.300 -0.100 0.000 1.063 2091 V CB 1.902 33.700 31.823 -0.042 0.000 1.090 2091 V HN 0.115 nan 8.190 nan 0.000 0.462 2092 V N 0.907 120.804 119.914 -0.028 0.000 2.376 2092 V HA 0.650 4.771 4.120 0.001 0.000 0.287 2092 V C -0.510 175.601 176.094 0.028 0.000 1.015 2092 V CA -0.297 61.978 62.300 -0.041 0.000 0.834 2092 V CB 1.306 33.112 31.823 -0.028 0.000 1.001 2092 V HN 0.723 nan 8.190 nan 0.000 0.428 2093 V N 4.768 124.721 119.914 0.066 0.000 2.680 2093 V HA 0.473 4.594 4.120 0.001 0.000 0.309 2093 V C 0.168 176.374 176.094 0.187 0.000 1.052 2093 V CA -1.144 61.255 62.300 0.164 0.000 0.908 2093 V CB 2.216 34.203 31.823 0.273 0.000 1.001 2093 V HN 0.748 nan 8.190 nan 0.000 0.431 2094 K N 1.849 122.339 120.400 0.150 0.000 2.202 2094 K HA 0.687 5.008 4.320 0.001 0.000 0.264 2094 K C 0.367 177.052 176.600 0.141 0.000 1.010 2094 K CA 0.267 56.644 56.287 0.150 0.000 0.940 2094 K CB 1.315 33.862 32.500 0.079 0.000 0.983 2094 K HN 1.006 nan 8.250 nan 0.000 0.475 2095 G N 0.025 108.920 108.800 0.158 0.000 2.348 2095 G HA2 0.184 4.145 3.960 0.001 0.000 0.296 2095 G HA3 0.184 4.145 3.960 0.001 0.000 0.296 2095 G C -1.513 173.317 174.900 -0.116 0.000 1.258 2095 G CA -0.586 44.393 45.100 -0.201 0.000 0.868 2095 G HN 0.382 nan 8.290 nan 0.000 0.488 2096 T N 0.665 115.008 114.554 -0.351 0.000 2.809 2096 T HA 0.553 4.904 4.350 0.001 0.000 0.284 2096 T C -0.690 174.005 174.700 -0.009 0.000 0.992 2096 T CA -0.213 61.838 62.100 -0.083 0.000 0.957 2096 T CB 1.433 70.262 68.868 -0.065 0.000 0.942 2096 T HN 0.627 nan 8.240 nan 0.000 0.439 2097 L N 3.390 124.699 121.223 0.144 0.000 2.312 2097 L HA 0.716 5.057 4.340 0.001 0.000 0.281 2097 L C -0.415 176.403 176.870 -0.086 0.000 1.070 2097 L CA 0.291 55.185 54.840 0.091 0.000 0.805 2097 L CB 1.122 43.189 42.059 0.014 0.000 1.174 2097 L HN 0.553 nan 8.230 nan 0.000 0.434 2098 S N 3.512 119.036 115.700 -0.293 0.000 2.557 2098 S HA 0.677 5.147 4.470 0.001 0.000 0.291 2098 S C -1.090 173.234 174.600 -0.460 0.000 1.116 2098 S CA -0.606 57.295 58.200 -0.499 0.000 0.992 2098 S CB 1.944 64.575 63.200 -0.948 0.000 1.028 2098 S HN 0.394 nan 8.310 nan 0.000 0.484 2099 V N 2.689 122.433 119.914 -0.283 0.000 2.407 2099 V HA 0.495 4.615 4.120 0.001 0.000 0.291 2099 V C 0.640 176.614 176.094 -0.200 0.000 1.018 2099 V CA -0.440 61.780 62.300 -0.134 0.000 0.842 2099 V CB 1.506 33.334 31.823 0.008 0.000 0.996 2099 V HN 0.927 nan 8.190 nan 0.000 0.426 2100 T N 2.336 116.777 114.554 -0.189 0.000 2.973 2100 T HA 0.149 4.499 4.350 0.001 0.000 0.308 2100 T C 1.376 175.928 174.700 -0.247 0.000 1.177 2100 T CA 0.656 62.635 62.100 -0.202 0.000 0.938 2100 T CB 1.583 70.362 68.868 -0.149 0.000 1.791 2100 T HN 0.648 nan 8.240 nan 0.000 0.581 2101 S N -0.876 114.681 115.700 -0.239 0.000 2.548 2101 S HA 0.131 4.602 4.470 0.001 0.000 0.215 2101 S C 1.360 175.700 174.600 -0.434 0.000 0.976 2101 S CA 0.885 58.967 58.200 -0.197 0.000 0.908 2101 S CB -0.270 62.885 63.200 -0.074 0.000 0.781 2101 S HN 0.697 nan 8.310 nan 0.000 0.519 2102 S N 0.171 115.475 115.700 -0.660 0.000 2.817 2102 S HA 0.298 4.769 4.470 0.001 0.000 0.262 2102 S C -0.167 173.928 174.600 -0.841 0.000 1.051 2102 S CA -0.582 57.199 58.200 -0.698 0.000 1.185 2102 S CB 0.322 63.381 63.200 -0.235 0.000 1.152 2102 S HN 0.545 nan 8.310 nan 0.000 0.653 2103 E N 1.330 121.010 120.200 -0.866 0.000 2.439 2103 E HA 0.551 4.902 4.350 0.001 0.000 0.279 2103 E C -1.467 175.166 176.600 0.054 0.000 1.077 2103 E CA -1.070 55.212 56.400 -0.196 0.000 0.849 2103 E CB 1.066 30.795 29.700 0.049 0.000 1.408 2103 E HN 0.397 nan 8.360 nan 0.000 0.457 2104 L N -1.084 120.369 121.223 0.383 0.000 2.350 2104 L HA 0.909 5.250 4.340 0.001 0.000 0.260 2104 L C -1.273 175.923 176.870 0.542 0.000 1.015 2104 L CA -1.161 53.888 54.840 0.349 0.000 0.821 2104 L CB 1.939 44.247 42.059 0.416 0.000 1.370 2104 L HN 0.717 nan 8.230 nan 0.000 0.416 2105 Y N 0.213 120.752 120.300 0.398 0.000 2.609 2105 Y HA 0.788 5.338 4.550 0.001 0.000 0.336 2105 Y C -2.107 174.067 175.900 0.456 0.000 1.129 2105 Y CA -1.950 56.409 58.100 0.431 0.000 1.040 2105 Y CB 1.226 39.781 38.460 0.159 0.000 1.310 2105 Y HN 0.664 nan 8.280 nan 0.000 0.460 2106 F N 1.954 122.301 119.950 0.662 0.000 2.551 2106 F HA 0.741 5.268 4.527 0.001 0.000 0.316 2106 F C -1.129 174.858 175.800 0.312 0.000 1.089 2106 F CA -0.744 57.507 58.000 0.418 0.000 0.915 2106 F CB 1.960 41.259 39.000 0.498 0.000 1.186 2106 F HN 0.604 nan 8.300 nan 0.000 0.456 2107 E N 4.466 124.340 120.200 -0.542 0.000 2.244 2107 E HA 0.323 4.673 4.350 0.001 0.000 0.260 2107 E C -1.071 175.058 176.600 -0.784 0.000 0.884 2107 E CA -0.541 55.612 56.400 -0.412 0.000 0.777 2107 E CB 1.974 31.589 29.700 -0.142 0.000 1.197 2107 E HN 0.524 nan 8.360 nan 0.000 0.416 2108 V N 0.308 119.852 119.914 -0.617 0.000 2.811 2108 V HA 0.198 4.318 4.120 0.001 0.000 0.302 2108 V C 0.552 176.358 176.094 -0.479 0.000 1.063 2108 V CA -0.626 61.344 62.300 -0.551 0.000 1.088 2108 V CB 0.955 32.471 31.823 -0.511 0.000 0.982 2108 V HN 0.464 nan 8.190 nan 0.000 0.485 2109 D N 2.847 122.996 120.400 -0.418 0.000 2.402 2109 D HA 0.127 4.767 4.640 0.001 0.000 0.235 2109 D C 0.960 176.994 176.300 -0.443 0.000 1.226 2109 D CA 0.003 53.820 54.000 -0.305 0.000 0.918 2109 D CB 0.726 41.426 40.800 -0.167 0.000 1.043 2109 D HN 0.773 nan 8.370 nan 0.000 0.506 2110 E N 2.014 121.962 120.200 -0.419 0.000 2.511 2110 E HA -0.070 4.281 4.350 0.001 0.000 0.196 2110 E C 0.764 177.365 176.600 0.002 0.000 1.066 2110 E CA 0.355 56.550 56.400 -0.341 0.000 0.871 2110 E CB 0.516 30.155 29.700 -0.102 0.000 0.863 2110 E HN 0.479 nan 8.360 nan 0.000 0.520 2111 E N 0.765 120.944 120.200 -0.036 0.000 2.447 2111 E HA -0.021 4.330 4.350 0.001 0.000 0.195 2111 E C 0.327 176.956 176.600 0.049 0.000 1.028 2111 E CA 0.179 56.592 56.400 0.022 0.000 0.876 2111 E CB 0.151 29.849 29.700 -0.004 0.000 0.885 2111 E HN 0.161 nan 8.360 nan 0.000 0.500 2112 D N 1.498 121.926 120.400 0.047 0.000 2.383 2112 D HA 0.018 4.659 4.640 0.001 0.000 0.252 2112 D C -1.718 174.668 176.300 0.144 0.000 1.166 2112 D CA -1.939 52.109 54.000 0.081 0.000 0.879 2112 D CB 1.894 42.737 40.800 0.071 0.000 1.164 2112 D HN -0.192 nan 8.370 nan 0.000 0.462 2113 P HA -0.152 nan 4.420 nan 0.000 0.214 2113 P C 0.996 178.353 177.300 0.094 0.000 1.163 2113 P CA 1.093 64.245 63.100 0.086 0.000 0.889 2113 P CB 0.221 31.954 31.700 0.055 0.000 0.790 2114 N N -1.513 117.244 118.700 0.094 0.000 2.334 2114 N HA -0.188 4.552 4.740 0.001 0.000 0.187 2114 N C 1.531 177.105 175.510 0.107 0.000 1.016 2114 N CA 0.956 54.055 53.050 0.081 0.000 0.879 2114 N CB -0.702 37.833 38.487 0.080 0.000 0.965 2114 N HN 0.222 nan 8.380 nan 0.000 0.438 2115 F N 2.093 122.053 119.950 0.016 0.000 2.187 2115 F HA 0.043 4.571 4.527 0.001 0.000 0.295 2115 F C 2.008 177.817 175.800 0.016 0.000 1.091 2115 F CA 0.939 58.950 58.000 0.018 0.000 1.308 2115 F CB 0.037 39.050 39.000 0.022 0.000 1.030 2115 F HN -0.171 nan 8.300 nan 0.000 0.487 2116 K N 0.401 120.822 120.400 0.036 0.000 2.147 2116 K HA -0.167 4.154 4.320 0.001 0.000 0.205 2116 K C 1.928 178.460 176.600 -0.113 0.000 1.049 2116 K CA 1.557 57.816 56.287 -0.047 0.000 0.936 2116 K CB -0.162 32.368 32.500 0.051 0.000 0.722 2116 K HN 0.307 nan 8.250 nan 0.000 0.446 2117 K N 0.654 121.005 120.400 -0.082 0.000 2.025 2117 K HA -0.023 4.298 4.320 0.001 0.000 0.207 2117 K C 0.860 177.389 176.600 -0.119 0.000 1.049 2117 K CA 0.411 56.653 56.287 -0.076 0.000 0.933 2117 K CB -0.151 32.325 32.500 -0.041 0.000 0.714 2117 K HN 0.011 nan 8.250 nan 0.000 0.438 2118 I N 3.008 123.476 120.570 -0.170 0.000 3.087 2118 I HA -0.176 3.995 4.170 0.001 0.000 0.318 2118 I C 0.618 176.631 176.117 -0.174 0.000 1.209 2118 I CA 0.602 61.792 61.300 -0.183 0.000 1.460 2118 I CB -0.370 37.466 38.000 -0.274 0.000 1.306 2118 I HN 0.272 nan 8.210 nan 0.000 0.560 2119 D N 8.625 128.961 120.400 -0.107 0.000 2.256 2119 D HA 0.168 4.809 4.640 0.001 0.000 0.250 2119 D C -1.512 174.749 176.300 -0.064 0.000 1.093 2119 D CA -1.730 52.225 54.000 -0.076 0.000 0.882 2119 D CB 2.183 42.959 40.800 -0.040 0.000 1.185 2119 D HN 0.265 nan 8.370 nan 0.000 0.437 2120 P HA -0.188 nan 4.420 nan 0.000 0.219 2120 P C 1.074 178.370 177.300 -0.008 0.000 1.146 2120 P CA 1.234 64.309 63.100 -0.042 0.000 0.808 2120 P CB 0.106 31.782 31.700 -0.039 0.000 0.779 2121 K N -0.307 120.101 120.400 0.014 0.000 2.209 2121 K HA -0.056 4.265 4.320 0.001 0.000 0.204 2121 K C 2.123 178.817 176.600 0.157 0.000 1.048 2121 K CA 1.104 57.425 56.287 0.057 0.000 0.940 2121 K CB -0.686 31.857 32.500 0.070 0.000 0.729 2121 K HN 0.166 nan 8.250 nan 0.000 0.451 2122 I N 1.250 121.909 120.570 0.148 0.000 2.385 2122 I HA -0.141 4.030 4.170 0.001 0.000 0.244 2122 I C 2.169 178.399 176.117 0.188 0.000 1.089 2122 I CA 0.566 62.010 61.300 0.239 0.000 1.410 2122 I CB -0.097 37.986 38.000 0.138 0.000 1.117 2122 I HN 0.068 nan 8.210 nan 0.000 0.429 2123 L N 0.849 122.119 121.223 0.078 0.000 2.351 2123 L HA -0.216 4.124 4.340 0.001 0.000 0.220 2123 L C 2.692 179.606 176.870 0.073 0.000 1.127 2123 L CA 0.986 55.867 54.840 0.067 0.000 0.786 2123 L CB -0.741 41.321 42.059 0.005 0.000 0.914 2123 L HN 0.265 nan 8.230 nan 0.000 0.443 2124 A N -0.696 122.143 122.820 0.031 0.000 1.897 2124 A HA -0.175 4.145 4.320 0.001 0.000 0.215 2124 A C 1.882 179.405 177.584 -0.101 0.000 1.181 2124 A CA 1.160 53.150 52.037 -0.078 0.000 0.620 2124 A CB -0.628 18.250 19.000 -0.205 0.000 0.821 2124 A HN 0.411 nan 8.150 nan 0.000 0.443 2125 Y N 0.617 120.960 120.300 0.072 0.000 2.546 2125 Y HA 0.053 4.603 4.550 0.001 0.000 0.287 2125 Y C 0.801 176.761 175.900 0.101 0.000 1.158 2125 Y CA 0.443 58.589 58.100 0.075 0.000 1.307 2125 Y CB -0.104 38.398 38.460 0.070 0.000 1.036 2125 Y HN 0.076 nan 8.280 nan 0.000 0.532 2126 T N 1.959 116.644 114.554 0.219 0.000 2.907 2126 T HA 0.131 4.482 4.350 0.001 0.000 0.298 2126 T C -0.088 174.697 174.700 0.142 0.000 1.017 2126 T CA -0.403 61.795 62.100 0.164 0.000 1.118 2126 T CB 0.684 69.634 68.868 0.136 0.000 0.948 2126 T HN -0.004 nan 8.240 nan 0.000 0.531 2127 E N 1.053 121.336 120.200 0.140 0.000 2.187 2127 E HA 0.516 4.867 4.350 0.001 0.000 0.268 2127 E C 0.813 177.550 176.600 0.228 0.000 0.896 2127 E CA -0.438 56.060 56.400 0.163 0.000 0.766 2127 E CB 1.695 31.493 29.700 0.164 0.000 1.142 2127 E HN 0.922 nan 8.360 nan 0.000 0.408 2128 G N 2.149 111.115 108.800 0.276 0.000 2.163 2128 G HA2 -0.259 3.702 3.960 0.001 0.000 0.213 2128 G HA3 -0.259 3.702 3.960 0.001 0.000 0.213 2128 G C 0.905 176.061 174.900 0.427 0.000 0.991 2128 G CA 0.223 45.609 45.100 0.477 0.000 0.653 2128 G HN 0.490 nan 8.290 nan 0.000 0.518 2129 L N -0.061 121.273 121.223 0.185 0.000 2.083 2129 L HA 0.057 4.397 4.340 0.001 0.000 0.209 2129 L C 1.381 178.044 176.870 -0.345 0.000 1.083 2129 L CA 1.207 56.023 54.840 -0.041 0.000 0.752 2129 L CB -0.184 41.745 42.059 -0.216 0.000 0.899 2129 L HN 0.379 nan 8.230 nan 0.000 0.433 2130 H N -0.849 118.301 119.070 0.134 0.000 2.716 2130 H HA 0.318 4.874 4.556 0.001 0.000 0.230 2130 H C 0.320 175.612 175.328 -0.059 0.000 1.401 2130 H CA -0.262 55.796 56.048 0.017 0.000 1.168 2130 H CB 0.209 29.947 29.762 -0.040 0.000 1.935 2130 H HN 0.078 nan 8.280 nan 0.000 0.538 2131 G N 0.759 109.565 108.800 0.010 0.000 2.444 2131 G HA2 0.347 4.307 3.960 0.001 0.000 0.268 2131 G HA3 0.347 4.307 3.960 0.001 0.000 0.268 2131 G C -0.307 174.103 174.900 -0.816 0.000 1.203 2131 G CA -0.506 44.231 45.100 -0.605 0.000 0.835 2131 G HN 0.233 nan 8.290 nan 0.000 0.543 2132 K N 1.074 120.853 120.400 -1.034 0.000 2.463 2132 K HA 0.353 4.674 4.320 0.001 0.000 0.255 2132 K C -1.510 174.717 176.600 -0.623 0.000 0.942 2132 K CA -0.891 55.089 56.287 -0.512 0.000 0.814 2132 K CB 1.428 33.780 32.500 -0.247 0.000 1.122 2132 K HN 0.542 nan 8.250 nan 0.000 0.425 2133 W N 6.091 127.529 121.300 0.229 0.000 2.619 2133 W HA 0.307 4.968 4.660 0.001 0.000 0.327 2133 W C -1.017 175.648 176.519 0.242 0.000 1.027 2133 W CA -1.059 56.418 57.345 0.220 0.000 1.233 2133 W CB 1.280 30.886 29.460 0.244 0.000 1.370 2133 W HN 0.340 nan 8.180 nan 0.000 0.453 2134 L N 3.305 124.747 121.223 0.365 0.000 2.319 2134 L HA 0.192 4.533 4.340 0.001 0.000 0.280 2134 L C 1.353 178.485 176.870 0.436 0.000 1.099 2134 L CA -0.165 54.863 54.840 0.313 0.000 0.828 2134 L CB -0.147 42.029 42.059 0.196 0.000 1.150 2134 L HN 0.271 nan 8.230 nan 0.000 0.442 2135 F N 1.326 121.374 119.950 0.163 0.000 2.063 2135 F HA -0.307 4.220 4.527 0.001 0.000 0.298 2135 F C 2.679 178.552 175.800 0.122 0.000 1.105 2135 F CA 1.958 60.042 58.000 0.140 0.000 1.215 2135 F CB -1.432 37.637 39.000 0.114 0.000 0.972 2135 F HN 0.739 nan 8.300 nan 0.000 0.483 2136 T N -2.492 112.253 114.554 0.318 0.000 2.896 2136 T HA -0.252 4.099 4.350 0.001 0.000 0.270 2136 T C 1.583 176.383 174.700 0.167 0.000 1.104 2136 T CA 1.863 64.081 62.100 0.196 0.000 1.115 2136 T CB -0.382 68.577 68.868 0.153 0.000 0.843 2136 T HN 0.238 nan 8.240 nan 0.000 0.523 2137 E N -0.045 120.275 120.200 0.200 0.000 2.415 2137 E HA 0.367 4.717 4.350 0.001 0.000 0.197 2137 E C 0.316 177.020 176.600 0.173 0.000 1.007 2137 E CA -0.189 56.320 56.400 0.181 0.000 0.890 2137 E CB 0.103 29.930 29.700 0.212 0.000 0.891 2137 E HN 0.625 nan 8.360 nan 0.000 0.496 2138 I N 1.906 122.576 120.570 0.166 0.000 2.505 2138 I HA -0.004 4.167 4.170 0.001 0.000 0.287 2138 I C 1.327 177.501 176.117 0.095 0.000 1.104 2138 I CA 0.118 61.493 61.300 0.125 0.000 1.387 2138 I CB 0.633 38.667 38.000 0.058 0.000 1.404 2138 I HN 0.015 nan 8.210 nan 0.000 0.528 2139 R N 3.520 124.094 120.500 0.123 0.000 2.195 2139 R HA 0.163 4.504 4.340 0.001 0.000 0.197 2139 R C 0.246 176.587 176.300 0.068 0.000 0.990 2139 R CA 0.392 56.543 56.100 0.086 0.000 1.048 2139 R CB 0.303 30.660 30.300 0.093 0.000 0.997 2139 R HN 0.739 nan 8.270 nan 0.000 0.502 2140 S N -0.247 115.546 115.700 0.155 0.000 2.541 2140 S HA 0.626 5.096 4.470 0.001 0.000 0.271 2140 S C -0.596 174.174 174.600 0.284 0.000 1.133 2140 S CA -0.855 57.428 58.200 0.138 0.000 0.876 2140 S CB 2.094 65.378 63.200 0.140 0.000 1.105 2140 S HN 0.048 nan 8.310 nan 0.000 0.470 2141 I N 2.269 122.913 120.570 0.123 0.000 2.468 