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 1mx1_1_B DATA FIRST_RESID 2022 DATA SEQUENCE SPPVVDTVHG KVLGKFVSLE GFAQPVAIFL GIPFAKPPLG PLRFTPPQPA DATA SEQUENCE EPWSFVKNAT SYPPMcTQDP KAGQLLSELF TNRKENIPLK LSEDcLYLNI DATA SEQUENCE YTPADLTKKN RLPVMVWIHG GGLMVGAAST YDGLALAAHE NVVVVTIQYR DATA SEQUENCE LGIWGFFSTG DEHSRGNWGH LDQVAALRWV QDNIASFGGN PGSVTIFGES DATA SEQUENCE AGGESVSVLV LSPLAKNLFH RAISESGVAL TSVLVKKGDV KPLAEQIAIT DATA SEQUENCE AGcKTTTSAV MVHcLRQKTE EELLETTLKM KFLSLDLQGD PRESQPLLGT DATA SEQUENCE VIDGMLLLKT PEELQAERNF HTVPYMVGIN KQEFGWLIPM XLMSYPLSEG DATA SEQUENCE QLDQKTAMSL LWKSYPLVCI AKELIPEATE KYLGGTDDTV KKKDLFLDLI DATA SEQUENCE ADVMFGVPSV IVARNHRDAG APTYMYEFQY RPSFSSDMKP KTVIGDHGDE DATA SEQUENCE LFSVFGAPFL KEGASEEEIR LSKMVMKFWA NFARNGNPNG EGLPHWPEYN DATA SEQUENCE QKEGYLQIGA NTQAAQKLKD KEVAFWTNLF AK VARS RESID RESNAME ATOMNAME SS_SHIFT SHIFT RC_SHIFT HM_SHIFT EF_SHIFT SIGMA FORMAT %4d %4s %4s %9.3f %9.3f %9.3f %9.3f %9.3f %9.3f 2022 S HA 0.000 nan 4.470 nan 0.000 0.327 2022 S C 0.000 174.685 174.600 0.142 0.000 1.055 2022 S CA 0.000 58.267 58.200 0.111 0.000 1.107 2022 S CB 0.000 63.246 63.200 0.077 0.000 0.593 2023 P HA 0.306 nan 4.420 nan 0.000 0.267 2023 P C -2.645 174.530 177.300 -0.208 0.000 1.200 2023 P CA -0.720 62.286 63.100 -0.155 0.000 0.772 2023 P CB -0.808 30.803 31.700 -0.147 0.000 0.855 2024 P HA 0.079 nan 4.420 nan 0.000 0.271 2024 P C -0.641 176.647 177.300 -0.020 0.000 1.226 2024 P CA 0.101 63.032 63.100 -0.281 0.000 0.765 2024 P CB 0.703 32.065 31.700 -0.564 0.000 0.835 2025 V N 4.770 124.730 119.914 0.077 0.000 2.495 2025 V HA 0.378 4.498 4.120 -0.000 0.000 0.298 2025 V C 0.338 176.479 176.094 0.078 0.000 1.031 2025 V CA -0.667 61.707 62.300 0.123 0.000 0.871 2025 V CB 2.230 34.105 31.823 0.086 0.000 0.988 2025 V HN 0.322 nan 8.190 nan 0.000 0.432 2026 V N 2.811 122.745 119.914 0.033 0.000 2.735 2026 V HA 0.495 4.615 4.120 -0.000 0.000 0.310 2026 V C -1.025 174.998 176.094 -0.119 0.000 1.061 2026 V CA -0.797 61.381 62.300 -0.203 0.000 0.913 2026 V CB 2.428 33.796 31.823 -0.759 0.000 1.005 2026 V HN 0.836 nan 8.190 nan 0.000 0.428 2027 D N 2.647 122.963 120.400 -0.139 0.000 2.280 2027 D HA 0.531 5.171 4.640 -0.000 0.000 0.243 2027 D C 0.308 176.546 176.300 -0.103 0.000 1.129 2027 D CA 0.116 54.071 54.000 -0.075 0.000 0.848 2027 D CB 1.699 42.454 40.800 -0.074 0.000 1.107 2027 D HN 0.780 nan 8.370 nan 0.000 0.471 2028 T N -2.172 112.363 114.554 -0.031 0.000 2.938 2028 T HA 0.332 4.682 4.350 -0.000 0.000 0.285 2028 T C 1.369 175.971 174.700 -0.164 0.000 1.028 2028 T CA -0.785 61.291 62.100 -0.040 0.000 1.005 2028 T CB 0.889 69.886 68.868 0.216 0.000 1.157 2028 T HN -0.021 nan 8.240 nan 0.000 0.550 2029 V N 1.015 120.766 119.914 -0.272 0.000 2.392 