2141 I HA 0.443 4.614 4.170 0.001 0.000 0.284 2141 I C -1.628 174.569 176.117 0.133 0.000 1.038 2141 I CA -0.403 61.014 61.300 0.196 0.000 1.083 2141 I CB 1.287 39.326 38.000 0.065 0.000 1.223 2141 I HN 0.555 nan 8.210 nan 0.000 0.443 2142 F N 3.768 123.822 119.950 0.174 0.000 2.458 2142 F HA 0.393 4.920 4.527 0.001 0.000 0.336 2142 F C 0.895 176.767 175.800 0.120 0.000 1.114 2142 F CA -0.697 57.391 58.000 0.147 0.000 0.987 2142 F CB 1.920 41.035 39.000 0.192 0.000 1.130 2142 F HN 0.312 nan 8.300 nan 0.000 0.458 2143 S N 4.267 120.125 115.700 0.262 0.000 2.562 2143 S HA 0.478 4.949 4.470 0.001 0.000 0.281 2143 S C -0.090 174.632 174.600 0.203 0.000 1.333 2143 S CA -0.353 57.960 58.200 0.189 0.000 1.052 2143 S CB 0.235 63.512 63.200 0.128 0.000 0.884 2143 S HN 0.623 nan 8.310 nan 0.000 0.506 2144 R N 2.263 122.862 120.500 0.165 0.000 2.799 2144 R HA 0.443 4.784 4.340 0.001 0.000 0.270 2144 R C -1.000 175.370 176.300 0.115 0.000 1.010 2144 R CA -0.843 55.334 56.100 0.129 0.000 0.916 2144 R CB 1.657 32.020 30.300 0.105 0.000 1.228 2144 R HN 0.682 nan 8.270 nan 0.000 0.469 2145 R N 0.386 120.941 120.500 0.091 0.000 2.668 2145 R HA 0.430 4.770 4.340 0.001 0.000 0.279 2145 R C -1.173 175.204 176.300 0.129 0.000 0.976 2145 R CA -0.629 55.525 56.100 0.090 0.000 0.978 2145 R CB 1.211 31.536 30.300 0.041 0.000 1.133 2145 R HN 0.486 nan 8.270 nan 0.000 0.484 2146 Y N 2.356 122.645 120.300 -0.020 0.000 2.386 2146 Y HA 0.275 4.825 4.550 0.001 0.000 0.334 2146 Y C -0.377 175.497 175.900 -0.044 0.000 1.002 2146 Y CA -1.179 56.895 58.100 -0.044 0.000 1.068 2146 Y CB 0.863 39.295 38.460 -0.047 0.000 1.203 2146 Y HN 0.599 nan 8.280 nan 0.000 0.443 2147 L N 8.024 128.860 121.223 -0.645 0.000 3.739 2147 L HA -0.352 3.988 4.340 0.001 0.000 0.442 2147 L C 0.411 177.139 176.870 -0.236 0.000 1.241 2147 L CA 0.880 55.420 54.840 -0.501 0.000 0.819 2147 L CB -1.313 40.392 42.059 -0.590 0.000 1.679 2147 L HN 0.927 nan 8.230 nan 0.000 0.889 2148 L N -3.033 118.091 121.223 -0.166 0.000 4.625 2148 L HA -0.276 4.064 4.340 0.001 0.000 0.428 2148 L C 0.755 177.608 176.870 -0.028 0.000 1.129 2148 L CA 0.895 55.684 54.840 -0.086 0.000 0.978 2148 L CB -1.024 40.980 42.059 -0.091 0.000 2.043 2148 L HN 0.566 nan 8.230 nan 0.000 0.847 2149 Q N 0.182 119.978 119.800 -0.006 0.000 2.245 2149 Q HA 0.317 4.658 4.340 0.001 0.000 0.256 2149 Q C 0.277 176.322 176.000 0.075 0.000 0.942 2149 Q CA -0.359 55.470 55.803 0.042 0.000 0.896 2149 Q CB 1.280 30.057 28.738 0.065 0.000 1.272 2149 Q HN 0.050 nan 8.270 nan 0.000 0.442 2150 N N 1.133 119.879 118.700 0.076 0.000 3.331 2150 N HA 0.030 4.770 4.740 0.001 0.000 0.303 2150 N C -0.433 175.147 175.510 0.116 0.000 1.326 2150 N CA 0.035 53.138 53.050 0.090 0.000 1.207 2150 N CB 0.022 38.553 38.487 0.072 0.000 1.477 2150 N HN 0.557 nan 8.380 nan 0.000 0.541 2151 T N -2.489 112.154 114.554 0.149 0.000 3.339 2151 T HA 0.638 4.989 4.350 0.001 0.000 0.292 2151 T C 0.206 175.060 174.700 0.256 0.000 1.012 2151 T CA -0.531 61.687 62.100 0.197 0.000 0.937 2151 T CB 0.183 69.165 68.868 0.188 0.000 1.164 2151 T HN 0.155 nan 8.240 nan 0.000 0.509 2152 A N 0.873 123.821 122.820 0.214 0.000 2.387 2152 A HA 0.969 5.290 4.320 0.001 0.000 0.298 2152 A C -1.638 176.084 177.584 0.230 0.000 1.165 2152 A CA -0.932 51.214 52.037 0.182 0.000 0.814 2152 A CB 1.619 20.666 19.000 0.079 0.000 1.357 2152 A HN 0.396 nan 8.150 nan 0.000 0.443 2153 L N -0.281 121.060 121.223 0.196 0.000 2.505 2153 L HA 0.584 4.925 4.340 0.001 0.000 0.259 2153 L C -0.812 176.114 176.870 0.093 0.000 0.952 2153 L CA 0.005 54.979 54.840 0.224 0.000 0.840 2153 L CB 2.219 44.508 42.059 0.383 0.000 1.358 2153 L HN 0.898 nan 8.230 nan 0.000 0.409 2154 E N 3.812 124.079 120.200 0.112 0.000 2.234 2154 E HA 0.669 5.020 4.350 0.001 0.000 0.266 2154 E C -1.580 175.054 176.600 0.057 0.000 0.877 2154 E CA -0.511 55.862 56.400 -0.045 0.000 0.758 2154 E CB 1.516 31.185 29.700 -0.052 0.000 1.170 2154 E HN 0.564 nan 8.360 nan 0.000 0.415 2155 I N 4.327 124.791 120.570 -0.178 0.000 2.406 2155 I HA 0.353 4.524 4.170 0.001 0.000 0.290 2155 I C -0.979 175.020 176.117 -0.196 0.000 0.999 2155 I CA -0.849 60.431 61.300 -0.033 0.000 1.124 2155 I CB 1.066 39.026 38.000 -0.067 0.000 1.289 2155 I HN 0.455 nan 8.210 nan 0.000 0.441 2156 F N 5.853 125.845 119.950 0.069 0.000 2.420 2156 F HA 0.505 5.033 4.527 0.001 0.000 0.342 2156 F C 0.340 176.185 175.800 0.076 0.000 1.113 2156 F CA -0.694 57.347 58.000 0.068 0.000 1.059 2156 F CB 1.278 40.346 39.000 0.115 0.000 1.128 2156 F HN 0.212 nan 8.300 nan 0.000 0.475 2157 M N 1.671 121.401 119.600 0.215 0.000 2.371 2157 M HA 0.393 4.874 4.480 0.001 0.000 0.301 2157 M C 1.338 177.750 176.300 0.187 0.000 1.173 2157 M CA -0.588 54.831 55.300 0.200 0.000 1.020 2157 M CB 0.716 33.445 32.600 0.214 0.000 1.490 2157 M HN 0.700 nan 8.290 nan 0.000 0.485 2158 A N 1.208 124.122 122.820 0.158 0.000 2.019 2158 A HA -0.169 4.151 4.320 0.001 0.000 0.219 2158 A C 1.157 178.811 177.584 0.116 0.000 1.164 2158 A CA 1.858 53.970 52.037 0.124 0.000 0.644 2158 A CB -1.189 17.876 19.000 0.108 0.000 0.805 2158 A HN 0.936 nan 8.150 nan 0.000 0.449 2159 N N -1.438 117.338 118.700 0.127 0.000 2.362 2159 N HA 0.123 4.864 4.740 0.001 0.000 0.211 2159 N C 0.480 176.059 175.510 0.114 0.000 1.170 2159 N CA 0.258 53.374 53.050 0.110 0.000 0.828 2159 N CB -0.181 38.371 38.487 0.109 0.000 1.034 2159 N HN 0.458 nan 8.380 nan 0.000 0.475 2160 R N -2.552 118.030 120.500 0.137 0.000 3.977 2160 R HA -0.143 4.197 4.340 0.001 0.000 0.428 2160 R C -0.783 175.614 176.300 0.162 0.000 1.079 2160 R CA 0.792 56.988 56.100 0.160 0.000 1.269 2160 R CB -2.405 27.964 30.300 0.115 0.000 1.856 2160 R HN 0.196 nan 8.270 nan 0.000 0.551 2161 V N 0.916 120.908 119.914 0.130 0.000 2.732 2161 V HA 0.625 4.745 4.120 0.001 0.000 0.297 2161 V C 0.675 176.748 176.094 -0.034 0.000 1.060 2161 V CA 0.325 62.670 62.300 0.074 0.000 1.038 2161 V CB 1.599 33.491 31.823 0.116 0.000 1.003 2161 V HN 0.327 nan 8.190 nan 0.000 0.481 2162 A N 4.138 126.834 122.820 -0.207 0.000 2.393 2162 A HA 0.792 5.112 4.320 0.001 0.000 0.306 2162 A C -1.107 176.194 177.584 -0.471 0.000 1.050 2162 A CA -0.546 51.150 52.037 -0.568 0.000 0.724 2162 A CB 1.998 20.264 19.000 -1.225 0.000 1.248 2162 A HN 0.847 nan 8.150 nan 0.000 0.424 2163 V N 3.880 123.434 119.914 -0.601 0.000 2.540 2163 V HA 0.753 4.874 4.120 0.001 0.000 0.302 2163 V C -0.561 175.012 176.094 -0.867 0.000 1.035 2163 V CA -0.693 61.169 62.300 -0.729 0.000 0.873 2163 V CB 1.559 32.779 31.823 -1.004 0.000 0.992 2163 V HN 1.013 nan 8.190 nan 0.000 0.428 2164 M N 6.922 126.003 119.600 -0.865 0.000 2.364 2164 M HA 0.649 5.130 4.480 0.001 0.000 0.334 2164 M C -2.022 173.685 176.300 -0.988 0.000 1.107 2164 M CA -0.284 54.579 55.300 -0.728 0.000 0.988 2164 M CB 1.520 33.867 32.600 -0.422 0.000 1.673 2164 M HN 0.642 nan 8.290 nan 0.000 0.441 2165 F N 2.413 122.102 119.950 -0.436 0.000 2.563 2165 F HA 0.495 5.023 4.527 0.001 0.000 0.316 2165 F C -0.215 175.142 175.800 -0.737 0.000 1.076 2165 F CA -0.902 56.694 58.000 -0.672 0.000 0.921 2165 F CB 1.853 40.390 39.000 -0.772 0.000 1.209 2165 F HN 0.572 nan 8.300 nan 0.000 0.462 2166 N N 1.178 119.488 118.700 -0.650 0.000 2.335 2166 N HA 0.642 5.383 4.740 0.001 0.000 0.304 2166 N C -1.640 173.451 175.510 -0.699 0.000 1.135 2166 N CA -0.369 52.355 53.050 -0.543 0.000 0.817 2166 N CB 1.196 39.352 38.487 -0.552 0.000 1.294 2166 N HN 0.387 nan 8.380 nan 0.000 0.497 2167 F N 0.979 120.937 119.950 0.014 0.000 2.654 2167 F HA 0.493 5.020 4.527 0.001 0.000 0.334 2167 F C -1.321 174.505 175.800 0.043 0.000 1.078 2167 F CA -1.825 56.191 58.000 0.026 0.000 0.986 2167 F CB 1.662 40.679 39.000 0.028 0.000 1.362 2167 F HN 0.420 nan 8.300 nan 0.000 0.498 2168 P HA -0.048 nan 4.420 nan 0.000 0.218 2168 P C -1.123 176.260 177.300 0.138 0.000 1.149 2168 P CA 1.548 64.742 63.100 0.157 0.000 0.817 2168 P CB 0.014 31.793 31.700 0.132 0.000 0.785 2169 D N -5.597 114.894 120.400 0.152 0.000 2.665 2169 D HA 0.113 4.754 4.640 0.001 0.000 0.287 2169 D C -2.530 173.834 176.300 0.106 0.000 1.266 2169 D CA -1.857 52.210 54.000 0.111 0.000 0.830 2169 D CB -0.181 40.664 40.800 0.075 0.000 1.356 2169 D HN -0.184 nan 8.370 nan 0.000 0.437 2170 P HA -0.051 nan 4.420 nan 0.000 0.221 2170 P C 1.150 178.465 177.300 0.025 0.000 1.150 2170 P CA 1.469 64.608 63.100 0.065 0.000 0.800 2170 P CB -0.029 31.705 31.700 0.057 0.000 0.787 2171 A N -0.054 122.777 122.820 0.018 0.000 2.070 2171 A HA -0.093 4.227 4.320 0.001 0.000 0.220 2171 A C 2.171 179.731 177.584 -0.040 0.000 1.159 2171 A CA 1.938 53.971 52.037 -0.006 0.000 0.656 2171 A CB -1.651 17.352 19.000 0.005 0.000 0.800 2171 A HN 0.204 nan 8.150 nan 0.000 0.453 2172 T N -0.801 113.720 114.554 -0.056 0.000 2.978 2172 T HA -0.018 4.333 4.350 0.001 0.000 0.262 2172 T C 1.802 176.298 174.700 -0.340 0.000 1.063 2172 T CA 1.156 63.157 62.100 -0.166 0.000 1.140 2172 T CB -0.149 68.638 68.868 -0.135 0.000 0.886 2172 T HN 0.160 nan 8.240 nan 0.000 0.470 2173 V N 1.685 121.464 119.914 -0.226 0.000 2.427 2173 V HA -0.145 3.975 4.120 0.001 0.000 0.248 2173 V C 2.487 178.497 176.094 -0.140 0.000 1.051 2173 V CA 1.575 63.751 62.300 -0.207 0.000 1.048 2173 V CB -0.475 31.364 31.823 0.027 0.000 0.666 2173 V HN 0.411 nan 8.190 nan 0.000 0.456 2174 K N 0.389 120.735 120.400 -0.090 0.000 2.057 2174 K HA -0.203 4.118 4.320 0.001 0.000 0.206 2174 K C 2.284 178.827 176.600 -0.094 0.000 1.050 2174 K CA 1.587 57.831 56.287 -0.071 0.000 0.935 2174 K CB -0.157 32.313 32.500 -0.048 0.000 0.715 2174 K HN 0.314 nan 8.250 nan 0.000 0.439 2175 K N 0.147 120.489 120.400 -0.096 0.000 2.032 2175 K HA -0.136 4.185 4.320 0.001 0.000 0.209 2175 K C 1.832 178.423 176.600 -0.014 0.000 1.048 2175 K CA 1.654 57.907 56.287 -0.057 0.000 0.927 2175 K CB 0.006 32.486 32.500 -0.034 0.000 0.712 2175 K HN 0.013 nan 8.250 nan 0.000 0.441 2176 V N 0.348 120.195 119.914 -0.112 0.000 2.427 2176 V HA -0.184 3.937 4.120 0.001 0.000 0.248 2176 V C 2.131 178.218 176.094 -0.012 0.000 1.051 2176 V CA 1.299 63.552 62.300 -0.078 0.000 1.048 2176 V CB 0.004 31.621 31.823 -0.343 0.000 0.666 2176 V HN 0.148 nan 8.190 nan 0.000 0.456 2177 V N 0.615 120.492 119.914 -0.061 0.000 2.667 2177 V HA -0.146 3.974 4.120 0.001 0.000 0.252 2177 V C 2.131 178.174 176.094 -0.085 0.000 1.065 2177 V CA 1.593 63.863 62.300 -0.051 0.000 1.083 2177 V CB -0.799 30.996 31.823 -0.046 0.000 0.692 2177 V HN 0.563 nan 8.190 nan 0.000 0.468 2178 N N -0.344 118.270 118.700 -0.144 0.000 2.453 2178 N HA -0.028 4.713 4.740 0.001 0.000 0.183 2178 N C 1.310 176.579 175.510 -0.402 0.000 1.041 2178 N CA 1.179 54.056 53.050 -0.289 0.000 0.900 2178 N CB -0.205 38.045 38.487 -0.394 0.000 0.961 2178 N HN 0.532 nan 8.380 nan 0.000 0.443 2179 F N -0.645 119.298 119.950 -0.011 0.000 2.717 2179 F HA 0.230 4.758 4.527 0.001 0.000 0.297 2179 F C 0.327 176.159 175.800 0.053 0.000 1.113 2179 F CA -0.583 57.449 58.000 0.053 0.000 1.319 2179 F CB 0.405 39.449 39.000 0.074 0.000 1.097 2179 F HN -0.131 nan 8.300 nan 0.000 0.595 2180 L N 0.717 121.963 121.223 0.038 0.000 2.456 2180 L HA 0.312 4.652 4.340 0.001 0.000 0.257 2180 L C -1.988 174.656 176.870 -0.377 0.000 1.162 2180 L CA -2.545 52.103 54.840 -0.320 0.000 0.808 2180 L CB -0.558 41.376 42.059 -0.210 0.000 1.136 2180 L HN -0.258 nan 8.230 nan 0.000 0.466 2181 P HA 0.026 nan 4.420 nan 0.000 0.266 2181 P C -0.489 176.717 177.300 -0.157 0.000 1.193 2181 P CA -0.183 62.734 63.100 -0.305 0.000 0.770 2181 P CB 0.274 31.798 31.700 -0.294 0.000 0.836 2182 R N 2.938 123.387 120.500 -0.085 0.000 2.878 2182 R HA 0.095 4.435 4.340 0.001 0.000 0.239 2182 R C 0.402 176.667 176.300 -0.058 0.000 1.515 2182 R CA 0.018 56.080 56.100 -0.065 0.000 1.210 2182 R CB -0.743 29.532 30.300 -0.042 0.000 1.209 2182 R HN 0.370 nan 8.270 nan 0.000 0.610 2183 V N 0.892 120.764 119.914 -0.069 0.000 3.528 2183 V HA 0.366 4.486 4.120 0.001 0.000 0.294 2183 V C 1.152 177.196 176.094 -0.082 0.000 1.404 2183 V CA 0.210 62.474 62.300 -0.061 0.000 1.065 2183 V CB -0.174 31.621 31.823 -0.046 0.000 0.904 2183 V HN 0.803 nan 8.190 nan 0.000 0.435 2184 G N 0.999 109.744 108.800 -0.092 0.000 2.596 2184 G HA2 -0.299 3.661 3.960 0.001 0.000 0.295 2184 G HA3 -0.299 3.661 3.960 0.001 0.000 0.295 2184 G C 0.588 175.362 174.900 -0.211 0.000 1.240 2184 G CA 0.495 45.522 45.100 -0.121 0.000 0.985 2184 G HN 0.957 nan 8.290 nan 0.000 0.555 2185 V N 2.098 121.844 119.914 -0.281 0.000 3.444 2185 V HA 0.563 4.684 4.120 0.001 0.000 0.308 2185 V C 1.389 177.241 176.094 -0.404 0.000 1.371 2185 V CA 2.084 64.042 62.300 -0.569 0.000 1.141 2185 V CB -0.727 30.768 31.823 -0.547 0.000 1.037 2185 V HN 2.634 nan 8.190 nan 0.000 0.433 2186 G N 0.479 109.139 108.800 -0.233 0.000 2.483 2186 G HA2 -0.159 3.802 3.960 0.001 0.000 0.521 2186 G HA3 -0.159 3.802 3.960 0.001 0.000 0.521 2186 G C 0.378 175.173 174.900 -0.175 0.000 1.278 2186 G CA 0.282 45.261 45.100 -0.201 0.000 0.965 2186 G HN 0.718 nan 8.290 nan 0.000 0.504 2187 T N -3.307 111.140 114.554 -0.179 0.000 3.003 2187 T HA 0.378 4.728 4.350 0.001 0.000 0.261 2187 T C 2.050 176.669 174.700 -0.134 0.000 1.003 2187 T CA 1.426 63.453 62.100 -0.121 0.000 0.917 2187 T CB 0.028 68.850 68.868 -0.077 0.000 1.084 2187 T HN 1.710 nan 8.240 nan 0.000 0.522 2188 S N 0.209 115.749 115.700 -0.266 0.000 2.593 2188 S HA 0.321 4.791 4.470 0.001 0.000 0.217 2188 S C 0.913 175.496 174.600 -0.029 0.000 0.966 2188 S CA -0.506 57.568 58.200 -0.210 0.000 0.914 2188 S CB -0.908 62.123 63.200 -0.282 0.000 0.776 2188 S HN 0.588 nan 8.310 nan 0.000 0.523 2189 F N 1.659 121.601 119.950 -0.012 0.000 2.639 2189 F HA 0.388 4.915 4.527 0.001 0.000 0.302 2189 F C 1.719 177.478 175.800 -0.069 0.000 1.097 2189 F CA -0.375 57.597 58.000 -0.047 0.000 1.294 2189 F CB 0.309 39.369 39.000 0.100 0.000 1.027 2189 F HN 0.383 nan 8.300 nan 0.000 0.550 2190 G N 2.039 110.899 108.800 0.101 0.000 2.225 2190 G HA2 -0.312 3.649 3.960 0.001 0.000 0.267 2190 G HA3 -0.312 3.649 3.960 0.001 0.000 0.267 2190 G C -0.156 174.768 174.900 0.040 0.000 1.024 2190 G CA 0.024 45.147 45.100 0.038 0.000 0.784 2190 G HN 0.323 nan 8.290 nan 