2029 V HA -0.161 3.959 4.120 -0.000 0.000 0.249 2029 V C 2.407 178.262 176.094 -0.398 0.000 1.059 2029 V CA 1.722 63.805 62.300 -0.361 0.000 1.051 2029 V CB -1.150 30.377 31.823 -0.494 0.000 0.658 2029 V HN 0.862 nan 8.190 nan 0.000 0.455 2030 H N -0.164 118.719 119.070 -0.311 0.000 2.548 2030 H HA 0.449 5.005 4.556 0.000 0.000 0.265 2030 H C 1.022 175.593 175.328 -1.262 0.000 0.969 2030 H CA 0.880 56.538 56.048 -0.650 0.000 1.155 2030 H CB 0.448 29.844 29.762 -0.610 0.000 1.394 2030 H HN 0.542 nan 8.280 nan 0.000 0.570 2031 G N 0.118 108.446 108.800 -0.785 0.000 2.361 2031 G HA2 0.018 3.978 3.960 -0.000 0.000 0.305 2031 G HA3 0.018 3.978 3.960 -0.000 0.000 0.305 2031 G C -1.336 173.606 174.900 0.069 0.000 1.367 2031 G CA -1.151 43.536 45.100 -0.688 0.000 0.951 2031 G HN 0.027 nan 8.290 nan 0.000 0.615 2032 K N -0.427 120.143 120.400 0.283 0.000 2.270 2032 K HA 0.538 4.858 4.320 -0.000 0.000 0.276 2032 K C 0.364 177.278 176.600 0.524 0.000 1.023 2032 K CA -0.372 56.117 56.287 0.337 0.000 0.955 2032 K CB 1.707 34.344 32.500 0.228 0.000 0.975 2032 K HN 1.022 nan 8.250 nan 0.000 0.471 2033 V N 0.731 120.871 119.914 0.376 0.000 2.735 2033 V HA 0.491 4.611 4.120 -0.000 0.000 0.310 2033 V C -0.857 175.449 176.094 0.353 0.000 1.061 2033 V CA -1.154 61.367 62.300 0.368 0.000 0.913 2033 V CB 1.752 33.835 31.823 0.433 0.000 1.005 2033 V HN 0.594 nan 8.190 nan 0.000 0.428 2034 L N 4.361 125.745 121.223 0.269 0.000 2.296 2034 L HA 0.919 5.259 4.340 -0.000 0.000 0.286 2034 L C 0.300 177.207 176.870 0.061 0.000 1.023 2034 L CA 0.673 55.609 54.840 0.160 0.000 0.812 2034 L CB 1.026 43.121 42.059 0.059 0.000 1.223 2034 L HN 1.047 nan 8.230 nan 0.000 0.421 2035 G N 4.914 113.576 108.800 -0.231 0.000 3.122 2035 G HA2 0.622 4.582 3.960 -0.000 0.000 0.180 2035 G HA3 0.622 4.582 3.960 -0.000 0.000 0.180 2035 G C -1.251 173.296 174.900 -0.588 0.000 1.279 2035 G CA -0.493 44.162 45.100 -0.743 0.000 0.987 2035 G HN 0.729 nan 8.290 nan 0.000 0.589 2036 K N -1.259 118.736 120.400 -0.676 0.000 2.532 2036 K HA 0.576 4.896 4.320 -0.000 0.000 0.265 2036 K C -1.819 174.531 176.600 -0.415 0.000 0.948 2036 K CA -0.831 55.184 56.287 -0.453 0.000 0.842 2036 K CB 1.849 34.196 32.500 -0.254 0.000 1.392 2036 K HN 0.296 nan 8.250 nan 0.000 0.436 2037 F N 1.296 121.186 119.950 -0.100 0.000 2.394 2037 F HA 0.475 5.002 4.527 0.000 0.000 0.340 2037 F C -0.318 175.472 175.800 -0.018 0.000 1.105 2037 F CA -0.874 57.097 58.000 -0.047 0.000 1.124 2037 F CB 2.040 41.030 39.000 -0.017 0.000 1.145 2037 F HN 0.093 nan 8.300 nan 0.000 0.505 2038 V N 2.727 122.789 119.914 0.246 0.000 2.612 2038 V HA 0.255 4.375 4.120 -0.000 0.000 0.301 2038 V C -0.596 175.583 176.094 0.142 0.000 1.059 2038 V CA -0.788 61.606 62.300 0.157 0.000 0.886 2038 V CB 1.786 33.689 31.823 0.134 0.000 1.007 2038 V HN 0.744 nan 8.190 nan 0.000 0.426 2039 S N 4.497 120.263 115.700 0.111 0.000 2.585 2039 S HA 0.738 5.208 4.470 -0.000 0.000 0.277 2039 S C -0.587 174.079 174.600 0.111 0.000 1.241 2039 S CA -0.408 57.850 58.200 0.097 0.000 1.041 2039 S CB 1.547 64.790 63.200 0.072 0.000 0.987 2039 S HN 0.549 nan 8.310 nan 0.000 0.512 2040 L N 2.636 123.938 121.223 0.133 0.000 2.333 2040 L HA 0.509 4.849 4.340 -0.000 0.000 0.280 2040 L C -0.276 176.744 176.870 0.251 0.000 1.004 2040 L CA -0.653 54.288 54.840 0.169 0.000 0.820 2040 L CB 1.403 43.519 42.059 0.096 0.000 1.247 2040 L HN 0.577 nan 8.230 nan 0.000 0.416 2041 E N 3.541 123.860 120.200 0.198 0.000 2.694 2041 E HA 0.354 4.704 4.350 -0.000 0.000 0.250 2041 E C 1.005 177.686 176.600 0.135 0.000 0.963 2041 E CA 1.661 58.149 56.400 0.147 0.000 0.949 2041 E CB -0.005 29.772 29.700 0.129 0.000 0.911 2041 E HN 0.839 nan 8.360 nan 0.000 0.500 2042 G N 3.353 112.140 108.800 -0.022 0.000 2.184 2042 G HA2 -0.215 3.745 3.960 -0.000 0.000 0.206 2042 G HA3 -0.215 3.745 3.960 -0.000 0.000 0.206 2042 G C -0.267 174.166 174.900 -0.778 0.000 0.995 2042 G CA -0.167 44.725 45.100 -0.347 0.000 0.651 2042 G HN 0.357 nan 8.290 nan 0.000 0.511 2043 F N -0.105 119.795 119.950 -0.082 0.000 2.579 2043 F HA 0.709 5.236 4.527 0.000 0.000 0.325 2043 F C 1.112 176.877 175.800 -0.057 0.000 1.162 2043 F CA -0.211 57.737 58.000 -0.088 0.000 0.946 2043 F CB 1.516 40.446 39.000 -0.117 0.000 1.211 2043 F HN 0.102 nan 8.300 nan 0.000 0.447 2044 A N 1.608 124.461 122.820 0.055 0.000 1.877 2044 A HA -0.148 4.172 4.320 -0.000 0.000 0.216 2044 A C 1.231 178.828 177.584 0.022 0.000 1.186 2044 A CA 1.187 53.236 52.037 0.019 0.000 0.620 2044 A CB -0.418 18.576 19.000 -0.009 0.000 0.822 2044 A HN 0.656 nan 8.150 nan 0.000 0.443 2045 Q N 0.967 120.796 119.800 0.047 0.000 2.286 2045 Q HA 0.350 4.690 4.340 -0.000 0.000 0.267 2045 Q C -2.707 173.304 176.000 0.019 0.000 1.028 2045 Q CA -2.185 53.626 55.803 0.013 0.000 0.901 2045 Q CB 0.342 29.102 28.738 0.037 0.000 1.183 2045 Q HN 0.237 nan 8.270 nan 0.000 0.392 2046 P HA 0.089 nan 4.420 nan 0.000 0.275 2046 P C -1.120 176.245 177.300 0.109 0.000 1.227 2046 P CA -0.401 62.689 63.100 -0.016 0.000 0.781 2046 P CB 0.903 32.484 31.700 -0.199 0.000 0.906 2047 V N 2.504 122.527 119.914 0.183 0.000 2.498 2047 V HA 0.416 4.536 4.120 -0.000 0.000 0.279 2047 V C 0.605 176.901 176.094 0.338 0.000 1.048 2047 V CA -0.475 61.968 62.300 0.239 0.000 0.967 2047 V CB 0.689 32.626 31.823 0.191 0.000 0.988 2047 V HN 0.658 nan 8.190 nan 0.000 0.473 2048 A N 6.945 129.976 122.820 0.351 0.000 2.320 2048 A HA 0.733 5.053 4.320 -0.000 0.000 0.287 2048 A C -0.403 177.175 177.584 -0.011 0.000 1.181 