0.000 0.507 2191 L N -0.129 121.132 121.223 0.063 0.000 2.334 2191 L HA 0.513 4.854 4.340 0.001 0.000 0.272 2191 L C -1.770 175.104 176.870 0.005 0.000 1.020 2191 L CA -2.460 52.405 54.840 0.043 0.000 0.812 2191 L CB 1.533 43.639 42.059 0.078 0.000 1.264 2191 L HN -0.128 nan 8.230 nan 0.000 0.439 2192 P HA 0.034 nan 4.420 nan 0.000 0.268 2192 P C -1.081 176.200 177.300 -0.031 0.000 1.205 2192 P CA -0.181 62.909 63.100 -0.017 0.000 0.771 2192 P CB 0.343 32.035 31.700 -0.014 0.000 0.858 2193 Q N 1.508 121.286 119.800 -0.036 0.000 2.844 2193 Q HA 0.187 4.528 4.340 0.001 0.000 0.235 2193 Q C -0.010 175.962 176.000 -0.047 0.000 1.336 2193 Q CA -0.054 55.719 55.803 -0.050 0.000 1.026 2193 Q CB -0.154 28.557 28.738 -0.046 0.000 1.513 2193 Q HN 0.522 nan 8.270 nan 0.000 0.577 2194 T N -3.140 111.385 114.554 -0.049 0.000 2.916 2194 T HA 0.399 4.750 4.350 0.001 0.000 0.292 2194 T C 0.825 175.493 174.700 -0.054 0.000 1.055 2194 T CA -0.972 61.101 62.100 -0.045 0.000 1.009 2194 T CB 1.812 70.659 68.868 -0.035 0.000 1.118 2194 T HN 0.341 nan 8.240 nan 0.000 0.497 2195 R N 0.028 120.495 120.500 -0.054 0.000 2.127 2195 R HA -0.061 4.280 4.340 0.001 0.000 0.238 2195 R C 2.617 178.888 176.300 -0.047 0.000 1.134 2195 R CA 1.484 57.549 56.100 -0.058 0.000 0.975 2195 R CB -0.282 29.978 30.300 -0.066 0.000 0.865 2195 R HN 0.696 nan 8.270 nan 0.000 0.447 2196 R N 0.839 121.315 120.500 -0.040 0.000 2.091 2196 R HA -0.140 4.201 4.340 0.001 0.000 0.238 2196 R C 1.966 178.251 176.300 -0.025 0.000 1.136 2196 R CA 1.391 57.474 56.100 -0.028 0.000 0.959 2196 R CB -0.135 30.151 30.300 -0.022 0.000 0.856 2196 R HN 0.096 nan 8.270 nan 0.000 0.437 2197 I N 0.842 121.391 120.570 -0.034 0.000 2.286 2197 I HA -0.187 3.983 4.170 0.001 0.000 0.248 2197 I C 1.953 178.034 176.117 -0.061 0.000 1.115 2197 I CA 1.364 62.640 61.300 -0.040 0.000 1.392 2197 I CB -0.937 37.033 38.000 -0.051 0.000 1.065 2197 I HN 0.185 nan 8.210 nan 0.000 0.418 2198 S N 0.282 115.938 115.700 -0.073 0.000 2.507 2198 S HA 0.012 4.482 4.470 0.001 0.000 0.235 2198 S C 1.746 176.339 174.600 -0.012 0.000 0.988 2198 S CA 0.690 58.845 58.200 -0.075 0.000 0.944 2198 S CB -0.041 63.122 63.200 -0.063 0.000 0.762 2198 S HN 0.368 nan 8.310 nan 0.000 0.526 2199 L N 0.235 121.455 121.223 -0.006 0.000 2.766 2199 L HA 0.398 4.738 4.340 0.001 0.000 0.242 2199 L C 0.771 177.656 176.870 0.025 0.000 1.136 2199 L CA -0.316 54.534 54.840 0.017 0.000 0.933 2199 L CB -0.001 42.059 42.059 0.003 0.000 1.241 2199 L HN 0.106 nan 8.230 nan 0.000 0.522 2200 A N 0.589 123.421 122.820 0.019 0.000 2.445 2200 A HA 0.357 4.677 4.320 0.001 0.000 0.242 2200 A C 0.774 178.386 177.584 0.047 0.000 1.075 2200 A CA 0.033 52.087 52.037 0.029 0.000 0.777 2200 A CB 0.180 19.194 19.000 0.023 0.000 1.013 2200 A HN 0.335 nan 8.150 nan 0.000 0.493 2201 S N 2.266 117.995 115.700 0.049 0.000 2.585 2201 S HA 0.280 4.751 4.470 0.001 0.000 0.273 2201 S C -1.868 172.770 174.600 0.063 0.000 1.339 2201 S CA -0.633 57.600 58.200 0.056 0.000 1.028 2201 S CB 0.515 63.746 63.200 0.051 0.000 0.906 2201 S HN 0.453 nan 8.310 nan 0.000 0.528 2202 P HA -0.163 nan 4.420 nan 0.000 0.216 2202 P C 1.522 178.865 177.300 0.072 0.000 1.154 2202 P CA 1.432 64.561 63.100 0.048 0.000 0.865 2202 P CB 0.029 31.745 31.700 0.028 0.000 0.789 2203 R N -0.449 120.096 120.500 0.075 0.000 2.096 2203 R HA -0.146 4.194 4.340 0.001 0.000 0.235 2203 R C 2.312 178.703 176.300 0.153 0.000 1.127 2203 R CA 1.326 57.492 56.100 0.111 0.000 0.968 2203 R CB -0.805 29.544 30.300 0.081 0.000 0.861 2203 R HN 0.431 nan 8.270 nan 0.000 0.440 2204 Q N 0.541 120.405 119.800 0.106 0.000 2.172 2204 Q HA -0.018 4.323 4.340 0.001 0.000 0.200 2204 Q C 2.266 178.326 176.000 0.099 0.000 0.964 2204 Q CA 0.890 56.748 55.803 0.091 0.000 0.855 2204 Q CB -0.009 28.766 28.738 0.061 0.000 0.918 2204 Q HN 0.335 nan 8.270 nan 0.000 0.444 2205 L N -0.476 120.813 121.223 0.109 0.000 2.093 2205 L HA -0.146 4.195 4.340 0.001 0.000 0.208 2205 L C 2.224 179.195 176.870 0.169 0.000 1.085 2205 L CA 0.857 55.767 54.840 0.117 0.000 0.755 2205 L CB -0.398 41.720 42.059 0.098 0.000 0.904 2205 L HN 0.191 nan 8.230 nan 0.000 0.435 2206 F N 1.254 121.230 119.950 0.043 0.000 2.060 2206 F HA -0.244 4.284 4.527 0.001 0.000 0.295 2206 F C 2.678 178.533 175.800 0.092 0.000 1.120 2206 F CA 1.904 59.953 58.000 0.082 0.000 1.205 2206 F CB -0.199 38.817 39.000 0.027 0.000 0.986 2206 F HN -0.144 nan 8.300 nan 0.000 0.470 2207 K N 0.210 120.689 120.400 0.131 0.000 2.063 2207 K HA -0.163 4.157 4.320 0.001 0.000 0.208 2207 K C 1.962 178.524 176.600 -0.063 0.000 1.048 2207 K CA 1.454 57.747 56.287 0.010 0.000 0.928 2207 K CB -0.444 32.118 32.500 0.104 0.000 0.713 2207 K HN 0.328 nan 8.250 nan 0.000 0.442 2208 A N 0.304 123.116 122.820 -0.013 0.000 2.169 2208 A HA 0.047 4.367 4.320 0.001 0.000 0.212 2208 A C 1.025 178.590 177.584 -0.033 0.000 1.153 2208 A CA 0.387 52.415 52.037 -0.016 0.000 0.756 2208 A CB -0.117 18.891 19.000 0.014 0.000 0.813 2208 A HN 0.321 nan 8.150 nan 0.000 0.471 2209 S N 0.346 116.014 115.700 -0.054 0.000 2.601 2209 S HA 0.177 4.647 4.470 0.001 0.000 0.271 2209 S C 0.847 175.354 174.600 -0.155 0.000 1.305 2209 S CA -0.074 58.090 58.200 -0.061 0.000 1.022 2209 S CB 0.260 63.468 63.200 0.013 0.000 0.940 2209 S HN 0.651 nan 8.310 nan 0.000 0.525 2210 N N 3.667 122.283 118.700 -0.139 0.000 2.235 2210 N HA 0.034 4.775 4.740 0.001 0.000 0.209 2210 N C 1.126 176.512 175.510 -0.207 0.000 1.122 2210 N CA -0.416 52.543 53.050 -0.153 0.000 0.845 2210 N CB 0.027 38.461 38.487 -0.088 0.000 1.004 2210 N HN 0.414 nan 8.380 nan 0.000 0.499 2211 M N 0.912 120.315 119.600 -0.328 0.000 2.213 2211 M HA -0.064 4.416 4.480 0.001 0.000 0.263 2211 M C 1.542 177.677 176.300 -0.274 0.000 1.062 2211 M CA 1.286 56.327 55.300 -0.432 0.000 1.105 2211 M CB -1.000 30.858 32.600 -1.236 0.000 1.385 2211 M HN 0.222 nan 8.290 nan 0.000 0.417 2212 T N 0.295 114.719 114.554 -0.217 0.000 2.777 2212 T HA -0.141 4.209 4.350 0.001 0.000 0.266 2212 T C 1.882 176.470 174.700 -0.186 0.000 1.040 2212 T CA 1.131 63.125 62.100 -0.177 0.000 1.141 2212 T CB -0.070 68.734 68.868 -0.107 0.000 0.868 2212 T HN 0.458 nan 8.240 nan 0.000 0.444 2213 Q N 0.620 120.273 119.800 -0.246 0.000 2.050 2213 Q HA -0.024 4.316 4.340 0.001 0.000 0.202 2213 Q C 2.656 178.397 176.000 -0.431 0.000 0.980 2213 Q CA 1.122 56.696 55.803 -0.383 0.000 0.840 2213 Q CB -0.140 28.415 28.738 -0.305 0.000 0.898 2213 Q HN 0.399 nan 8.270 nan 0.000 0.424 2214 R N -0.419 119.953 120.500 -0.213 0.000 2.120 2214 R HA -0.178 4.163 4.340 0.001 0.000 0.234 2214 R C 1.899 178.160 176.300 -0.065 0.000 1.123 2214 R CA 1.360 57.408 56.100 -0.086 0.000 0.975 2214 R CB -0.369 29.909 30.300 -0.037 0.000 0.866 2214 R HN 0.426 nan 8.270 nan 0.000 0.446 2215 W N 2.317 123.410 121.300 -0.345 0.000 2.409 2215 W HA -0.114 4.547 4.660 0.001 0.000 0.299 2215 W C 1.780 178.138 176.519 -0.268 0.000 1.203 2215 W CA 1.079 58.200 57.345 -0.373 0.000 1.298 2215 W CB -0.092 28.849 29.460 -0.866 0.000 1.127 2215 W HN 0.004 nan 8.180 nan 0.000 0.528 2216 Q N -1.105 118.394 119.800 -0.502 0.000 2.172 2216 Q HA -0.194 4.146 4.340 0.001 0.000 0.200 2216 Q C 1.840 177.638 176.000 -0.337 0.000 0.964 2216 Q CA 1.355 56.788 55.803 -0.616 0.000 0.855 2216 Q CB -0.448 28.012 28.738 -0.464 0.000 0.918 2216 Q HN 0.337 nan 8.270 nan 0.000 0.444 2217 H N 0.157 119.087 119.070 -0.233 0.000 2.547 2217 H HA 0.154 4.710 4.556 0.001 0.000 0.272 2217 H C 0.389 175.624 175.328 -0.155 0.000 0.989 2217 H CA 0.643 56.592 56.048 -0.166 0.000 1.214 2217 H CB 0.386 30.081 29.762 -0.112 0.000 1.389 2217 H HN 0.186 nan 8.280 nan 0.000 0.577 2218 R N -0.401 120.056 120.500 -0.071 0.000 3.862 2218 R HA -0.154 4.187 4.340 0.001 0.000 0.398 2218 R C 0.594 176.898 176.300 0.007 0.000 1.110 2218 R CA 0.800 56.859 56.100 -0.067 0.000 1.010 2218 R CB -2.117 28.137 30.300 -0.076 0.000 1.613 2218 R HN 0.460 nan 8.270 nan 0.000 0.530 2219 E N 0.265 120.485 120.200 0.034 0.000 2.285 2219 E HA 0.055 4.406 4.350 0.001 0.000 0.194 2219 E C 0.585 177.231 176.600 0.076 0.000 0.997 2219 E CA 0.602 57.031 56.400 0.048 0.000 0.845 2219 E CB 0.231 29.960 29.700 0.049 0.000 0.782 2219 E HN 0.148 nan 8.360 nan 0.000 0.491 2220 I N 1.004 121.635 120.570 0.102 0.000 2.509 2220 I HA 0.108 4.279 4.170 0.001 0.000 0.293 2220 I C 0.527 176.798 176.117 0.258 0.000 1.020 2220 I CA -0.767 60.641 61.300 0.180 0.000 1.088 2220 I CB 1.579 39.697 38.000 0.197 0.000 1.267 2220 I HN -0.097 nan 8.210 nan 0.000 0.430 2221 S N 4.869 120.735 115.700 0.276 0.000 2.645 2221 S HA 0.297 4.768 4.470 0.001 0.000 0.266 2221 S C 0.912 175.771 174.600 0.432 0.000 1.258 2221 S CA -0.510 57.872 58.200 0.304 0.000 0.990 2221 S CB 1.008 64.367 63.200 0.265 0.000 0.967 2221 S HN 0.560 nan 8.310 nan 0.000 0.556 2222 N N 0.292 119.240 118.700 0.413 0.000 2.120 2222 N HA -0.082 4.659 4.740 0.001 0.000 0.188 2222 N C 1.286 176.927 175.510 0.219 0.000 1.024 2222 N CA 1.190 54.478 53.050 0.398 0.000 0.852 2222 N CB -0.825 37.846 38.487 0.306 0.000 1.003 2222 N HN 0.704 nan 8.380 nan 0.000 0.424 2223 F N 2.326 122.364 119.950 0.146 0.000 2.043 2223 F HA -0.196 4.331 4.527 0.001 0.000 0.297 2223 F C 2.306 178.243 175.800 0.229 0.000 1.121 2223 F CA 1.653 59.784 58.000 0.218 0.000 1.199 2223 F CB -0.273 38.865 39.000 0.231 0.000 0.968 2223 F HN 0.037 nan 8.300 nan 0.000 0.478 2224 E N -1.264 119.145 120.200 0.350 0.000 2.085 2224 E HA -0.290 4.061 4.350 0.001 0.000 0.194 2224 E C 2.056 178.755 176.600 0.165 0.000 0.994 2224 E CA 1.569 58.120 56.400 0.251 0.000 0.801 2224 E CB -0.509 29.377 29.700 0.311 0.000 0.743 2224 E HN 0.581 nan 8.360 nan 0.000 0.453 2225 Y N 1.160 121.453 120.300 -0.012 0.000 2.200 2225 Y HA -0.158 4.392 4.550 0.001 0.000 0.290 2225 Y C 1.872 177.638 175.900 -0.223 0.000 1.137 2225 Y CA 1.171 59.185 58.100 -0.143 0.000 1.163 2225 Y CB -0.315 37.852 38.460 -0.489 0.000 0.988 2225 Y HN -0.038 nan 8.280 nan 0.000 0.518 2226 L N -1.012 119.951 121.223 -0.433 0.000 1.989 2226 L HA -0.314 4.026 4.340 0.001 0.000 0.211 2226 L C 2.537 179.113 176.870 -0.490 0.000 1.071 2226 L CA 1.461 55.906 54.840 -0.658 0.000 0.749 2226 L CB -0.652 40.765 42.059 -1.070 0.000 0.890 2226 L HN 0.229 nan 8.230 nan 0.000 0.431 2227 M N -0.833 118.588 119.600 -0.299 0.000 2.106 2227 M HA -0.272 4.208 4.480 0.001 0.000 0.259 2227 M C 2.396 178.609 176.300 -0.145 0.000 1.068 2227 M CA 1.885 57.110 55.300 -0.125 0.000 1.100 2227 M CB -1.193 31.357 32.600 -0.083 0.000 1.351 2227 M HN 0.244 nan 8.290 nan 0.000 0.404 2228 F N 1.053 120.831 119.950 -0.286 0.000 2.102 2228 F HA -0.190 4.338 4.527 0.001 0.000 0.298 2228 F C 2.002 177.492 175.800 -0.516 0.000 1.105 2228 F CA 1.505 59.266 58.000 -0.400 0.000 1.239 2228 F CB -0.571 38.176 39.000 -0.421 0.000 0.991 2228 F HN 0.029 nan 8.300 nan 0.000 0.474 2229 L N 0.400 121.040 121.223 -0.972 0.000 2.046 2229 L HA -0.265 4.076 4.340 0.001 0.000 0.208 2229 L C 2.514 178.789 176.870 -0.993 0.000 1.077 2229 L CA 1.515 55.603 54.840 -1.253 0.000 0.747 2229 L CB -1.023 40.150 42.059 -1.477 0.000 0.896 2229 L HN 0.248 nan 8.230 nan 0.000 0.432 2230 N N -0.450 117.891 118.700 -0.599 0.000 2.069 2230 N HA -0.164 4.576 4.740 0.001 0.000 0.191 2230 N C 1.789 177.153 175.510 -0.243 0.000 1.031 2230 N CA 2.118 55.043 53.050 -0.209 0.000 0.852 2230 N CB -0.221 38.223 38.487 -0.072 0.000 1.018 2230 N HN 0.320 nan 8.380 nan 0.000 0.423 2231 T N 2.211 116.583 114.554 -0.304 0.000 2.684 2231 T HA -0.064 4.286 4.350 0.001 0.000 0.267 2231 T C 1.906 176.459 174.700 -0.245 0.000 1.036 2231 T CA 0.604 62.545 62.100 -0.265 0.000 1.148 2231 T CB -0.049 68.708 68.868 -0.185 0.000 0.863 2231 T HN 0.127 nan 8.240 nan 0.000 0.436 2232 I N 1.421 121.747 120.570 -0.406 0.000 2.756 2232 I HA 0.006 4.177 4.170 0.001 0.000 0.262 2232 I C 2.417 178.429 176.117 -0.175 0.000 1.225 2232 I CA 0.432 61.554 61.300 -0.297 0.000 1.472 2232 I CB -1.337 36.243 38.000 -0.700 0.000 1.094 2232 I HN 0.175 nan 8.210 nan 0.000 0.454 2233 A N -0.380 122.322 122.820 -0.197 0.000 2.275 2233 A HA 0.437 4.757 4.320 0.001 0.000 0.212 2233 A C 1.861 179.442 177.584 -0.004 0.000 1.201 2233 A CA 0.730 52.739 52.037 -0.046 0.000 0.843 2233 A CB -0.400 18.668 19.000 0.112 0.000 0.873 2233 A HN 0.493 nan 8.150 nan 0.000 0.492 2234 G N -0.851 107.934 108.800 -0.025 0.000 2.175 2234 G HA2 -0.215 3.745 3.960 0.001 0.000 0.244 2234 G HA3 -0.215 3.745 3.960 0.001 0.000 0.244 2234 G C 0.356 175.231 174.900 -0.042 0.000 0.982 2234 G CA -0.026 45.069 45.100 -0.008 0.000 0.641 2234 G HN 0.447 nan 8.290 nan 0.000 0.527 2235 R N 1.022 121.483 120.500 -0.065 0.000 2.590 2235 R HA 0.520 4.861 4.340 0.001 0.000 0.274 2235 R C 0.544 176.752 176.300 -0.153 0.000 1.061 2235 R CA 1.012 57.051 56.100 -0.101 0.000 1.081 2235 R CB 1.117 31.361 30.300 -0.093 0.000 0.984 2235 R HN 0.988 nan 8.270 nan 0.000 0.448 2236 S N 0.862 116.455 115.700 -0.178 0.000 2.588 2236 S HA 0.274 4.745 4.470 0.001 0.000 0.269 2236 S C -0.016 174.467 174.600 -0.195 0.000 1.157 2236 S CA -0.870 57.231 58.200 -0.165 0.000 0.824 2236 S CB 0.701 63.870 63.200 -0.051 0.000 1.126 2236 S HN 0.561 nan 8.310 nan 0.000 0.464 2237 Y N 1.105 121.398 120.300 -0.012 0.000 2.516 2237 Y HA 0.181 4.732 4.550 0.001 0.000 0.291 2237 Y C 2.351 178.356 175.900 0.174 0.000 1.131 2237 Y CA 0.513 58.686 58.100 0.121 0.000 1.281 2237 Y CB -0.065 38.476 38.460 0.135 0.000 1.013 2237 Y HN 0.613 nan 8.280 nan 0.000 0.554 2238 N N -0.207 118.590 118.700 0.162 0.000 2.354 2238 N HA -0.111 4.630 4.740 0.001 0.000 0.179 2238 N C -0.147 175.385 175.510 0.038 0.000 1.021 2238 N CA 1.014 54.093 53.050 0.047 0.000 0.887 2238 N CB 0.077 38.503 38.487 -0.102 0.000 0.974 2238 N HN 0.220 nan 8.380 nan 0.000 0.437 2239 D N 0.720 121.160 120.400 0.067 0.000 2.438 2239 D HA 0.161 4.802 4.640 0.001 0.000 0.257 2239 D C 1.074 177.438 176.300 0.107 0.000 1.148 2239 D CA -0.323 53.714 54.000 0.061 0.000 0.902 2239 D CB 0.501 41.333 40.800 0.054 0.000 1.062 2239 D HN -0.059 nan 8.370 nan 0.000 0.518 2240 L N 2.262 123.550 121.223 0.109 0.000 2.556 2240 L HA -0.114 4.227 4.340 0.001 0.000 0.230 2240 L C 1.265 178.135 176.870 0.001 0.000 1.163 2240 L CA 0.588 55.488 54.840 0.100 0.000 0.819 2240 L CB -0.254 41.815 42.059 0.016 0.000 0.939 2240 L HN 0.324 nan 8.230 nan 0.000 0.452 2241 N N -0.065 118.607 118.700 -0.046 0.000 2.353 2241 N HA -0.015 4.726 4.740 0.001 0.000 0.185 2241 N C 0.594 176.021 175.510 -0.139 0.000 1.098 2241 N CA 0.491 53.455 53.050 -0.144 0.000 0.872 2241 N CB 0.462 38.835 38.487 -0.191 0.000 0.970 2241 N HN 0.535 nan 8.380 nan 0.000 0.467 2242 Q N -0.124 119.648 119.800 -0.047 0.000 2.144 2242 Q HA 0.152 4.492 4.340 0.001 0.000 0.305 2242 Q C -1.005 174.997 176.000 0.003 0.000 0.876 2242 Q CA -0.367 55.401 55.803 -0.059 0.000 1.130 2242 Q CB 0.562 29.265 28.738 -0.058 0.000 1.267 2242 Q HN 0.183 nan 8.270 nan 0.000 0.433 2243 Y N 2.238 122.484 120.300 -0.090 0.000 2.480 2243 Y HA 0.096 4.647 4.550 0.001 0.000 0.338 2243 Y C -2.053 173.812 175.900 -0.059 0.000 1.220 2243 Y CA -1.437 56.613 58.100 -0.083 0.000 1.430 2243 Y CB 0.524 38.975 38.460 -0.015 0.000 1.311 2243 Y HN 0.127 nan 8.280 nan 0.000 0.575 2244 P HA 0.014 nan 4.420 nan 0.000 0.267 2244 P C -1.356 176.037 177.300 0.155 0.000 1.200 2244 P CA 0.271 63.271 63.100 -0.167 0.000 0.772 2244 P CB 0.471 31.950 31.700 -0.369 0.000 0.855 2245 V N 4.101 124.194 119.914 0.297 0.000 2.448 2245 V HA 0.458 4.579 4.120 0.001 0.000 0.295 2245 V C -0.353 176.093 176.094 0.587 0.000 1.025 2245 V CA -0.232 62.319 62.300 0.418 0.000 0.859 2245 V CB 0.867 32.896 31.823 0.344 0.000 0.988 2245 V HN 0.362 nan 8.190 nan 0.000 0.431 2246 F N 5.742 125.806 119.950 0.189 0.000 2.561 2246 F HA 0.712 5.239 4.527 0.001 0.000 0.321 2246 F C -2.236 173.464 175.800 -0.167 0.000 1.065 2246 F CA -2.325 55.665 58.000 -0.016 0.000 0.934 2246 F CB 2.836 41.848 39.000 0.020 0.000 1.215 2246 F HN 0.287 nan 8.300 nan 0.000 0.471 2247 P HA 0.077 nan 4.420 nan 0.000 0.279 2247 P C -1.084 176.181 177.300 -0.059 0.000 1.252 2247 P CA -0.381 62.404 63.100 -0.525 0.000 0.811 2247 P CB 0.937 31.704 31.700 -1.554 0.000 1.035 2248 W N 1.174 122.496 121.300 0.036 0.000 2.238 2248 W HA 0.188 4.848 4.660 0.001 0.000 0.321 2248 W C 1.172 177.721 176.519 0.050 0.000 1.293 2248 W CA -0.010 57.407 57.345 0.119 0.000 1.204 2248 W CB 0.777 30.419 29.460 0.305 0.000 1.167 2248 W HN 0.107 nan 8.180 nan 0.000 0.553 2249 V N 3.454 123.566 119.914 0.330 0.000 3.137 2249 V HA 0.165 4.286 4.120 0.001 0.000 0.236 2249 V C 0.502 176.595 176.094 -0.002 0.000 1.260 2249 V CA 0.221 62.630 62.300 0.182 0.000 1.244 2249 V CB -0.046 31.913 31.823 0.227 0.000 1.016 2249 V HN 0.274 nan 8.190 nan 0.000 0.477 2250 I N 1.345 121.874 120.570 -0.069 0.000 2.440 2250 I HA 0.267 4.437 4.170 0.001 0.000 0.294 2250 I C 1.245 176.948 176.117 -0.690 0.000 0.995 2250 I CA 0.380 61.419 61.300 -0.435 0.000 1.306 2250 I CB 1.747 39.518 38.000 -0.381 0.000 1.407 2250 I HN 0.275 nan 8.210 nan 0.000 0.501 2251 T N -0.534 113.495 114.554 -0.874 0.000 2.975 2251 T HA 0.106 4.457 4.350 0.001 0.000 0.261 2251 T C 0.536 174.737 174.700 -0.831 0.000 0.984 2251 T CA -0.230 61.247 62.100 -1.039 0.000 0.911 2251 T CB -0.021 68.556 68.868 -0.485 0.000 1.127 2251 T HN 0.453 nan 8.240 nan 0.000 0.514 2252 N N 0.917 119.143 118.700 -0.790 0.000 2.527 2252 N HA 0.229 4.970 4.740 0.001 0.000 0.236 2252 N C -1.254 174.064 175.510 -0.319 0.000 0.999 2252 N CA -0.541 52.258 53.050 -0.418 0.000 0.935 2252 N CB 0.532 38.843 38.487 -0.293 0.000 1.132 2252 N HN 0.379 nan 8.380 nan 0.000 0.511 2253 Y N 1.324 121.728 120.300 0.174 0.000 2.696 2253 Y HA 0.332 4.882 4.550 0.001 0.000 0.260 2253 Y C 1.041 176.981 175.900 0.066 0.000 1.165 2253 Y CA -0.379 57.829 58.100 0.180 0.000 1.189 2253 Y CB 0.822 39.334 38.460 0.086 0.000 1.180 2253 Y HN 0.409 nan 8.280 nan 0.000 0.538 2254 E N -0.569 119.750 120.200 0.199 0.000 2.357 2254 E HA 0.145 4.495 4.350 0.001 0.000 0.202 2254 E C 0.539 177.216 176.600 0.129 0.000 0.855 2254 E CA 0.206 56.681 56.400 0.125 0.000 1.048 2254 E CB -0.057 29.707 29.700 0.107 0.000 1.037 2254 E HN 0.044 nan 8.360 nan 0.000 0.499 2255 S N 2.845 118.645 115.700 0.166 0.000 2.558 2255 S HA -0.045 4.425 4.470 0.001 0.000 0.287 2255 S C 1.229 175.960 174.600 0.219 0.000 1.321 2255 S CA 0.065 58.358 58.200 0.154 0.000 1.048 2255 S CB 0.623 63.888 63.200 0.107 0.000 0.844 2255 S HN 0.137 nan 8.310 nan 0.000 0.512 2256 E N 1.109 121.393 120.200 0.139 0.000 2.208 2256 E HA -0.008 4.343 4.350 0.001 0.000 0.193 2256 E C 0.246 176.963 176.600 0.194 0.000 0.988 2256 E CA 0.892 57.372 56.400 0.134 0.000 0.828 2256 E CB 0.155 29.901 29.700 0.077 0.000 0.763 2256 E HN 0.553 nan 8.360 nan 0.000 0.478 2257 E N 0.351 120.644 120.200 0.156 0.000 2.256 2257 E HA 0.348 4.698 4.350 0.001 0.000 0.267 2257 E C -0.950 175.640 176.600 -0.016 0.000 0.892 2257 E CA -0.938 55.523 56.400 0.101 0.000 0.775 2257 E CB 2.270 31.995 29.700 0.043 0.000 1.207 2257 E HN -0.085 nan 8.360 nan 0.000 0.420 2258 L N 3.353 124.459 121.223 -0.195 0.000 2.356 2258 L HA 0.238 4.579 4.340 0.001 0.000 0.264 2258 L C -0.545 176.124 176.870 -0.335 0.000 1.029 2258 L CA -0.407 54.126 54.840 -0.511 0.000 0.897 2258 L CB 0.674 41.960 42.059 -1.288 0.000 1.256 2258 L HN 0.275 nan 8.230 nan 0.000 0.444 2259 D N 3.949 124.227 120.400 -0.202 0.000 2.382 2259 D HA 0.016 4.656 4.640 0.001 0.000 0.259 2259 D C 0.790 177.050 176.300 -0.066 0.000 1.224 2259 D CA 0.231 54.175 54.000 -0.093 0.000 0.894 2259 D CB 0.947 41.725 40.800 -0.038 0.000 1.127 2259 D HN 0.598 nan 8.370 nan 0.000 0.487 2260 L N 3.479 124.713 121.223 0.018 0.000 2.627 2260 L HA 0.003 4.344 4.340 0.001 0.000 0.232 2260 L C 1.918 179.068 176.870 0.467 0.000 1.150 2260 L CA 0.315 55.286 54.840 0.219 0.000 0.917 2260 L CB -0.156 42.013 42.059 0.183 0.000 1.104 2260 L HN 0.463 nan 8.230 nan 0.000 0.445 2261 T N -4.234 110.529 114.554 0.347 0.000 3.001 2261 T HA 0.129 4.479 4.350 0.001 0.000 0.251 2261 T C 0.734 175.712 174.700 0.463 0.000 1.040 2261 T CA -0.187 62.194 62.100 0.467 0.000 0.985 2261 T CB 0.237 69.223 68.868 0.197 0.000 1.011 2261 T HN 0.064 nan 8.240 nan 0.000 0.509 2262 L N 3.258 124.614 121.223 0.222 0.000 2.407 2262 L HA 0.254 4.594 4.340 0.001 0.000 0.282 2262 L C -1.613 175.221 176.870 -0.060 0.000 1.110 2262 L CA -1.959 52.931 54.840 0.085 0.000 0.863 2262 L CB 1.521 43.582 42.059 0.004 0.000 1.207 2262 L HN 0.014 nan 8.230 nan 0.000 0.454 2263 P HA -0.179 nan 4.420 nan 0.000 0.216 2263 P C 1.464 178.698 177.300 -0.109 0.000 1.150 2263 P CA 1.156 64.078 63.100 -0.297 0.000 0.843 2263 P CB 0.239 31.953 31.700 0.024 0.000 0.787 2264 T N -1.287 113.238 114.554 -0.048 0.000 2.946 2264 T HA -0.106 4.244 4.350 0.001 0.000 0.271 2264 T C 1.313 175.951 174.700 -0.103 0.000 1.104 2264 T CA 1.095 63.169 62.100 -0.043 0.000 1.114 2264 T CB -0.825 68.027 68.868 -0.027 0.000 0.867 2264 T HN 0.048 nan 8.240 nan 0.000 0.513 2265 N N 0.064 118.657 118.700 -0.178 0.000 2.336 2265 N HA 0.160 4.901 4.740 0.001 0.000 0.189 2265 N C -0.643 174.476 175.510 -0.651 0.000 1.113 2265 N CA 0.166 52.959 53.050 -0.428 0.000 0.858 2265 N CB 0.188 38.325 38.487 -0.583 0.000 0.970 2265 N HN 0.349 nan 8.380 nan 0.000 0.471 2266 F N 0.796 120.549 119.950 -0.329 0.000 2.450 2266 F HA 0.384 4.911 4.527 0.001 0.000 0.332 2266 F C 1.073 176.791 175.800 -0.137 0.000 1.093 2266 F CA -1.163 56.678 58.000 -0.263 0.000 1.003 2266 F CB 1.030 39.829 39.000 -0.336 0.000 1.151 2266 F HN -0.282 nan 8.300 nan 0.000 0.474 2267 R N 2.293 122.836 120.500 0.071 0.000 2.623 2267 R HA -0.017 4.324 4.340 0.001 0.000 0.271 2267 R C -0.670 175.726 176.300 0.159 0.000 1.043 2267 R CA -0.100 56.077 56.100 0.128 0.000 1.083 2267 R CB 0.503 30.905 30.300 0.170 0.000 0.974 2267 R HN 0.695 nan 8.270 nan 0.000 0.436 2268 D N 4.926 125.421 120.400 0.157 0.000 2.344 2268 D HA 0.008 4.648 4.640 0.001 0.000 0.253 2268 D C 0.939 177.334 176.300 0.158 0.000 1.255 2268 D CA -0.069 54.013 54.000 0.137 0.000 0.894 2268 D CB 0.478 41.348 40.800 0.117 0.000 1.067 2268 D HN 0.560 nan 8.370 nan 0.000 0.492 2269 L N 2.945 124.260 121.223 0.153 0.000 2.551 2269 L HA -0.109 4.232 4.340 0.001 0.000 0.228 2269 L C 2.242 179.229 176.870 0.196 0.000 1.153 2269 L CA 0.673 55.628 54.840 0.192 0.000 0.851 2269 L CB -0.271 41.874 42.059 0.144 0.000 0.959 2269 L HN 0.381 nan 8.230 nan 0.000 0.451 2270 S N -1.796 113.973 115.700 0.116 0.000 2.528 2270 S HA 0.057 4.528 4.470 0.001 0.000 0.219 2270 S C 0.785 175.415 174.600 0.051 0.000 0.985 2270 S CA -0.089 58.147 58.200 0.060 0.000 0.914 2270 S CB 0.049 63.272 63.200 0.038 0.000 0.776 2270 S HN 0.264 nan 8.310 nan 0.000 0.526 2271 K N 2.043 122.496 120.400 0.088 0.000 2.207 2271 K HA 0.530 4.851 4.320 0.001 0.000 0.255 2271 K C -3.048 173.604 176.600 0.086 0.000 0.941 2271 K CA -2.525 53.802 56.287 0.065 0.000 0.825 2271 K CB 1.508 34.051 32.500 0.071 0.000 1.119 2271 K HN 0.066 nan 8.250 nan 0.000 0.430 2272 P HA 0.068 nan 4.420 nan 0.000 0.272 2272 P C 0.861 178.184 177.300 0.038 0.000 1.240 2272 P CA -0.512 62.592 63.100 0.007 0.000 0.791 2272 P CB 0.484 32.167 31.700 -0.028 0.000 0.978 2273 I N 0.962 121.554 120.570 0.037 0.000 2.151 2273 I HA -0.203 3.967 4.170 0.001 0.000 0.243 2273 I C 2.369 178.474 176.117 -0.020 0.000 1.080 2273 I CA 2.288 63.610 61.300 0.037 0.000 1.339 2273 I CB -2.257 35.779 38.000 0.059 0.000 1.039 2273 I HN 0.521 nan 8.210 nan 0.000 0.409 2274 G N 0.354 109.074 108.800 -0.134 0.000 2.485 2274 G HA2 -0.169 3.792 3.960 0.001 0.000 0.221 2274 G HA3 -0.169 3.792 3.960 0.001 0.000 0.221 2274 G C 1.606 176.651 174.900 0.241 0.000 1.115 2274 G CA 0.898 46.014 45.100 0.025 0.000 0.751 2274 G HN 0.538 nan 8.290 nan 0.000 0.567 2275 A N -0.184 122.710 122.820 0.124 0.000 2.275 2275 A HA 0.461 4.782 4.320 0.001 0.000 0.212 2275 A C 2.184 179.825 177.584 0.094 0.000 1.201 2275 A CA 0.016 52.121 52.037 0.114 0.000 0.843 2275 A CB -0.058 18.969 19.000 0.044 0.000 0.873 2275 A HN 0.331 nan 8.150 nan 0.000 0.492 2276 L N -0.238 121.037 121.223 0.085 0.000 2.072 2276 L HA -0.039 4.302 4.340 0.001 0.000 0.205 2276 L C 1.101 178.007 176.870 0.059 0.000 1.079 2276 L CA 0.596 55.482 54.840 0.077 0.000 0.752 2276 L CB -0.452 41.654 42.059 0.078 0.000 0.906 2276 L HN 0.426 nan 8.230 nan 0.000 0.436 2277 N N 1.392 120.119 118.700 0.046 0.000 2.415 2277 N HA 0.068 4.808 4.740 0.001 0.000 0.246 2277 N C -1.682 173.860 175.510 0.053 0.000 1.078 2277 N CA -1.680 51.387 53.050 0.029 0.000 0.942 2277 N CB 1.504 39.987 38.487 -0.005 0.000 1.140 2277 N HN -0.048 nan 8.380 nan 0.000 0.501 2278 P HA -0.188 nan 4.420 nan 0.000 0.216 2278 P C 1.043 178.364 177.300 0.035 0.000 1.150 2278 P CA 1.183 64.310 63.100 0.044 0.000 0.837 2278 P CB 0.535 32.256 31.700 0.035 0.000 0.786 2279 K N 0.965 121.375 120.400 0.016 0.000 2.026 2279 K HA -0.135 4.186 4.320 0.001 0.000 0.208 2279 K C 2.475 179.066 176.600 -0.015 0.000 1.048 2279 K CA 1.555 57.841 56.287 -0.002 0.000 0.929 2279 K CB -0.966 31.522 32.500 -0.019 0.000 0.713 2279 K HN -0.075 nan 8.250 nan 0.000 0.439 2280 R N -0.468 120.016 120.500 -0.026 0.000 2.148 2280 R HA 0.051 4.392 4.340 0.001 0.000 0.223 2280 R C 1.870 178.135 176.300 -0.059 0.000 1.088 2280 R CA 1.041 57.085 56.100 -0.092 0.000 0.985 2280 R CB -0.236 30.021 30.300 -0.070 0.000 0.880 2280 R HN 0.243 nan 8.270 nan 0.000 0.451 2281 A N 0.670 123.552 122.820 0.103 0.000 2.015 2281 A HA -0.041 4.280 4.320 0.001 0.000 0.219 2281 A C 2.260 179.922 177.584 0.131 0.000 1.163 2281 A CA 1.381 53.547 52.037 0.215 0.000 0.646 2281 A CB -0.483 18.612 19.000 0.158 0.000 0.806 2281 A HN 0.496 nan 8.150 nan 0.000 0.448 2282 A N -0.825 122.038 122.820 0.073 0.000 1.898 2282 A HA -0.003 4.318 4.320 0.001 0.000 0.216 2282 A C 1.981 179.607 177.584 0.071 0.000 1.181 2282 A CA 1.535 53.609 52.037 0.063 0.000 0.620 2282 A CB -0.695 18.334 19.000 0.050 0.000 0.819 2282 A HN 0.674 nan 8.150 nan 0.000 0.442 2283 F N 0.116 119.984 119.950 -0.136 0.000 2.046 2283 F HA -0.188 4.340 4.527 0.001 0.000 0.297 2283 F C 1.990 177.722 175.800 -0.112 0.000 1.123 2283 F CA 1.738 59.623 58.000 -0.190 0.000 1.199 2283 F CB -0.803 37.973 39.000 -0.374 0.000 0.972 2283 F HN 0.244 nan 8.300 nan 0.000 0.474 2284 F N 0.470 120.373 119.950 -0.079 0.000 2.120 2284 F HA -0.244 4.283 4.527 0.001 0.000 0.300 2284 F C 2.636 178.371 175.800 -0.108 0.000 1.095 2284 F CA 0.960 58.834 58.000 -0.210 0.000 1.249 2284 F CB -1.128 37.824 39.000 -0.082 0.000 0.995 2284 F HN 0.145 nan 8.300 nan 0.000 0.480 2285 A N 0.201 123.110 122.820 0.147 0.000 1.883 2285 A HA -0.222 4.099 4.320 0.001 0.000 0.217 2285 A C 2.056 179.673 177.584 0.054 0.000 1.186 2285 A CA 1.948 54.056 52.037 0.119 0.000 0.624 2285 A CB -0.798 18.242 19.000 0.066 0.000 0.822 2285 A HN 0.435 nan 8.150 nan 0.000 0.444 2286 E N -0.916 119.271 120.200 -0.022 0.000 2.051 2286 E HA -0.192 4.159 4.350 0.001 0.000 0.192 2286 E C 2.372 178.903 176.600 -0.115 0.000 0.991 2286 E CA 0.826 57.197 56.400 -0.048 0.000 0.799 2286 E CB -0.247 29.432 29.700 -0.036 0.000 0.748 2286 E HN 0.445 nan 8.360 nan 0.000 0.449 2287 R N 0.408 120.740 120.500 -0.279 0.000 2.112 2287 R HA -0.232 4.109 4.340 0.001 0.000 0.242 2287 R C 2.280 178.430 176.300 -0.251 0.000 1.137 2287 R CA 1.787 57.685 56.100 -0.337 0.000 0.944 2287 R CB -0.615 29.333 30.300 -0.587 0.000 0.857 2287 R HN 0.283 nan 8.270 nan 0.000 0.435 2288 Y N 1.808 121.875 120.300 -0.388 0.000 2.097 2288 Y HA -0.249 4.302 4.550 0.001 0.000 0.282 2288 Y C 2.409 178.178 175.900 -0.218 0.000 1.152 2288 Y CA 2.010 59.844 58.100 -0.443 0.000 1.136 2288 Y CB -0.118 37.982 38.460 -0.601 0.000 0.975 2288 Y HN 0.136 nan 8.280 nan 0.000 0.498 2289 E N -0.141 120.092 120.200 0.055 0.000 2.049 2289 E HA -0.228 4.123 4.350 0.001 0.000 0.198 2289 E C 2.133 178.704 176.600 -0.048 0.000 1.007 2289 E CA 1.891 58.311 56.400 0.034 0.000 0.809 2289 E CB -0.805 28.921 29.700 0.044 0.000 0.749 2289 E HN 0.556 nan 8.360 nan 0.000 0.450 2290 S N -0.434 115.234 115.700 -0.053 0.000 2.634 2290 S HA -0.012 4.458 4.470 0.001 0.000 0.221 2290 S C 0.410 174.966 174.600 -0.074 0.000 0.952 2290 S CA -0.607 57.556 58.200 -0.062 0.000 0.930 2290 S CB -0.426 62.743 63.200 -0.050 0.000 0.780 2290 S HN 0.301 nan 8.310 nan 0.000 0.498 2291 W N 4.787 125.916 121.300 -0.284 0.000 2.485 2291 W HA 0.217 4.878 4.660 0.001 0.000 0.315 2291 W C -0.583 175.797 176.519 -0.232 0.000 1.304 2291 W CA -0.436 56.735 57.345 -0.290 0.000 1.345 2291 W CB 0.368 29.552 29.460 -0.460 0.000 1.368 2291 W HN 0.447 nan 8.180 nan 0.000 0.497 2292 E N 2.885 122.740 120.200 -0.575 0.000 2.129 2292 E HA 0.050 4.401 4.350 0.001 0.000 0.283 2292 E C -0.387 175.925 176.600 -0.480 0.000 1.080 2292 E CA -0.392 55.761 56.400 -0.411 0.000 0.867 2292 E CB 0.242 29.740 29.700 -0.337 0.000 1.056 2292 E HN 0.401 nan 8.360 nan 0.000 0.404 2293 D N 3.230 123.531 120.400 -0.165 0.000 2.741 2293 D HA 0.025 4.665 4.640 0.001 0.000 0.233 2293 D C -0.055 176.212 176.300 -0.054 0.000 1.160 2293 D CA -0.487 53.512 54.000 -0.003 0.000 1.003 2293 D CB 0.528 41.389 40.800 0.101 0.000 1.064 2293 D HN 0.306 nan 8.370 nan 0.000 0.503 2294 D N 1.022 121.364 120.400 -0.097 0.000 2.078 2294 D HA -0.173 4.468 4.640 0.001 0.000 0.193 2294 D C 1.172 177.438 176.300 -0.057 0.000 0.990 2294 D CA 1.423 55.376 54.000 -0.078 0.000 0.827 2294 D CB 0.320 41.068 40.800 -0.086 0.000 0.975 2294 D HN 0.388 nan 8.370 nan 0.000 0.451 2295 Q N -0.663 119.112 119.800 -0.042 0.000 2.280 2295 Q HA 0.188 4.529 4.340 0.001 0.000 0.244 2295 Q C -0.286 175.643 176.000 -0.117 0.000 0.847 2295 Q CA 0.058 55.825 55.803 -0.059 0.000 0.945 2295 Q CB 1.948 30.670 28.738 -0.027 0.000 1.115 2295 Q HN -0.032 nan 8.270 nan 0.000 0.513 2296 V N 2.593 122.507 119.914 0.001 0.000 2.409 2296 V HA 0.417 4.538 4.120 0.001 0.000 0.291 2296 V C -2.437 173.717 176.094 0.099 0.000 1.020 2296 V CA -2.382 59.892 62.300 -0.044 0.000 0.848 2296 V CB 1.620 33.638 31.823 0.324 0.000 0.990 2296 V HN -0.043 nan 8.190 nan 0.000 0.430 2297 P HA 0.090 nan 4.420 nan 0.000 0.267 2297 P C -0.163 177.055 177.300 -0.138 0.000 1.200 2297 P CA -0.053 62.968 63.100 -0.132 0.000 0.772 2297 P CB 0.495 32.082 31.700 -0.189 0.000 0.855 2298 K N 2.285 122.541 120.400 -0.240 0.000 2.397 2298 K HA 0.344 4.665 4.320 0.001 0.000 0.265 2298 K C 0.065 176.392 176.600 -0.454 0.000 0.982 2298 K CA 0.689 56.571 56.287 -0.676 0.000 0.931 2298 K CB -0.047 31.718 32.500 -1.225 0.000 0.943 2298 K HN 0.496 nan 8.250 nan 0.000 0.501 2299 F N -2.553 117.029 119.950 -0.614 0.000 2.725 2299 F HA 0.281 4.808 4.527 0.001 0.000 0.309 2299 F C -0.161 175.455 175.800 -0.308 0.000 1.132 2299 F CA -0.910 56.924 58.000 -0.276 0.000 0.957 2299 F CB 0.758 39.603 39.000 -0.259 0.000 1.286 2299 F HN 0.504 nan 8.300 nan 0.000 0.440 2300 H N 0.130 119.083 119.070 -0.194 0.000 2.418 2300 H HA 0.293 4.850 4.556 0.001 0.000 0.300 2300 H C -0.960 173.898 175.328 -0.784 0.000 1.041 2300 H CA 1.339 56.961 56.048 -0.711 0.000 1.364 2300 H CB 0.172 29.130 29.762 -1.340 0.000 1.439 2300 H HN 0.522 nan 8.280 nan 0.000 0.540 2301 Y N -0.856 119.480 120.300 0.060 0.000 2.376 2301 Y HA 0.428 4.979 4.550 0.001 0.000 0.340 2301 Y C 1.118 177.130 175.900 0.187 0.000 0.965 2301 Y CA -0.913 57.199 58.100 0.021 0.000 1.078 2301 Y CB 1.858 40.105 38.460 -0.355 0.000 1.193 2301 Y HN 0.060 nan 8.280 nan 0.000 0.452 2302 G N 1.047 110.031 108.800 0.308 0.000 3.042 2302 G HA2 0.094 4.055 3.960 0.001 0.000 0.212 2302 G HA3 0.094 4.055 3.960 0.001 0.000 0.212 2302 G C 0.215 175.150 174.900 0.058 0.000 1.166 2302 G CA 0.237 45.312 45.100 -0.042 0.000 0.767 2302 G HN 0.526 nan 8.290 nan 0.000 0.546 2303 T N -0.480 114.232 114.554 0.264 0.000 2.950 2303 T HA 0.486 4.837 4.350 0.001 0.000 0.288 2303 T C -1.105 173.848 174.700 0.422 0.000 1.035 2303 T CA -0.479 61.808 62.100 0.312 0.000 1.028 2303 T CB 2.127 71.190 68.868 0.326 0.000 1.109 2303 T HN 0.140 nan 8.240 nan 0.000 0.514 2304 H N 0.329 119.549 119.070 0.249 0.000 2.737 2304 H HA 0.285 4.842 4.556 0.001 0.000 0.358 2304 H C -0.109 175.319 175.328 0.166 0.000 1.187 2304 H CA -0.621 55.461 56.048 0.058 0.000 1.221 2304 H CB 1.393 30.994 29.762 -0.268 0.000 1.799 2304 H HN 0.796 nan 8.280 nan 0.000 0.568 2305 Y N 0.102 120.293 120.300 -0.183 0.000 2.466 2305 Y HA 0.310 4.860 4.550 0.001 0.000 0.272 2305 Y C 0.381 176.520 175.900 0.398 0.000 1.169 2305 Y CA -0.334 57.838 58.100 0.121 0.000 1.285 2305 Y CB 0.263 38.650 38.460 -0.123 0.000 1.078 2305 Y HN 0.167 nan 8.280 nan 0.000 0.523 2306 S N 0.098 116.027 115.700 0.381 0.000 2.677 2306 S HA 0.678 5.148 4.470 0.001 0.000 0.283 2306 S C -1.033 173.472 174.600 -0.158 0.000 1.159 2306 S CA -0.251 58.094 58.200 0.241 0.000 1.001 2306 S CB 1.611 64.883 63.200 0.120 0.000 1.032 2306 S HN 0.249 nan 8.310 nan 0.000 0.487 2307 T N 3.054 117.390 114.554 -0.364 0.000 2.894 2307 T HA 0.625 4.976 4.350 0.001 0.000 0.309 2307 T C 1.083 175.525 174.700 -0.430 0.000 1.208 2307 T CA 0.084 61.770 62.100 -0.689 0.000 1.016 2307 T CB 1.553 69.516 68.868 -1.509 0.000 1.192 2307 T HN 0.777 nan 8.240 nan 0.000 0.491 2308 A N 1.506 124.118 122.820 -0.348 0.000 1.902 2308 A HA -0.029 4.292 4.320 0.001 0.000 0.217 2308 A C 2.369 179.855 177.584 -0.164 0.000 1.181 2308 A CA 2.386 54.297 52.037 -0.210 0.000 0.623 2308 A CB -0.898 17.988 19.000 -0.189 0.000 0.818 2308 A HN 0.717 nan 8.150 nan 0.000 0.443 2309 S N -0.554 114.993 115.700 -0.255 0.000 2.374 2309 S HA -0.165 4.306 4.470 0.001 0.000 0.227 2309 S C 1.628 176.264 174.600 0.060 0.000 1.037 2309 S CA 1.589 59.722 58.200 -0.112 0.000 1.024 2309 S CB -0.651 62.435 63.200 -0.190 0.000 0.861 2309 S HN 0.647 nan 8.310 nan 0.000 0.456 2310 F N 0.788 120.668 119.950 -0.116 0.000 2.146 2310 F HA -0.104 4.423 4.527 0.001 0.000 0.298 2310 F C 2.424 178.107 175.800 -0.196 0.000 1.096 2310 F CA 0.320 58.166 58.000 -0.258 0.000 1.275 2310 F CB -0.481 38.425 39.000 -0.156 0.000 1.008 2310 F HN 0.058 nan 8.300 nan 0.000 0.480 2311 V N 0.967 120.962 119.914 0.134 0.000 2.261 2311 V HA -0.300 3.820 4.120 0.001 0.000 0.246 2311 V C 2.289 178.401 176.094 0.029 0.000 1.047 2311 V CA 1.585 63.898 62.300 0.022 0.000 1.015 2311 V CB -0.679 30.947 31.823 -0.330 0.000 0.642 2311 V HN 0.329 nan 8.190 nan 0.000 0.446 2312 L N 0.076 121.370 121.223 0.117 0.000 2.131 2312 L HA -0.148 4.193 4.340 0.001 0.000 0.210 2312 L C 2.689 179.666 176.870 0.177 0.000 1.092 2312 L CA 1.487 56.486 54.840 0.265 0.000 0.759 2312 L CB -0.830 41.489 42.059 0.434 0.000 0.903 2312 L HN 0.382 nan 8.230 nan 0.000 0.435 2313 A N -0.615 122.270 122.820 0.109 0.000 1.929 2313 A HA -0.189 4.131 4.320 0.001 0.000 0.216 2313 A C 1.960 179.528 177.584 -0.026 0.000 1.176 2313 A CA 1.015 53.026 52.037 -0.043 0.000 0.628 2313 A CB -0.748 18.191 19.000 -0.102 0.000 0.816 2313 A HN 0.492 nan 8.150 nan 0.000 0.444 2314 W N -0.137 121.119 121.300 -0.075 0.000 2.379 2314 W HA 0.026 4.687 4.660 0.001 0.000 0.307 2314 W C 1.326 177.796 176.519 -0.081 0.000 1.200 2314 W CA 0.466 57.712 57.345 -0.165 0.000 1.297 2314 W CB -0.132 29.229 29.460 -0.165 0.000 1.140 2314 W HN 0.119 nan 8.180 nan 0.000 0.507 2315 L N 0.760 122.024 121.223 0.069 0.000 2.728 2315 L HA 0.095 4.435 4.340 0.001 0.000 0.235 2315 L C 1.869 178.744 176.870 0.009 0.000 1.197 2315 L CA -0.332 54.439 54.840 -0.116 0.000 0.992 2315 L CB -0.635 41.091 42.059 -0.555 0.000 1.263 2315 L HN 0.148 nan 8.230 nan 0.000 0.484 2316 L N 0.481 121.733 121.223 0.048 0.000 2.034 2316 L HA -0.292 4.049 4.340 0.001 0.000 0.217 2316 L C 2.464 179.425 176.870 0.153 0.000 1.077 2316 L CA 1.797 56.650 54.840 0.023 0.000 0.769 2316 L CB -0.056 41.925 42.059 -0.130 0.000 0.890 2316 L HN 0.406 nan 8.230 nan 0.000 0.435 2317 R N -0.472 120.098 120.500 0.117 0.000 2.357 2317 R HA 0.103 4.443 4.340 0.001 0.000 0.202 2317 R C -0.153 176.256 176.300 0.183 0.000 1.047 2317 R CA 0.293 56.496 56.100 0.172 0.000 1.034 2317 R CB -0.222 30.076 30.300 -0.004 0.000 0.875 2317 R HN 0.377 nan 8.270 nan 0.000 0.473 2318 I N 0.599 121.285 120.570 0.193 0.000 2.509 2318 I HA 0.174 4.344 4.170 0.001 0.000 0.293 2318 I C 0.144 176.399 176.117 0.230 0.000 1.020 2318 I CA -1.064 60.349 61.300 0.189 0.000 1.088 2318 I CB 2.074 40.164 38.000 0.149 0.000 1.267 2318 I HN -0.134 nan 8.210 nan 0.000 0.430 2319 E N 6.621 126.893 120.200 0.119 0.000 2.390 2319 E HA 0.152 4.502 4.350 0.001 0.000 0.261 2319 E C -1.673 174.756 176.600 -0.285 0.000 1.076 2319 E CA -1.462 54.868 56.400 -0.117 0.000 0.905 2319 E CB 0.936 30.613 29.700 -0.040 0.000 0.984 2319 E HN 0.381 nan 8.360 nan 0.000 0.427 2320 P HA 0.020 nan 4.420 nan 0.000 0.249 2320 P C 0.997 177.480 177.300 -1.363 0.000 1.229 2320 P CA 0.382 62.587 63.100 -1.492 0.000 0.788 2320 P CB 0.076 30.518 31.700 -2.097 0.000 1.072 2321 F N 1.123 120.687 119.950 -0.643 0.000 2.154 2321 F HA -0.186 4.342 4.527 0.001 0.000 0.301 2321 F C 2.428 178.165 175.800 -0.105 0.000 1.087 2321 F CA 1.782 59.611 58.000 -0.284 0.000 1.274 2321 F CB -1.893 37.085 39.000 -0.037 0.000 1.009 2321 F HN -0.058 nan 8.300 nan 0.000 0.485 2322 T N -1.139 113.453 114.554 0.062 0.000 2.684 2322 T HA -0.197 4.154 4.350 0.001 0.000 0.267 2322 T C 2.013 176.726 174.700 0.021 0.000 1.036 2322 T CA 2.033 64.192 62.100 0.099 0.000 1.148 2322 T CB -0.685 68.236 68.868 0.088 0.000 0.863 2322 T HN 0.268 nan 8.240 nan 0.000 0.436 2323 T N 0.984 115.460 114.554 -0.130 0.000 2.788 2323 T HA -0.063 4.288 4.350 0.001 0.000 0.268 2323 T C 1.646 176.385 174.700 0.065 0.000 1.044 2323 T CA 1.107 63.162 62.100 -0.074 0.000 1.139 2323 T CB -0.529 68.278 68.868 -0.102 0.000 0.867 2323 T HN 0.561 nan 8.240 nan 0.000 0.454 2324 Y N -0.396 119.888 120.300 -0.026 0.000 2.181 2324 Y HA -0.125 4.426 4.550 0.001 0.000 0.288 2324 Y C 2.265 178.187 175.900 0.037 0.000 1.146 2324 Y CA 0.603 58.699 58.100 -0.006 0.000 1.164 2324 Y CB -0.317 38.143 38.460 -0.001 0.000 0.982 2324 Y HN 0.158 nan 8.280 nan 0.000 0.515 2325 F N 0.356 120.390 119.950 0.139 0.000 2.084 2325 F HA -0.231 4.297 4.527 0.001 0.000 0.296 2325 F C 1.905 177.693 175.800 -0.020 0.000 1.111 2325 F CA 1.155 59.199 58.000 0.072 0.000 1.224 2325 F CB -0.467 38.595 39.000 0.104 0.000 0.991 2325 F HN -0.131 nan 8.300 nan 0.000 0.471 2326 L N 0.948 122.226 121.223 0.091 0.000 2.012 2326 L HA -0.292 4.049 4.340 0.001 0.000 0.210 2326 L C 2.380 179.161 176.870 -0.148 0.000 1.073 2326 L CA 1.886 56.653 54.840 -0.122 0.000 0.748 2326 L CB -1.741 40.182 42.059 -0.226 0.000 0.891 2326 L HN 0.337 nan 8.230 nan 0.000 0.431 2327 N N 0.267 118.919 118.700 -0.079 0.000 2.025 2327 N HA -0.212 4.528 4.740 0.001 0.000 0.194 2327 N C 1.943 177.383 175.510 -0.118 0.000 1.044 2327 N CA 1.733 54.741 53.050 -0.069 0.000 0.851 2327 N CB -0.119 38.366 38.487 -0.004 0.000 1.036 2327 N HN 0.329 nan 8.380 nan 0.000 0.422 2328 L N 0.509 121.640 121.223 -0.154 0.000 2.141 2328 L HA -0.139 4.202 4.340 0.001 0.000 0.209 2328 L C 2.715 179.431 176.870 -0.257 0.000 1.094 2328 L CA 0.883 55.605 54.840 -0.196 0.000 0.763 2328 L CB -0.382 41.548 42.059 -0.215 0.000 0.908 2328 L HN 0.289 nan 8.230 nan 0.000 0.437 2329 Q N 0.275 119.853 119.800 -0.369 0.000 2.079 2329 Q HA -0.081 4.260 4.340 0.001 0.000 0.200 2329 Q C 1.400 177.290 176.000 -0.184 0.000 0.974 2329 Q CA 1.813 57.403 55.803 -0.355 0.000 0.840 2329 Q CB 0.157 28.612 28.738 -0.471 0.000 0.898 2329 Q HN 0.419 nan 8.270 nan 0.000 0.430 2330 G N -3.563 105.144 108.800 -0.155 0.000 2.507 2330 G HA2 0.157 4.118 3.960 0.001 0.000 0.205 2330 G HA3 0.157 4.118 3.960 0.001 0.000 0.205 2330 G C 0.654 175.497 174.900 -0.095 0.000 0.996 2330 G CA 0.119 45.158 45.100 -0.102 0.000 0.776 2330 G HN 0.994 nan 8.290 nan 0.000 0.532 2331 G N -0.776 107.949 108.800 -0.125 0.000 2.313 2331 G HA2 -0.132 3.828 3.960 0.001 0.000 0.215 2331 G HA3 -0.132 3.828 3.960 0.001 0.000 0.215 2331 G C 0.255 175.043 174.900 -0.187 0.000 1.023 2331 G CA 0.759 45.781 45.100 -0.132 0.000 0.626 2331 G HN 0.848 nan 8.290 nan 0.000 0.503 2332 K N 0.237 120.547 120.400 -0.149 0.000 2.221 2332 K HA 0.781 5.101 4.320 0.001 0.000 0.243 2332 K C 0.165 176.701 176.600 -0.107 0.000 0.968 2332 K CA -0.842 55.355 56.287 -0.149 0.000 0.846 2332 K CB 0.686 33.178 32.500 -0.013 0.000 1.141 2332 K HN 0.062 nan 8.250 nan 0.000 0.434 2333 F N 0.338 120.361 119.950 0.121 0.000 2.444 2333 F HA 0.042 4.570 4.527 0.001 0.000 0.297 2333 F C 1.171 177.120 175.800 0.247 0.000 1.295 2333 F CA 0.134 58.268 58.000 0.222 0.000 1.286 2333 F CB 0.226 39.280 39.000 0.090 0.000 1.298 2333 F HN 0.512 nan 8.300 nan 0.000 0.531 2334 D N -1.745 118.988 120.400 0.554 0.000 2.388 2334 D HA 0.109 4.750 4.640 0.001 0.000 0.254 2334 D C -0.897 175.576 176.300 0.289 0.000 1.111 2334 D CA -0.466 53.765 54.000 0.385 0.000 0.993 2334 D CB 0.449 41.514 40.800 0.441 0.000 1.118 2334 D HN 0.411 nan 8.370 nan 0.000 0.502 2335 H N 0.897 120.051 119.070 0.140 0.000 3.107 2335 H HA 0.234 4.790 4.556 0.001 0.000 0.301 2335 H C 1.016 176.387 175.328 0.072 0.000 0.981 2335 H CA 0.465 56.568 56.048 0.091 0.000 1.443 2335 H CB 0.630 30.433 29.762 0.069 0.000 1.479 2335 H HN 0.420 nan 8.280 nan 0.000 0.564 2336 A N 4.294 126.978 122.820 -0.226 0.000 2.009 2336 A HA -0.251 4.070 4.320 0.001 0.000 0.222 2336 A C 1.929 179.346 177.584 -0.278 0.000 1.175 2336 A CA 2.076 53.971 52.037 -0.237 0.000 0.651 2336 A CB -0.257 18.619 19.000 -0.205 0.000 0.815 2336 A HN 0.882 nan 8.150 nan 0.000 0.459 2337 D N -1.500 118.603 120.400 -0.494 0.000 2.363 2337 D HA 0.033 4.674 4.640 0.001 0.000 0.226 2337 D C 1.593 177.850 176.300 -0.071 0.000 1.020 2337 D CA 0.491 54.347 54.000 -0.240 0.000 0.892 2337 D CB 0.060 40.734 40.800 -0.209 0.000 0.900 2337 D HN 0.583 nan 8.370 nan 0.000 0.531 2338 R N -0.520 119.959 120.500 -0.034 0.000 2.513 2338 R HA 0.058 4.399 4.340 0.001 0.000 0.245 2338 R C 0.768 177.096 176.300 0.047 0.000 0.908 2338 R CA 0.057 56.183 56.100 0.044 0.000 1.023 2338 R CB 0.617 30.985 30.300 0.113 0.000 1.338 2338 R HN 0.028 nan 8.270 nan 0.000 0.575 2339 T N -0.487 114.082 114.554 0.024 0.000 2.907 2339 T HA 0.129 4.480 4.350 0.001 0.000 0.298 2339 T C 0.050 174.782 174.700 0.054 0.000 1.017 2339 T CA -0.584 61.523 62.100 0.011 0.000 1.118 2339 T CB 0.769 69.605 68.868 -0.053 0.000 0.948 2339 T HN 0.003 nan 8.240 nan 0.000 0.531 2340 F N 3.835 123.720 119.950 -0.108 0.000 2.539 2340 F HA 0.273 4.801 4.527 0.001 0.000 0.393 2340 F C 1.145 176.924 175.800 -0.035 0.000 1.032 2340 F CA -0.219 57.750 58.000 -0.052 0.000 1.120 2340 F CB -0.170 38.822 39.000 -0.014 0.000 1.014 2340 F HN 0.810 nan 8.300 nan 0.000 0.546 2341 S N 2.254 117.902 115.700 -0.087 0.000 2.651 2341 S HA 0.248 4.718 4.470 0.001 0.000 0.259 2341 S C 0.204 174.658 174.600 -0.243 0.000 1.073 2341 S CA 0.256 58.297 58.200 -0.265 0.000 1.090 2341 S CB -0.088 63.028 63.200 -0.141 0.000 1.042 2341 S HN 0.637 nan 8.310 nan 0.000 0.581 2342 S N -0.065 115.609 115.700 -0.044 0.000 2.572 2342 S HA 0.613 5.083 4.470 0.001 0.000 0.274 2342 S C 0.399 175.140 174.600 0.236 0.000 1.150 2342 S CA -0.757 57.447 58.200 0.006 0.000 0.944 2342 S CB 0.965 64.165 63.200 0.001 0.000 1.071 2342 S HN 0.296 nan 8.310 nan 0.000 0.479 2343 I N 3.233 123.884 120.570 0.136 0.000 2.202 2343 I HA -0.087 4.084 4.170 0.001 0.000 0.242 2343 I C 2.668 178.819 176.117 0.057 0.000 1.091 2343 I CA 1.291 62.712 61.300 0.202 0.000 1.368 2343 I CB -0.370 37.523 38.000 -0.177 0.000 1.058 2343 I HN 0.717 nan 8.210 nan 0.000 0.410 2344 S N 0.398 116.082 115.700 -0.027 0.000 2.374 2344 S HA -0.264 4.207 4.470 0.001 0.000 0.227 2344 S C 2.207 176.898 174.600 0.153 0.000 1.037 2344 S CA 1.738 59.991 58.200 0.088 0.000 1.024 2344 S CB -0.193 63.075 63.200 0.114 0.000 0.861 2344 S HN 0.244 nan 8.310 nan 0.000 0.456 2345 R N 0.589 121.162 120.500 0.121 0.000 2.073 2345 R HA 0.090 4.430 4.340 0.001 0.000 0.234 2345 R C 2.558 178.932 176.300 0.123 0.000 1.134 2345 R CA 1.441 57.604 56.100 0.104 0.000 0.952 2345 R CB -0.740 29.609 30.300 0.083 0.000 0.850 2345 R HN 0.459 nan 8.270 nan 0.000 0.433 2346 A N 0.425 123.383 122.820 0.230 0.000 1.940 2346 A HA -0.226 4.095 4.320 0.001 0.000 0.219 2346 A C 2.026 179.757 177.584 0.245 0.000 1.176 2346 A CA 1.467 53.667 52.037 0.273 0.000 0.631 2346 A CB -1.071 18.225 19.000 0.493 0.000 0.814 2346 A HN 0.722 nan 8.150 nan 0.000 0.446 2347 W N 0.622 121.924 121.300 0.002 0.000 2.379 2347 W HA -0.156 4.505 4.660 0.001 0.000 0.307 2347 W C 2.271 178.653 176.519 -0.229 0.000 1.200 2347 W CA 1.594 58.704 57.345 -0.392 0.000 1.297 2347 W CB -0.347 28.846 29.460 -0.445 0.000 1.140 2347 W HN 0.374 nan 8.180 nan 0.000 0.507 2348 R N 0.847 121.245 120.500 -0.172 0.000 2.091 2348 R HA -0.203 4.137 4.340 0.001 0.000 0.238 2348 R C 1.882 178.026 176.300 -0.260 0.000 1.136 2348 R CA 2.140 58.098 56.100 -0.237 0.000 0.959 2348 R CB -0.525 29.763 30.300 -0.019 0.000 0.856 2348 R HN 0.114 nan 8.270 nan 0.000 0.437 2349 N N 0.005 118.608 118.700 -0.161 0.000 2.309 2349 N HA -0.119 4.621 4.740 0.001 0.000 0.182 2349 N C 1.599 177.001 175.510 -0.180 0.000 1.018 2349 N CA 1.571 54.544 53.050 -0.128 0.000 0.876 2349 N CB -0.129 38.320 38.487 -0.064 0.000 0.972 2349 N HN 0.327 nan 8.380 nan 0.000 0.434 2350 S N -0.248 115.284 115.700 -0.280 0.000 2.561 2350 S HA 0.060 4.530 4.470 0.001 0.000 0.225 2350 S C 1.526 175.873 174.600 -0.422 0.000 0.977 2350 S CA 0.430 58.453 58.200 -0.295 0.000 0.926 2350 S CB 0.208 63.239 63.200 -0.282 0.000 0.769 2350 S HN 0.128 nan 8.310 nan 0.000 0.533 2351 Q N 1.238 120.729 119.800 -0.516 0.000 2.287 2351 Q HA 0.168 4.509 4.340 0.001 0.000 0.201 2351 Q C 2.409 178.288 176.000 -0.202 0.000 0.946 2351 Q CA 0.806 56.342 55.803 -0.445 0.000 0.868 2351 Q CB -0.164 28.225 28.738 -0.583 0.000 0.967 2351 Q HN 0.684 nan 8.270 nan 0.000 0.516 2352 R N 0.690 121.088 120.500 -0.169 0.000 2.074 2352 R HA 0.077 4.417 4.340 0.001 0.000 0.218 2352 R C 0.557 176.816 176.300 -0.068 0.000 1.137 2352 R CA 0.229 56.267 56.100 -0.103 0.000 0.998 2352 R CB -1.160 29.083 30.300 -0.095 0.000 0.895 2352 R HN 0.031 nan 8.270 nan 0.000 0.442 2353 D N 2.126 122.495 120.400 -0.052 0.000 2.451 2353 D HA -0.033 4.608 4.640 0.001 0.000 0.254 2353 D C 0.328 176.670 176.300 0.070 0.000 1.204 2353 D CA 0.518 54.512 54.000 -0.010 0.000 0.896 2353 D CB 1.196 41.994 40.800 -0.003 0.000 1.136 2353 D HN 0.023 nan 8.370 nan 0.000 0.499 2354 T N 2.216 116.803 114.554 0.056 0.000 2.929 2354 T HA -0.097 4.254 4.350 0.001 0.000 0.271 2354 T C 1.304 176.234 174.700 0.382 0.000 1.085 2354 T CA 1.150 63.365 62.100 0.192 0.000 1.125 2354 T CB 0.123 68.965 68.868 -0.043 0.000 0.874 2354 T HN 0.312 nan 8.240 nan 0.000 0.494 2355 S N 0.621 116.463 115.700 0.237 0.000 2.572 2355 S HA 0.184 4.654 4.470 0.001 0.000 0.228 2355 S C -0.094 174.629 174.600 0.206 0.000 0.963 2355 S CA -0.408 57.938 58.200 0.244 0.000 0.939 2355 S CB 0.292 63.599 63.200 0.178 0.000 0.804 2355 S HN 0.361 nan 8.310 nan 0.000 0.480 2356 D N 1.555 122.057 120.400 0.170 0.000 2.402 2356 D HA 0.373 5.013 4.640 0.001 0.000 0.252 2356 D C -0.519 175.816 176.300 0.058 0.000 1.294 2356 D CA -0.548 53.497 54.000 0.075 0.000 0.948 2356 D CB 0.553 41.346 40.800 -0.012 0.000 1.202 2356 D HN 0.118 nan 8.370 nan 0.000 0.561 2357 I N 1.230 121.840 120.570 0.067 0.000 3.241 2357 I HA 0.288 4.458 4.170 0.001 0.000 0.333 2357 I C 0.203 176.392 176.117 0.119 0.000 1.534 2357 I CA -0.988 60.326 61.300 0.024 0.000 0.979 2357 I CB -0.042 37.860 38.000 -0.164 0.000 1.497 2357 I HN 0.124 nan 8.210 nan 0.000 0.530 2358 K N 1.767 122.235 120.400 0.114 0.000 2.326 2358 K HA 0.239 4.560 4.320 0.001 0.000 0.275 2358 K C -0.380 176.486 176.600 0.443 0.000 1.018 2358 K CA 0.051 56.455 56.287 0.194 0.000 0.962 2358 K CB 1.186 33.492 32.500 -0.322 0.000 0.953 2358 K HN 0.272 nan 8.250 nan 0.000 0.475 2359 E N 2.062 122.514 120.200 0.421 0.000 2.561 2359 E HA 0.197 4.548 4.350 0.001 0.000 0.254 2359 E C 0.159 176.771 176.600 0.019 0.000 1.213 2359 E CA -0.742 55.855 56.400 0.328 0.000 0.995 2359 E CB 0.494 30.399 29.700 0.341 0.000 1.233 2359 E HN 0.410 nan 8.360 nan 0.000 0.556 2360 L N 0.383 121.421 121.223 -0.307 0.000 2.567 2360 L HA 0.352 4.693 4.340 0.001 0.000 0.238 2360 L C 0.105 176.857 176.870 -0.196 0.000 1.168 2360 L CA -0.310 54.154 54.840 -0.628 0.000 0.817 2360 L CB 0.243 41.745 42.059 -0.927 0.000 1.409 2360 L HN 0.400 nan 8.230 nan 0.000 0.502 2361 I N 0.059 120.406 120.570 -0.372 0.000 2.646 2361 I HA 0.406 4.577 4.170 0.001 0.000 0.299 2361 I C -1.760 174.290 176.117 -0.111 0.000 1.036 2361 I CA -2.031 59.228 61.300 -0.067 0.000 1.074 2361 I CB 2.020 39.976 38.000 -0.074 0.000 1.258 2361 I HN 0.400 nan 8.210 nan 0.000 0.430 2362 P HA -0.189 nan 4.420 nan 0.000 0.216 2362 P C 0.853 178.181 177.300 0.045 0.000 1.154 2362 P CA 1.379 64.186 63.100 -0.488 0.000 0.865 2362 P CB 0.250 31.829 31.700 -0.201 0.000 0.789 2363 E N -1.665 118.521 120.200 -0.024 0.000 2.219 2363 E HA -0.180 4.171 4.350 0.001 0.000 0.198 2363 E C 1.598 177.988 176.600 -0.350 0.000 0.998 2363 E CA 0.955 57.097 56.400 -0.430 0.000 0.818 2363 E CB -1.119 28.382 29.700 -0.331 0.000 0.741 2363 E HN 0.267 nan 8.360 nan 0.000 0.477 2364 F N -0.915 118.800 119.950 -0.393 0.000 2.307 2364 F HA -0.159 4.368 4.527 0.001 0.000 0.301 2364 F C 1.029 176.492 175.800 -0.563 0.000 1.076 2364 F CA 1.071 58.818 58.000 -0.421 0.000 1.383 2364 F CB -0.076 38.505 39.000 -0.699 0.000 1.055 2364 F HN 0.127 nan 8.300 nan 0.000 0.526 2365 Y N -2.289 118.036 120.300 0.042 0.000 2.524 2365 Y HA 0.056 4.606 4.550 0.001 0.000 0.266 2365 Y C 0.545 176.466 175.900 0.034 0.000 1.180 2365 Y CA -0.062 58.070 58.100 0.053 0.000 1.244 2365 Y CB -0.335 38.249 38.460 0.206 0.000 1.125 2365 Y HN 0.255 nan 8.280 nan 0.000 0.524 2366 Y N -3.950 116.346 120.300 -0.006 0.000 2.841 2366 Y HA 0.287 4.838 4.550 0.001 0.000 0.316 2366 Y C -1.091 174.800 175.900 -0.016 0.000 0.914 2366 Y CA -1.155 56.910 58.100 -0.058 0.000 1.052 2366 Y CB -0.176 38.185 38.460 -0.165 0.000 1.439 2366 Y HN -0.103 nan 8.280 nan 0.000 0.574 2367 L N 5.648 126.512 121.223 -0.599 0.000 2.371 2367 L HA 0.617 4.958 4.340 0.001 0.000 0.262 2367 L C -1.883 174.890 176.870 -0.161 0.000 1.054 2367 L CA -2.091 52.501 54.840 -0.413 0.000 0.924 2367 L CB 1.146 42.815 42.059 -0.651 0.000 1.295 2367 L HN -0.107 nan 8.230 nan 0.000 0.441 2368 P HA -0.158 nan 4.420 nan 0.000 0.220 2368 P C 0.699 178.040 177.300 0.068 0.000 1.148 2368 P CA 1.113 64.298 63.100 0.141 0.000 0.803 2368 P CB 0.509 32.250 31.700 0.069 0.000 0.782 2369 E N 0.653 120.798 120.200 -0.091 0.000 2.219 2369 E HA -0.183 4.168 4.350 0.001 0.000 0.198 2369 E C 2.192 178.680 176.600 -0.186 0.000 0.998 2369 E CA 1.459 57.765 56.400 -0.157 0.000 0.818 2369 E CB -1.100 28.488 29.700 -0.187 0.000 0.741 2369 E HN 0.447 nan 8.360 nan 0.000 0.477 2370 M N -1.356 118.048 119.600 -0.327 0.000 2.460 2370 M HA -0.012 4.469 4.480 0.001 0.000 0.263 2370 M C 0.795 176.751 176.300 -0.574 0.000 1.071 2370 M CA 1.437 56.450 55.300 -0.479 0.000 1.096 2370 M CB -0.102 32.083 32.600 -0.693 0.000 1.408 2370 M HN -0.023 nan 8.290 nan 0.000 0.463 2371 F N 0.877 120.742 119.950 -0.141 0.000 2.727 2371 F HA 0.330 4.857 4.527 0.001 0.000 0.302 2371 F C 0.066 175.753 175.800 -0.189 0.000 1.097 2371 F CA -0.504 57.374 58.000 -0.204 0.000 1.330 2371 F CB 0.327 39.189 39.000 -0.231 0.000 1.084 2371 F HN -0.126 nan 8.300 nan 0.000 0.578 2372 V N 0.300 120.199 119.914 -0.025 0.000 2.495 2372 V HA 0.197 4.317 4.120 0.001 0.000 0.298 2372 V C 0.060 176.146 176.094 -0.013 0.000 1.031 2372 V CA -0.977 61.324 62.300 0.001 0.000 0.871 2372 V CB 1.682 33.544 31.823 0.065 0.000 0.988 2372 V HN 0.001 nan 8.190 nan 0.000 0.432 2373 N N 2.734 121.409 118.700 -0.043 0.000 2.652 2373 N HA 0.074 4.815 4.740 0.001 0.000 0.259 2373 N C 0.972 176.410 175.510 -0.119 0.000 1.240 2373 N CA -0.086 52.896 53.050 -0.114 0.000 0.951 2373 N CB -0.590 37.819 38.487 -0.131 0.000 1.281 2373 N HN 0.622 nan 8.380 nan 0.000 0.507 2374 F N 0.498 120.320 119.950 -0.213 0.000 2.257 2374 F HA -0.160 4.367 4.527 0.001 0.000 0.302 2374 F C 1.378 177.031 175.800 -0.244 0.000 1.056 2374 F CA 1.182 59.072 58.000 -0.184 0.000 1.353 2374 F CB 0.100 39.020 39.000 -0.132 0.000 1.064 2374 F HN 0.334 nan 8.300 nan 0.000 0.520 2375 N N 0.479 118.974 118.700 -0.341 0.000 2.268 2375 N HA -0.031 4.710 4.740 0.001 0.000 0.204 2375 N C -0.415 174.820 175.510 -0.459 0.000 1.124 2375 N CA 0.230 52.981 53.050 -0.497 0.000 0.838 2375 N CB -0.419 37.545 38.487 -0.871 0.000 0.994 2375 N HN 0.236 nan 8.380 nan 0.000 0.489 2376 N N 0.982 119.481 118.700 -0.334 0.000 2.699 2376 N HA -0.238 4.503 4.740 0.001 0.000 0.256 2376 N C -0.680 174.816 175.510 -0.023 0.000 0.993 2376 N CA 0.791 53.741 53.050 -0.166 0.000 0.759 2376 N CB -1.704 36.711 38.487 -0.120 0.000 0.906 2376 N HN 0.518 nan 8.380 nan 0.000 0.541 2377 Y N 0.150 120.416 120.300 -0.058 0.000 2.314 2377 Y HA -0.043 4.508 4.550 0.001 0.000 0.334 2377 Y C 2.041 177.861 175.900 -0.132 0.000 1.266 2377 Y CA -0.669 57.392 58.100 -0.066 0.000 1.391 2377 Y CB 0.561 38.920 38.460 -0.168 0.000 1.306 2377 Y HN 0.134 nan 8.280 nan 0.000 0.558 2378 N N 0.967 119.715 118.700 0.081 0.000 2.030 2378 N HA -0.205 4.535 4.740 0.001 0.000 0.194 2378 N C 0.863 176.282 175.510 -0.152 0.000 1.074 2378 N CA 2.471 55.521 53.050 0.000 0.000 0.860 2378 N CB -0.277 38.270 38.487 0.100 0.000 1.055 2378 N HN 0.811 nan 8.380 nan 0.000 0.429 2379 L N -3.259 117.755 121.223 -0.349 0.000 4.342 2379 L HA -0.256 4.085 4.340 0.001 0.000 0.395 2379 L C 1.091 177.865 176.870 -0.159 0.000 0.764 2379 L CA 0.514 55.117 54.840 -0.395 0.000 2.417 2379 L CB -2.169 39.681 42.059 -0.348 0.000 1.210 2379 L HN 0.709 nan 8.230 nan 0.000 0.626 2380 G N -0.834 107.918 108.800 -0.079 0.000 2.553 2380 G HA2 -0.127 3.834 3.960 0.001 0.000 0.242 2380 G HA3 -0.127 3.834 3.960 0.001 0.000 0.242 2380 G C -0.548 174.320 174.900 -0.052 0.000 1.277 2380 G CA -0.178 44.902 45.100 -0.033 0.000 0.910 2380 G HN 0.632 nan 8.290 nan 0.000 0.576 2381 V N 0.461 120.349 119.914 -0.043 0.000 2.777 2381 V HA 0.574 4.694 4.120 0.001 0.000 0.306 2381 V C 0.617 176.669 176.094 -0.071 0.000 1.112 2381 V CA -0.473 61.796 62.300 -0.052 0.000 0.917 2381 V CB 1.776 33.583 31.823 -0.026 0.000 1.018 2381 V HN 0.852 nan 8.190 nan 0.000 0.426 2382 M N 2.124 121.670 119.600 -0.090 0.000 2.207 2382 M HA 0.214 4.694 4.480 0.001 0.000 0.311 2382 M C 1.034 177.304 176.300 -0.050 0.000 1.127 2382 M CA -0.137 55.096 55.300 -0.111 0.000 1.181 2382 M CB 0.265 32.808 32.600 -0.096 0.000 1.409 2382 M HN 0.616 nan 8.290 nan 0.000 0.461 2383 D N 0.712 121.095 120.400 -0.027 0.000 2.149 2383 D HA -0.178 4.462 4.640 0.001 0.000 0.198 2383 D C 1.234 177.536 176.300 0.005 0.000 0.990 2383 D CA 1.393 55.406 54.000 0.022 0.000 0.839 2383 D CB -0.277 40.555 40.800 0.053 0.000 0.948 2383 D HN 0.594 nan 8.370 nan 0.000 0.460 2384 D N -0.116 120.278 120.400 -0.010 0.000 2.271 2384 D HA -0.137 4.504 4.640 0.001 0.000 0.207 2384 D C 1.541 177.833 176.300 -0.014 0.000 0.983 2384 D CA 1.488 55.481 54.000 -0.012 0.000 0.878 2384 D CB 0.195 40.983 40.800 -0.021 0.000 0.920 2384 D HN 0.388 nan 8.370 nan 0.000 0.479 2385 G N 0.297 109.086 108.800 -0.017 0.000 2.175 2385 G HA2 -0.248 3.713 3.960 0.001 0.000 0.244 2385 G HA3 -0.248 3.713 3.960 0.001 0.000 0.244 2385 G C 0.425 175.309 174.900 -0.027 0.000 0.982 2385 G CA 0.438 45.528 45.100 -0.016 0.000 0.641 2385 G HN 0.290 nan 8.290 nan 0.000 0.527 2386 T N 1.483 116.015 114.554 -0.037 0.000 2.814 2386 T HA 0.485 4.835 4.350 0.001 0.000 0.297 2386 T C 0.796 175.461 174.700 -0.057 0.000 0.956 2386 T CA -0.224 61.849 62.100 -0.046 0.000 1.123 2386 T CB 2.381 71.219 68.868 -0.050 0.000 0.902 2386 T HN 0.472 nan 8.240 nan 0.000 0.528 2387 V N 4.153 124.033 119.914 -0.057 0.000 2.637 2387 V HA 0.140 4.261 4.120 0.001 0.000 0.296 2387 V C 0.353 176.396 176.094 -0.085 0.000 1.046 2387 V CA -0.336 61.926 62.300 -0.064 0.000 1.066 2387 V CB 0.969 32.758 31.823 -0.056 0.000 0.968 2387 V HN 0.688 nan 8.190 nan 0.000 0.483 2388 V N 4.685 124.540 119.914 -0.098 0.000 2.357 2388 V HA 0.562 4.683 4.120 0.001 0.000 0.284 2388 V C 0.272 176.284 176.094 -0.137 0.000 1.018 2388 V CA 0.355 62.579 62.300 -0.127 0.000 0.841 2388 V CB 1.120 32.857 31.823 -0.142 0.000 0.991 2388 V HN 1.023 nan 8.190 nan 0.000 0.437 2389 S N 2.568 118.183 115.700 -0.142 0.000 4.569 2389 S HA 0.244 4.714 4.470 0.001 0.000 0.161 2389 S C -0.353 174.156 174.600 -0.153 0.000 1.104 2389 S CA -0.204 57.914 58.200 -0.136 0.000 1.153 2389 S CB 0.204 63.339 63.200 -0.109 0.000 2.018 2389 S HN 0.744 nan 8.310 nan 0.000 0.800 2390 D N 1.968 122.288 120.400 -0.132 0.000 2.368 2390 D HA 0.294 4.935 4.640 0.001 0.000 0.240 2390 D C -0.436 175.747 176.300 -0.196 0.000 1.169 2390 D CA 0.200 54.119 54.000 -0.134 0.000 0.906 2390 D CB 0.674 41.415 40.800 -0.099 0.000 1.187 2390 D HN 0.159 nan 8.370 nan 0.000 0.435 2391 V N 1.896 121.671 119.914 -0.231 0.000 2.555 2391 V HA 0.019 4.139 4.120 0.001 0.000 0.286 2391 V C 0.633 176.553 176.094 -0.290 0.000 1.044 2391 V CA -0.308 61.787 62.300 -0.343 0.000 1.026 2391 V CB 0.598 32.180 31.823 -0.401 0.000 0.981 2391 V HN 0.375 nan 8.190 nan 0.000 0.480 2392 E N 5.061 125.099 120.200 -0.270 0.000 2.383 2392 E HA 0.171 4.522 4.350 0.001 0.000 0.257 2392 E C -0.507 175.898 176.600 -0.324 0.000 1.079 2392 E CA -0.026 56.231 56.400 -0.237 0.000 0.934 2392 E CB 0.324 29.923 29.700 -0.170 0.000 0.978 2392 E HN 0.465 nan 8.360 nan 0.000 0.462 2393 L N 4.804 125.798 121.223 -0.381 0.000 2.454 2393 L HA 0.373 4.713 4.340 0.001 0.000 0.256 2393 L C -1.920 174.662 176.870 -0.480 0.000 1.136 2393 L CA -2.220 52.283 54.840 -0.562 0.000 0.804 2393 L CB 0.035 41.772 42.059 -0.536 0.000 1.181 2393 L HN 0.328 nan 8.230 nan 0.000 0.469 2394 P HA 0.209 nan 4.420 nan 0.000 0.276 2394 P C -2.292 174.685 177.300 -0.538 0.000 1.244 2394 P CA -1.500 61.207 63.100 -0.655 0.000 0.801 2394 P CB 0.136 31.044 31.700 -1.318 0.000 1.006 2395 P HA -0.130 nan 4.420 nan 0.000 0.218 2395 P C 0.977 178.252 177.300 -0.042 0.000 1.148 2395 P CA 1.352 64.376 63.100 -0.127 0.000 0.822 2395 P CB -0.405 31.282 31.700 -0.022 0.000 0.784 2396 W N -1.239 120.072 121.300 0.019 0.000 2.961 2396 W HA 0.433 5.094 4.660 0.001 0.000 0.240 2396 W C -0.319 176.226 176.519 0.042 0.000 1.305 2396 W CA -0.005 57.353 57.345 0.022 0.000 1.465 2396 W CB -0.648 28.816 29.460 0.008 0.000 1.135 2396 W HN -0.086 nan 8.180 nan 0.000 0.688 2397 A N 1.899 124.708 122.820 -0.019 0.000 2.410 2397 A HA 0.417 4.738 4.320 0.001 0.000 0.289 2397 A C 0.870 178.414 177.584 -0.068 0.000 1.200 2397 A CA -0.674 51.377 52.037 0.023 0.000 0.751 2397 A CB 1.111 20.075 19.000 -0.060 0.000 1.161 2397 A HN -0.089 nan 8.150 nan 0.000 0.459 2398 K N 0.713 121.112 120.400 -0.002 0.000 2.228 2398 K HA 0.047 4.367 4.320 0.001 0.000 0.202 2398 K C 0.905 177.482 176.600 -0.039 0.000 1.051 2398 K CA 1.610 57.880 56.287 -0.028 0.000 0.960 2398 K CB -0.196 32.305 32.500 0.001 0.000 0.743 2398 K HN 0.850 nan 8.250 nan 0.000 0.458 2399 T N -2.894 111.650 114.554 -0.016 0.000 2.916 2399 T HA 0.267 4.618 4.350 0.001 0.000 0.292 2399 T C 1.187 175.880 174.700 -0.013 0.000 1.064 2399 T CA -0.305 61.785 62.100 -0.016 0.000 1.011 2399 T CB 1.843 70.715 68.868 0.007 0.000 1.152 2399 T HN -0.009 nan 8.240 nan 0.000 0.510 2400 S N 0.420 116.113 115.700 -0.012 0.000 2.382 2400 S HA -0.138 4.333 4.470 0.001 0.000 0.228 2400 S C 1.506 176.146 174.600 0.067 0.000 1.027 2400 S CA 1.159 59.367 58.200 0.013 0.000 0.991 2400 S CB -0.746 62.503 63.200 0.081 0.000 0.823 2400 S HN 0.756 nan 8.310 nan 0.000 0.469 2401 E N 1.594 121.824 120.200 0.050 0.000 2.077 2401 E HA -0.075 4.276 4.350 0.001 0.000 0.193 2401 E C 2.037 178.692 176.600 0.091 0.000 0.989 2401 E CA 1.416 57.848 56.400 0.053 0.000 0.800 2401 E CB -0.345 29.369 29.700 0.023 0.000 0.746 2401 E HN 0.838 nan 8.360 nan 0.000 0.452 2402 E N -0.614 119.648 120.200 0.102 0.000 2.107 2402 E HA -0.171 4.179 4.350 0.001 0.000 0.191 2402 E C 1.740 178.474 176.600 0.224 0.000 0.982 2402 E CA 0.581 57.081 56.400 0.167 0.000 0.809 2402 E CB -0.141 29.646 29.700 0.145 0.000 0.756 2402 E HN 0.256 nan 8.360 nan 0.000 0.459 2403 F N 0.888 120.836 119.950 -0.004 0.000 2.102 2403 F HA -0.193 4.335 4.527 0.001 0.000 0.298 2403 F C 1.957 177.750 175.800 -0.012 0.000 1.105 2403 F CA 1.304 59.268 58.000 -0.060 0.000 1.239 2403 F CB -0.560 38.193 39.000 -0.412 0.000 0.991 2403 F HN -0.112 nan 8.300 nan 0.000 0.474 2404 V N 0.013 119.805 119.914 -0.203 0.000 2.358 2404 V HA -0.313 3.807 4.120 0.001 0.000 0.246 2404 V C 2.395 178.442 176.094 -0.078 0.000 1.047 2404 V CA 2.297 64.457 62.300 -0.234 0.000 1.035 2404 V CB -1.085 30.707 31.823 -0.052 0.000 0.658 2404 V HN 0.523 nan 8.190 nan 0.000 0.452 2405 H N 0.279 119.322 119.070 -0.044 0.000 2.319 2405 H HA -0.136 4.420 4.556 0.001 0.000 0.299 2405 H C 2.023 177.357 175.328 0.009 0.000 1.092 2405 H CA 2.228 58.277 56.048 0.001 0.000 1.302 2405 H CB -0.228 29.547 29.762 0.021 0.000 1.373 2405 H HN 0.385 nan 8.280 nan 0.000 0.497 2406 I N 0.055 120.566 120.570 -0.098 0.000 2.394 2406 I HA -0.232 3.939 4.170 0.001 0.000 0.251 2406 I C 1.934 177.957 176.117 -0.157 0.000 1.136 2406 I CA 0.784 61.989 61.300 -0.159 0.000 1.425 2406 I CB -0.313 37.693 38.000 0.010 0.000 1.079 2406 I HN 0.334 nan 8.210 nan 0.000 0.425 2407 N N 1.024 119.631 118.700 -0.156 0.000 2.084 2407 N HA -0.217 4.524 4.740 0.001 0.000 0.190 2407 N C 1.952 177.589 175.510 0.210 0.000 1.030 2407 N CA 1.261 54.260 53.050 -0.085 0.000 0.849 2407 N CB -0.348 37.892 38.487 -0.412 0.000 1.012 2407 N HN 0.192 nan 8.380 nan 0.000 0.423 2408 R N 1.179 121.763 120.500 0.140 0.000 2.081 2408 R HA 0.092 4.433 4.340 0.001 0.000 0.235 2408 R C 2.200 178.531 176.300 0.050 0.000 1.131 2408 R CA 0.924 57.124 56.100 0.167 0.000 0.960 2408 R CB -0.747 29.586 30.300 0.056 0.000 0.856 2408 R HN 0.220 nan 8.270 nan 0.000 0.436 2409 L N -0.224 120.944 121.223 -0.092 0.000 2.042 2409 L HA -0.158 4.183 4.340 0.001 0.000 0.210 2409 L C 2.459 179.353 176.870 0.039 0.000 1.076 2409 L CA 1.493 56.286 54.840 -0.079 0.000 0.749 2409 L CB -0.716 41.229 42.059 -0.191 0.000 0.893 2409 L HN 0.356 nan 8.230 nan 0.000 0.432 2410 A N -0.017 122.839 122.820 0.061 0.000 1.877 2410 A HA -0.239 4.081 4.320 0.001 0.000 0.216 2410 A C 2.193 179.922 177.584 0.241 0.000 1.186 2410 A CA 1.667 53.819 52.037 0.191 0.000 0.620 2410 A CB -0.742 18.296 19.000 0.064 0.000 0.822 2410 A HN 0.330 nan 8.150 nan 0.000 0.443 2411 L N -0.427 120.902 121.223 0.177 0.000 2.127 2411 L HA -0.120 4.221 4.340 0.001 0.000 0.211 2411 L C 1.611 178.538 176.870 0.096 0.000 1.089 2411 L CA 2.078 56.964 54.840 0.077 0.000 0.757 2411 L CB -0.351 41.646 42.059 -0.104 0.000 0.899 2411 L HN 0.337 nan 8.230 nan 0.000 0.434 2412 E N -0.370 119.894 120.200 0.107 0.000 2.479 2412 E HA 0.111 4.462 4.350 0.001 0.000 0.193 2412 E C 1.016 177.662 176.600 0.078 0.000 1.049 2412 E CA 0.542 57.003 56.400 0.102 0.000 0.870 2412 E CB -0.220 29.532 29.700 0.086 0.000 0.944 2412 E HN 0.624 nan 8.360 nan 0.000 0.492 2413 S N 0.613 116.371 115.700 0.097 0.000 2.580 2413 S HA 0.018 4.489 4.470 0.001 0.000 0.266 2413 S C 1.194 175.791 174.600 -0.004 0.000 1.354 2413 S CA -0.311 57.928 58.200 0.065 0.000 1.008 2413 S CB 1.494 64.791 63.200 0.161 0.000 0.898 2413 S HN -0.110 nan 8.310 nan 0.000 0.555 2414 E N 0.614 120.748 120.200 -0.109 0.000 2.268 2414 E HA 0.004 4.354 4.350 0.001 0.000 0.195 2414 E C 1.110 177.583 176.600 -0.211 0.000 0.995 2414 E CA 1.021 57.311 56.400 -0.182 0.000 0.836 2414 E CB -0.422 29.114 29.700 -0.273 0.000 0.763 2414 E HN 0.746 nan 8.360 nan 0.000 0.491 2415 F N -0.771 119.011 119.950 -0.280 0.000 2.134 2415 F HA -0.167 4.361 4.527 0.001 0.000 0.299 2415 F C 2.180 177.837 175.800 -0.239 0.000 1.097 2415 F CA 0.954 58.695 58.000 -0.432 0.000 1.264 2415 F CB -0.544 37.771 39.000 -1.141 0.000 1.001 2415 F HN -0.031 nan 8.300 nan 0.000 0.479 2416 V N -1.574 118.379 119.914 0.065 0.000 2.346 2416 V HA -0.193 3.928 4.120 0.001 0.000 0.244 2416 V C 2.299 178.483 176.094 0.149 0.000 1.037 2416 V CA 1.724 64.092 62.300 0.114 0.000 1.029 2416 V CB -0.780 31.117 31.823 0.124 0.000 0.663 2416 V HN 0.230 nan 8.190 nan 0.000 0.454 2417 S N 0.557 116.328 115.700 0.117 0.000 2.365 2417 S HA -0.298 4.173 4.470 0.001 0.000 0.225 2417 S C 2.056 176.735 174.600 0.132 0.000 1.039 2417 S CA 1.996 60.271 58.200 0.125 0.000 1.033 2417 S CB -0.726 62.469 63.200 -0.008 0.000 0.887 2417 S HN 0.882 nan 8.310 nan 0.000 0.447 2418 C N 0.729 120.073 119.300 0.074 0.000 2.466 2418 C HA 0.129 4.589 4.460 0.001 0.000 0.283 2418 C C 1.667 176.820 174.990 0.272 0.000 1.472 2418 C CA 0.154 59.230 59.018 0.097 0.000 1.765 2418 C CB -0.881 26.872 27.740 0.022 0.000 1.724 2418 C HN 0.396 nan 8.230 nan 0.000 0.560 2419 Q N -0.758 119.228 119.800 0.309 0.000 2.101 2419 Q HA 0.219 4.560 4.340 0.001 0.000 0.236 2419 Q C 1.618 177.769 176.000 0.251 0.000 0.772 2419 Q CA -0.128 55.858 55.803 0.304 0.000 0.944 2419 Q CB -0.438 28.397 28.738 0.163 0.000 1.171 2419 Q HN 0.534 nan 8.270 nan 0.000 0.463 2420 L N 2.994 124.416 121.223 0.332 0.000 2.211 2420 L HA -0.226 4.115 4.340 0.001 0.000 0.216 2420 L C 2.449 179.478 176.870 0.266 0.000 1.092 2420 L CA 2.109 57.114 54.840 0.275 0.000 0.767 2420 L CB -0.476 41.769 42.059 0.311 0.000 0.894 2420 L HN 0.401 nan 8.230 nan 0.000 0.437 2421 H N -1.403 117.831 119.070 0.274 0.000 2.489 2421 H HA -0.133 4.424 4.556 0.001 0.000 0.293 2421 H C 1.611 177.048 175.328 0.181 0.000 1.066 2421 H CA 1.520 57.682 56.048 0.191 0.000 1.305 2421 H CB -0.519 29.521 29.762 0.463 0.000 1.386 2421 H HN 0.582 nan 8.280 nan 0.000 0.551 2422 Q N -0.567 119.020 119.800 -0.354 0.000 2.245 2422 Q HA -0.080 4.261 4.340 0.001 0.000 0.201 2422 Q C 1.886 177.886 176.000 -0.000 0.000 0.955 2422 Q CA 0.828 56.519 55.803 -0.188 0.000 0.870 2422 Q CB -0.107 28.503 28.738 -0.212 0.000 0.945 2422 Q HN 0.534 nan 8.270 nan 0.000 0.461 2423 W N 1.568 122.800 121.300 -0.114 0.000 2.409 2423 W HA -0.042 4.618 4.660 0.001 0.000 0.299 2423 W C 1.620 178.072 176.519 -0.112 0.000 1.203 2423 W CA 0.912 58.196 57.345 -0.101 0.000 1.298 2423 W CB -0.104 29.309 29.460 -0.079 0.000 1.127 2423 W HN -0.056 nan 8.180 nan 0.000 0.528 2424 I N 0.832 121.455 120.570 0.087 0.000 2.335 2424 I HA -0.336 3.834 4.170 0.001 0.000 0.251 2424 I C 1.939 177.996 176.117 -0.100 0.000 1.129 2424 I CA 1.653 62.932 61.300 -0.035 0.000 1.402 2424 I CB -0.586 37.294 38.000 -0.201 0.000 1.069 2424 I HN -0.043 nan 8.210 nan 0.000 0.424 2425 D N 0.839 121.206 120.400 -0.055 0.000 2.117 2425 D HA -0.131 4.510 4.640 0.001 0.000 0.197 2425 D C 2.358 178.541 176.300 -0.195 0.000 0.987 2425 D CA 1.286 55.272 54.000 -0.023 0.000 0.829 2425 D CB -0.161 40.660 40.800 0.035 0.000 0.961 2425 D HN 0.332 nan 8.370 nan 0.000 0.460 2426 L N 0.386 121.426 121.223 -0.305 0.000 2.027 2426 L HA -0.125 4.215 4.340 0.001 0.000 0.206 2426 L C 2.338 178.923 176.870 -0.475 0.000 1.074 2426 L CA 0.591 55.210 54.840 -0.369 0.000 0.745 2426 L CB -0.190 41.621 42.059 -0.414 0.000 0.898 2426 L HN 0.024 nan 8.230 nan 0.000 0.433 2427 I N -0.881 119.220 120.570 -0.782 0.000 2.206 2427 I HA -0.153 4.018 4.170 0.001 0.000 0.239 2427 I C 2.057 177.691 176.117 -0.805 0.000 1.078 2427 I CA 1.899 62.602 61.300 -0.994 0.000 1.367 2427 I CB -0.987 36.001 38.000 -1.686 0.000 1.078 2427 I HN 0.128 nan 8.210 nan 0.000 0.413 2428 F N 0.237 119.972 119.950 -0.358 0.000 2.724 2428 F HA 0.416 4.943 4.527 0.001 0.000 0.306 2428 F C 1.666 177.341 175.800 -0.208 0.000 1.100 2428 F CA -0.171 57.669 58.000 -0.265 0.000 1.255 2428 F CB -0.628 38.175 39.000 -0.328 0.000 1.072 2428 F HN -0.061 nan 8.300 nan 0.000 0.589 2429 G N -0.255 108.543 108.800 -0.004 0.000 2.509 2429 G HA2 0.069 4.029 3.960 0.001 0.000 0.269 2429 G HA3 0.069 4.029 3.960 0.001 0.000 0.269 2429 G C 0.492 175.446 174.900 0.090 0.000 1.416 2429 G CA -0.139 44.997 45.100 0.061 0.000 1.052 2429 G HN 0.420 nan 8.290 nan 0.000 0.542 2430 Y N -1.288 119.011 120.300 -0.002 0.000 2.616 2430 Y HA 0.268 4.818 4.550 0.001 0.000 0.296 2430 Y C 1.860 177.763 175.900 0.004 0.000 1.154 2430 Y CA 0.825 58.930 58.100 0.008 0.000 1.325 2430 Y CB 0.134 38.610 38.460 0.026 0.000 1.007 2430 Y HN 0.190 nan 8.280 nan 0.000 0.542 2431 K N 0.849 120.967 120.400 -0.471 0.000 2.387 2431 K HA 0.006 4.326 4.320 0.001 0.000 0.198 2431 K C 1.544 178.038 176.600 -0.176 0.000 1.022 2431 K CA 0.138 56.160 56.287 -0.441 0.000 1.128 2431 K CB 0.169 32.372 32.500 -0.497 0.000 0.853 2431 K HN 0.504 nan 8.250 nan 0.000 0.523 2432 Q N 0.992 120.737 119.800 -0.090 0.000 2.123 2432 Q HA -0.078 4.263 4.340 0.001 0.000 0.199 2432 Q C 0.171 176.220 176.000 0.083 0.000 0.966 2432 Q CA 1.200 57.017 55.803 0.023 0.000 0.845 2432 Q CB 0.486 29.247 28.738 0.038 0.000 0.907 2432 Q HN 0.301 nan 8.270 nan 0.000 0.439 2433 Q N -2.203 117.599 119.800 0.003 0.000 2.615 2433 Q HA 0.538 4.878 4.340 0.001 0.000 0.298 2433 Q C -0.407 175.567 176.000 -0.043 0.000 1.023 2433 Q CA -0.440 55.332 55.803 -0.051 0.000 0.768 2433 Q CB 1.998 30.676 28.738 -0.100 0.000 1.500 2433 Q HN 0.346 nan 8.270 nan 0.000 0.441 2434 G N 0.322 109.091 108.800 -0.053 0.000 2.693 2434 G HA2 -0.218 3.742 3.960 0.001 0.000 0.226 2434 G HA3 -0.218 3.742 3.960 0.001 0.000 0.226 2434 G C -2.174 172.717 174.900 -0.015 0.000 1.354 2434 G CA -0.349 44.738 45.100 -0.022 0.000 0.873 2434 G HN 0.500 nan 8.290 nan 0.000 0.562 2435 P HA -0.013 nan 4.420 nan 0.000 0.217 2435 P C 1.548 178.835 177.300 -0.022 0.000 1.148 2435 P CA 1.827 64.927 63.100 -0.000 0.000 0.828 2435 P CB 0.062 31.772 31.700 0.017 0.000 0.783 2436 E N -0.568 119.614 120.200 -0.030 0.000 2.072 2436 E HA -0.087 4.263 4.350 0.001 0.000 0.191 2436 E C 2.091 178.619 176.600 -0.121 0.000 0.985 2436 E CA 1.195 57.543 56.400 -0.088 0.000 0.801 2436 E CB -0.959 28.646 29.700 -0.158 0.000 0.750 2436 E HN 0.062 nan 8.360 nan 0.000 0.452 2437 A N 0.222 122.988 122.820 -0.091 0.000 1.972 2437 A HA -0.154 4.166 4.320 0.001 0.000 0.219 2437 A C 2.401 179.947 177.584 -0.063 0.000 1.169 2437 A CA 1.731 53.731 52.037 -0.061 0.000 0.635 2437 A CB -0.869 18.129 19.000 -0.003 0.000 0.810 2437 A HN 0.286 nan 8.150 nan 0.000 0.446 2438 V N -2.018 117.852 119.914 -0.073 0.000 2.488 2438 V HA -0.099 4.022 4.120 0.001 0.000 0.246 2438 V C 2.246 178.256 176.094 -0.140 0.000 1.046 2438 V CA 2.006 64.231 62.300 -0.124 0.000 1.053 2438 V CB -0.843 30.892 31.823 -0.148 0.000 0.679 2438 V HN 0.542 nan 8.190 nan 0.000 0.458 2439 R N 0.912 121.350 120.500 -0.103 0.000 2.092 2439 R HA 0.044 4.384 4.340 0.001 0.000 0.231 2439 R C 2.100 178.330 176.300 -0.117 0.000 1.119 2439 R CA 1.532 57.578 56.100 -0.090 0.000 0.970 2439 R CB -0.475 29.793 30.300 -0.054 0.000 0.864 2439 R HN 0.606 nan 8.270 nan 0.000 0.440 2440 A N 0.930 123.670 122.820 -0.134 0.000 2.238 2440 A HA 0.098 4.418 4.320 0.001 0.000 0.208 2440 A C 0.991 178.455 177.584 -0.198 0.000 1.177 2440 A CA 0.029 51.984 52.037 -0.137 0.000 0.804 2440 A CB 0.026 18.945 19.000 -0.134 0.000 0.823 2440 A HN 0.469 nan 8.150 nan 0.000 0.482 2441 L N -0.742 120.269 121.223 -0.353 0.000 3.533 2441 L HA -0.191 4.149 4.340 0.001 0.000 0.477 2441 L C -0.147 176.438 176.870 -0.475 0.000 1.306 2441 L CA 1.089 55.459 54.840 -0.782 0.000 0.850 2441 L CB -1.912 39.866 42.059 -0.468 0.000 1.654 2441 L HN 0.667 nan 8.230 nan 0.000 0.863 2442 N N -0.617 117.946 118.700 -0.229 0.000 2.517 2442 N HA 0.299 5.040 4.740 0.001 0.000 0.285 2442 N C -0.671 174.962 175.510 0.204 0.000 1.528 2442 N CA -0.068 53.022 53.050 0.065 0.000 0.892 2442 N CB 0.676 39.196 38.487 0.054 0.000 1.356 2442 N HN 0.107 nan 8.380 nan 0.000 0.495 2443 V N 2.254 122.280 119.914 0.186 0.000 2.333 2443 V HA 0.464 4.585 4.120 0.001 0.000 0.274 2443 V C -0.083 176.094 176.094 0.139 0.000 1.028 2443 V CA -0.540 61.912 62.300 0.255 0.000 0.851 2443 V CB -0.084 31.854 31.823 0.191 0.000 1.000 2443 V HN 0.055 nan 8.190 nan 0.000 0.456 2444 F N 2.641 122.899 119.950 0.514 0.000 2.364 2444 F HA 0.457 4.985 4.527 0.001 0.000 0.316 2444 F C 0.379 176.412 175.800 0.387 0.000 1.133 2444 F CA -0.847 57.402 58.000 0.415 0.000 1.051 2444 F CB 0.282 39.398 39.000 0.192 0.000 1.342 2444 F HN 0.365 nan 8.300 nan 0.000 0.507 2445 Y N 1.238 121.655 120.300 0.195 0.000 2.702 2445 Y HA -0.126 4.424 4.550 0.001 0.000 0.336 2445 Y C 1.339 177.333 175.900 0.157 0.000 1.235 2445 Y CA -0.510 57.540 58.100 -0.084 0.000 1.492 2445 Y CB 0.073 38.347 38.460 -0.309 0.000 1.308 2445 Y HN 0.521 nan 8.280 nan 0.000 0.589 2446 Y N 2.194 122.298 120.300 -0.326 0.000 2.274 2446 Y HA -0.177 4.373 4.550 0.001 0.000 0.290 2446 Y C 1.477 177.437 175.900 0.099 0.000 1.145 2446 Y CA 1.095 59.184 58.100 -0.019 0.000 1.203 2446 Y CB -0.506 37.819 38.460 -0.224 0.000 0.984 2446 Y HN 0.475 nan 8.280 nan 0.000 0.533 2447 L N 0.772 121.443 121.223 -0.920 0.000 2.265 2447 L HA -0.153 4.188 4.340 0.001 0.000 0.215 2447 L C 2.287 179.027 176.870 -0.216 0.000 1.117 2447 L CA 1.809 56.315 54.840 -0.556 0.000 0.782 2447 L CB -1.773 40.032 42.059 -0.424 0.000 0.914 2447 L HN 0.405 nan 8.230 nan 0.000 0.441 2448 T N -1.242 113.211 114.554 -0.169 0.000 3.051 2448 T HA -0.093 4.258 4.350 0.001 0.000 0.269 2448 T C 0.109 174.553 174.700 -0.428 0.000 1.127 2448 T CA 0.517 62.430 62.100 -0.312 0.000 1.107 2448 T CB -0.254 68.434 68.868 -0.300 0.000 0.898 2448 T HN 0.061 nan 8.240 nan 0.000 0.517 2449 Y N 1.561 121.828 120.300 -0.055 0.000 2.457 2449 Y HA 0.407 4.958 4.550 0.001 0.000 0.333 2449 Y C 0.614 176.495 175.900 -0.033 0.000 1.119 2449 Y CA -1.673 56.411 58.100 -0.027 0.000 1.143 2449 Y CB 0.750 39.224 38.460 0.023 0.000 1.230 2449 Y HN -0.012 nan 8.280 nan 0.000 0.469 2450 E N 0.677 120.955 120.200 0.129 0.000 2.415 2450 E HA 0.202 4.552 4.350 0.001 0.000 0.262 2450 E C 0.845 177.499 176.600 0.090 0.000 1.038 2450 E CA 0.867 57.309 56.400 0.070 0.000 0.921 2450 E CB 0.404 30.137 29.700 0.055 0.000 0.950 2450 E HN 0.977 nan 8.360 nan 0.000 0.438 2451 G N 1.970 110.807 108.800 0.062 0.000 2.189 2451 G HA2 -0.412 3.549 3.960 0.001 0.000 0.267 2451 G HA3 -0.412 3.549 3.960 0.001 0.000 0.267 2451 G C 1.040 175.986 174.900 0.077 0.000 0.975 2451 G CA 0.646 45.783 45.100 0.061 0.000 0.644 2451 G HN 0.668 nan 8.290 nan 0.000 0.537 2452 A N -1.325 121.556 122.820 0.101 0.000 1.972 2452 A HA 0.499 4.820 4.320 0.001 0.000 0.219 2452 A C 1.177 178.844 177.584 0.138 0.000 1.169 2452 A CA 2.130 54.256 52.037 0.148 0.000 0.635 2452 A CB 0.213 19.311 19.000 0.163 0.000 0.810 2452 A HN 1.346 nan 8.150 nan 0.000 0.446 2453 V N -1.374 118.592 119.914 0.087 0.000 3.167 2453 V HA 0.194 4.315 4.120 0.001 0.000 0.293 2453 V C -1.109 175.013 176.094 0.047 0.000 1.379 2453 V CA -0.969 61.376 62.300 0.076 0.000 1.019 2453 V CB 2.036 33.913 31.823 0.089 0.000 1.115 2453 V HN 0.478 nan 8.190 nan 0.000 0.442 2454 N N 2.186 120.912 118.700 0.044 0.000 2.437 2454 N HA 0.454 5.194 4.740 0.001 0.000 0.259 2454 N C 0.944 176.473 175.510 0.032 0.000 0.983 2454 N CA -0.603 52.468 53.050 0.035 0.000 0.937 2454 N CB 1.214 39.723 38.487 0.036 0.000 1.122 2454 N HN 0.680 nan 8.380 nan 0.000 0.499 2455 L N 2.948 124.187 121.223 0.026 0.000 1.997 2455 L HA -0.316 4.025 4.340 0.001 0.000 0.216 2455 L C 1.819 178.707 176.870 0.030 0.000 1.074 2455 L CA 1.290 56.145 54.840 0.024 0.000 0.763 2455 L CB -0.612 41.459 42.059 0.020 0.000 0.890 2455 L HN 0.678 nan 8.230 nan 0.000 0.434 2456 N N 0.321 119.042 118.700 0.034 0.000 2.018 2456 N HA -0.212 4.529 4.740 0.001 0.000 0.196 2456 N C 1.914 177.443 175.510 0.032 0.000 1.043 2456 N CA 1.868 54.939 53.050 0.035 0.000 0.856 2456 N CB -1.042 37.468 38.487 0.038 0.000 1.042 2456 N HN 0.423 nan 8.380 nan 0.000 0.423 2457 S N 0.388 116.107 115.700 0.032 0.000 2.478 2457 S HA -0.140 4.331 4.470 0.001 0.000 0.256 2457 S C 0.836 175.454 174.600 0.030 0.000 1.003 2457 S CA 0.613 58.831 58.200 0.030 0.000 0.976 2457 S CB -0.545 62.674 63.200 0.032 0.000 0.751 2457 S HN 0.187 nan 8.310 nan 0.000 0.513 2458 I N 2.742 123.331 120.570 0.031 0.000 2.359 2458 I HA 0.255 4.425 4.170 0.001 0.000 0.294 2458 I C 1.151 177.285 176.117 0.027 0.000 0.987 2458 I CA -0.059 61.260 61.300 0.030 0.000 1.225 2458 I CB 1.101 39.120 38.000 0.033 0.000 1.366 2458 I HN 0.341 nan 8.210 nan 0.000 0.466 2459 T N -0.715 113.854 114.554 0.025 0.000 3.040 2459 T HA 0.112 4.463 4.350 0.001 0.000 0.266 2459 T C 0.286 174.999 174.700 0.022 0.000 1.005 2459 T CA -0.306 61.808 62.100 0.023 0.000 0.906 2459 T CB 0.055 68.936 68.868 0.021 0.000 1.082 2459 T HN 0.421 nan 8.240 nan 0.000 0.531 2460 D N 2.534 122.948 120.400 0.022 0.000 2.380 2460 D HA 0.342 4.983 4.640 0.001 0.000 0.230 2460 D C -1.631 174.682 176.300 0.021 0.000 1.154 2460 D CA -2.542 51.471 54.000 0.021 0.000 0.859 2460 D CB 1.825 42.638 40.800 0.022 0.000 1.045 2460 D HN -0.070 nan 8.370 nan 0.000 0.495 2461 P HA -0.262 nan 4.420 nan 0.000 0.218 2461 P C 1.494 178.805 177.300 0.019 0.000 1.165 2461 P CA 1.109 64.221 63.100 0.020 0.000 0.922 2461 P CB 0.258 31.969 31.700 0.018 0.000 0.794 2462 V N -0.961 118.964 119.914 0.018 0.000 2.261 2462 V HA -0.226 3.895 4.120 0.001 0.000 0.246 2462 V C 2.438 178.544 176.094 0.020 0.000 1.047 2462 V CA 1.813 64.123 62.300 0.017 0.000 1.015 2462 V CB -1.467 30.366 31.823 0.016 0.000 0.642 2462 V HN 0.049 nan 8.190 nan 0.000 0.446 2463 L N 0.241 121.478 121.223 0.022 0.000 2.079 2463 L HA -0.175 4.165 4.340 0.001 0.000 0.210 2463 L C 2.548 179.434 176.870 0.027 0.000 1.081 2463 L CA 2.078 56.934 54.840 0.028 0.000 0.752 2463 L CB -0.785 41.292 42.059 0.031 0.000 0.896 2463 L HN 0.223 nan 8.230 nan 0.000 0.433 2464 R N -0.773 119.742 120.500 0.025 0.000 2.073 2464 R HA -0.161 4.179 4.340 0.001 0.000 0.229 2464 R C 2.325 178.635 176.300 0.017 0.000 1.120 2464 R CA 1.514 57.627 56.100 0.023 0.000 0.967 2464 R CB -0.204 30.110 30.300 0.024 0.000 0.862 2464 R HN 0.529 nan 8.270 nan 0.000 0.436 2465 E N -0.438 119.772 120.200 0.017 0.000 2.208 2465 E HA -0.128 4.223 4.350 0.001 0.000 0.193 2465 E C 1.587 178.194 176.600 0.012 0.000 0.988 2465 E CA 0.844 57.252 56.400 0.013 0.000 0.828 2465 E CB 0.061 29.770 29.700 0.015 0.000 0.763 2465 E HN 0.460 nan 8.360 nan 0.000 0.478 2466 A N 0.285 123.114 122.820 0.015 0.000 1.968 2466 A HA -0.083 4.238 4.320 0.001 0.000 0.217 2466 A C 2.286 179.877 177.584 0.012 0.000 1.169 2466 A CA 0.865 52.910 52.037 0.015 0.000 0.638 2466 A CB -0.294 18.715 19.000 0.015 0.000 0.812 2466 A HN 0.191 nan 8.150 nan 0.000 0.446 2467 V N 0.381 120.301 119.914 0.011 0.000 2.453 2467 V HA -0.215 3.906 4.120 0.001 0.000 0.247 2467 V C 2.322 178.404 176.094 -0.021 0.000 1.048 2467 V CA 2.090 64.391 62.300 0.001 0.000 1.049 2467 V CB -0.714 31.116 31.823 0.011 0.000 0.672 2467 V HN 0.636 nan 8.190 nan 0.000 0.457 2468 E N 0.495 120.681 120.200 -0.022 0.000 2.158 2468 E HA -0.080 4.270 4.350 0.001 0.000 0.191 2468 E C 2.299 178.865 176.600 -0.056 0.000 0.982 2468 E CA 1.127 57.495 56.400 -0.054 0.000 0.823 2468 E CB -0.233 29.442 29.700 -0.042 0.000 0.766 2468 E HN 0.588 nan 8.360 nan 0.000 0.468 2469 A N 1.387 124.199 122.820 -0.013 0.000 1.929 2469 A HA -0.214 4.107 4.320 0.001 0.000 0.216 2469 A C 2.170 179.805 177.584 0.084 0.000 1.176 2469 A CA 1.433 53.476 52.037 0.010 0.000 0.628 2469 A CB -0.302 18.722 19.000 0.041 0.000 0.816 2469 A HN 0.092 nan 8.150 nan 0.000 0.444 2470 Q N 0.158 120.023 119.800 0.107 0.000 2.079 2470 Q HA -0.029 4.312 4.340 0.001 0.000 0.200 2470 Q C 1.701 177.790 176.000 0.148 0.000 0.974 2470 Q CA 1.754 57.686 55.803 0.215 0.000 0.840 2470 Q CB -0.436 28.309 28.738 0.012 0.000 0.898 2470 Q HN 0.667 nan 8.270 nan 0.000 0.430 2471 I N -0.111 120.445 120.570 -0.022 0.000 2.315 2471 I HA -0.238 3.933 4.170 0.001 0.000 0.248 2471 I C 2.449 178.453 176.117 -0.190 0.000 1.117 2471 I CA 1.202 62.431 61.300 -0.119 0.000 1.404 2471 I CB -0.202 37.711 38.000 -0.145 0.000 1.071 2471 I HN 0.197 nan 8.210 nan 0.000 0.419 2472 R N 0.907 121.293 120.500 -0.189 0.000 2.062 2472 R HA -0.095 4.245 4.340 0.001 0.000 0.231 2472 R C 1.916 178.018 176.300 -0.331 0.000 1.136 2472 R CA 2.153 58.100 56.100 -0.255 0.000 0.948 2472 R CB -0.171 30.004 30.300 -0.209 0.000 0.845 2472 R HN 0.129 nan 8.270 nan 0.000 0.430 2473 S N -0.944 114.493 115.700 -0.439 0.000 2.524 2473 S HA 0.208 4.679 4.470 0.001 0.000 0.215 2473 S C 0.077 174.026 174.600 -1.084 0.000 0.986 2473 S CA -0.232 57.498 58.200 -0.784 0.000 0.911 2473 S CB 0.375 62.999 63.200 -0.960 0.000 0.805 2473 S HN 0.252 nan 8.310 nan 0.000 0.501 2474 F N 2.087 121.882 119.950 -0.258 0.000 2.708 2474 F HA 0.515 5.042 4.527 0.001 0.000 0.300 2474 F C 1.149 176.768 175.800 -0.302 0.000 1.118 2474 F CA -0.269 57.580 58.000 -0.252 0.000 1.307 2474 F CB 0.440 39.316 39.000 -0.206 0.000 0.986 2474 F HN 0.182 nan 8.300 nan 0.000 0.522 2475 G N 1.075 109.640 108.800 -0.392 0.000 2.770 2475 G HA2 -0.009 3.951 3.960 0.001 0.000 0.686 2475 G HA3 -0.009 3.951 3.960 0.001 0.000 0.686 2475 G C -1.202 173.214 174.900 -0.807 0.000 1.180 2475 G CA -1.149 43.505 45.100 -0.742 0.000 0.767 2475 G HN 0.133 nan 8.290 nan 0.000 0.646 2476 Q N 0.812 120.037 119.800 -0.958 0.000 2.303 2476 Q HA 0.520 4.861 4.340 0.001 0.000 0.267 2476 Q C -0.173 175.411 176.000 -0.694 0.000 1.011 2476 Q CA -0.760 54.651 55.803 -0.654 0.000 0.740 2476 Q CB 2.097 30.590 28.738 -0.408 0.000 1.250 2476 Q HN 0.596 nan 8.270 nan 0.000 0.458 2477 T N 4.285 118.485 114.554 -0.589 0.000 2.888 2477 T HA 0.154 4.505 4.350 0.001 0.000 0.301 2477 T C -2.139 172.407 174.700 -0.257 0.000 1.001 2477 T CA -0.770 61.092 62.100 -0.398 0.000 1.147 2477 T CB 0.187 68.772 68.868 -0.471 0.000 0.931 2477 T HN 0.254 nan 8.240 nan 0.000 0.541 2478 P HA 0.103 nan 4.420 nan 0.000 0.269 2478 P C -0.369 176.899 177.300 -0.053 0.000 1.217 2478 P CA -0.264 62.758 63.100 -0.130 0.000 0.783 2478 P CB 0.367 31.947 31.700 -0.199 0.000 0.898 2479 S N 0.813 116.519 115.700 0.011 0.000 2.549 2479 S HA 0.006 4.477 4.470 0.001 0.000 0.286 2479 S C 0.218 174.856 174.600 0.063 0.000 1.314 2479 S CA -0.304 57.917 58.200 0.035 0.000 1.062 2479 S CB -0.129 63.092 63.200 0.035 0.000 0.865 2479 S HN 0.416 nan 8.310 nan 0.000 0.498 2480 Q N 1.946 121.776 119.800 0.050 0.000 2.311 2480 Q HA 0.172 4.513 4.340 0.001 0.000 0.272 2480 Q C 0.289 176.294 176.000 0.007 0.000 1.012 2480 Q CA 0.008 55.835 55.803 0.041 0.000 0.891 2480 Q CB 0.311 29.075 28.738 0.044 0.000 1.201 2480 Q HN 0.717 nan 8.270 nan 0.000 0.391 2481 L N 4.856 126.043 121.223 -0.060 0.000 2.513 2481 L HA 0.250 4.590 4.340 0.001 0.000 0.222 2481 L C 0.155 176.869 176.870 -0.261 0.000 1.096 2481 L CA 0.118 54.836 54.840 -0.204 0.000 0.857 2481 L CB 0.032 41.813 42.059 -0.462 0.000 1.026 2481 L HN 0.606 nan 8.230 nan 0.000 0.469 2482 L N -2.570 118.538 121.223 -0.191 0.000 2.710 2482 L HA 0.424 4.764 4.340 0.001 0.000 0.260 2482 L C -0.372 176.510 176.870 0.019 0.000 0.993 2482 L CA -0.839 53.953 54.840 -0.080 0.000 0.877 2482 L CB 1.787 43.748 42.059 -0.162 0.000 1.461 2482 L HN 0.018 nan 8.230 nan 0.000 0.413 2483 I N -2.727 117.880 120.570 0.061 0.000 4.009 2483 I HA 0.473 4.644 4.170 0.001 0.000 0.331 2483 I C -0.356 175.813 176.117 0.086 0.000 1.462 2483 I CA -0.126 61.235 61.300 0.101 0.000 1.117 2483 I CB 0.443 38.490 38.000 0.079 0.000 1.091 2483 I HN 0.528 nan 8.210 nan 0.000 0.410 2484 E N 1.848 122.059 120.200 0.018 0.000 2.320 2484 E HA 0.521 4.871 4.350 0.001 0.000 0.264 2484 E C -2.668 173.771 176.600 -0.268 0.000 0.923 2484 E CA -2.107 54.197 56.400 -0.160 0.000 0.796 2484 E CB 1.249 30.903 29.700 -0.077 0.000 1.262 2484 E HN -0.091 nan 8.360 nan 0.000 0.428 2485 P HA -0.076 nan 4.420 nan 0.000 0.265 2485 P C -0.336 177.022 177.300 0.097 0.000 1.187 2485 P CA 0.481 63.380 63.100 -0.335 0.000 0.766 2485 P CB 0.297 31.828 31.700 -0.280 0.000 0.820 2486 H N 5.113 124.310 119.070 0.212 0.000 2.620 2486 H HA 0.211 4.768 4.556 0.001 0.000 0.313 2486 H C -2.129 173.390 175.328 0.318 0.000 1.075 2486 H CA -2.206 54.008 56.048 0.277 0.000 1.397 2486 H CB 0.544 30.485 29.762 0.299 0.000 1.446 2486 H HN 0.275 nan 8.280 nan 0.000 0.493 2487 P HA 0.047 nan 4.420 nan 0.000 0.267 2487 P C -2.747 174.657 177.300 0.173 0.000 1.200 2487 P CA -0.993 62.155 63.100 0.080 0.000 0.772 2487 P CB 0.263 31.939 31.700 -0.040 0.000 0.855 2488 P HA 0.166 nan 4.420 nan 0.000 0.274 2488 P C -1.097 176.107 177.300 -0.160 0.000 1.246 2488 P CA -0.999 61.832 63.100 -0.449 0.000 0.795 2488 P CB 1.287 32.586 31.700 -0.669 0.000 1.006 2489 R N 0.000 120.350 120.500 -0.251 0.000 2.786 2489 R HA 0.000 4.341 4.340 0.001 0.000 0.208 2489 R CA 0.000 55.639 56.100 -0.769 0.000 0.921 2489 R CB 0.000 29.706 30.300 -0.991 0.000 0.687 2489 R HN 0.000 nan 8.270 nan 0.000 0.535