2048 A CA -0.302 51.819 52.037 0.139 0.000 0.831 2048 A CB 0.025 19.177 19.000 0.254 0.000 1.102 2048 A HN 0.769 nan 8.150 nan 0.000 0.513 2049 I N 2.233 122.596 120.570 -0.346 0.000 2.406 2049 I HA 0.413 4.583 4.170 -0.000 0.000 0.290 2049 I C -1.336 174.387 176.117 -0.657 0.000 0.999 2049 I CA -0.257 60.811 61.300 -0.386 0.000 1.124 2049 I CB 1.646 39.478 38.000 -0.280 0.000 1.289 2049 I HN 0.541 nan 8.210 nan 0.000 0.441 2050 F N 6.536 126.353 119.950 -0.223 0.000 2.460 2050 F HA 0.556 5.083 4.527 -0.000 0.000 0.341 2050 F C -0.300 175.367 175.800 -0.222 0.000 1.130 2050 F CA -0.538 57.380 58.000 -0.137 0.000 0.962 2050 F CB 1.337 40.364 39.000 0.044 0.000 1.171 2050 F HN 0.100 nan 8.300 nan 0.000 0.436 2051 L N 2.125 123.290 121.223 -0.097 0.000 2.334 2051 L HA 0.739 5.079 4.340 -0.000 0.000 0.273 2051 L C 0.774 177.584 176.870 -0.100 0.000 1.013 2051 L CA -1.127 53.621 54.840 -0.153 0.000 0.816 2051 L CB 1.787 43.627 42.059 -0.364 0.000 1.278 2051 L HN 0.860 nan 8.230 nan 0.000 0.431 2052 G N 2.917 111.676 108.800 -0.068 0.000 2.298 2052 G HA2 -0.247 3.713 3.960 -0.000 0.000 0.287 2052 G HA3 -0.247 3.713 3.960 -0.000 0.000 0.287 2052 G C -0.251 174.700 174.900 0.085 0.000 1.075 2052 G CA -0.280 44.765 45.100 -0.092 0.000 0.960 2052 G HN 0.452 nan 8.290 nan 0.000 0.502 2053 I N 2.081 122.712 120.570 0.102 0.000 2.325 2053 I HA 0.246 4.416 4.170 -0.000 0.000 0.291 2053 I C -1.533 174.600 176.117 0.026 0.000 1.019 2053 I CA -2.296 59.027 61.300 0.039 0.000 1.302 2053 I CB 1.463 39.404 38.000 -0.099 0.000 1.401 2053 I HN 0.008 nan 8.210 nan 0.000 0.485 2054 P HA 0.051 nan 4.420 nan 0.000 0.276 2054 P C -0.239 176.945 177.300 -0.194 0.000 1.235 2054 P CA -0.047 62.879 63.100 -0.289 0.000 0.772 2054 P CB 0.546 32.091 31.700 -0.259 0.000 0.871 2055 F N 1.322 121.078 119.950 -0.324 0.000 2.661 2055 F HA 0.747 5.274 4.527 0.000 0.000 0.306 2055 F C 0.027 175.828 175.800 0.002 0.000 1.094 2055 F CA -0.925 56.935 58.000 -0.233 0.000 1.254 2055 F CB 0.169 38.954 39.000 -0.358 0.000 1.040 2055 F HN 0.391 nan 8.300 nan 0.000 0.562 2056 A N 0.475 123.078 122.820 -0.361 0.000 2.586 2056 A HA 0.485 4.805 4.320 -0.000 0.000 0.290 2056 A C -1.339 176.080 177.584 -0.276 0.000 1.086 2056 A CA -1.147 50.753 52.037 -0.228 0.000 0.665 2056 A CB 0.815 19.648 19.000 -0.277 0.000 1.279 2056 A HN 0.184 nan 8.150 nan 0.000 0.423 2057 K N 0.711 121.011 120.400 -0.167 0.000 2.350 2057 K HA 0.416 4.736 4.320 -0.000 0.000 0.279 2057 K C -2.421 174.061 176.600 -0.197 0.000 1.027 2057 K CA -1.503 54.690 56.287 -0.157 0.000 0.969 2057 K CB 0.331 32.775 32.500 -0.094 0.000 0.954 2057 K HN 0.332 nan 8.250 nan 0.000 0.474 2058 P HA -0.034 nan 4.420 nan 0.000 0.258 2058 P C -2.388 174.821 177.300 -0.152 0.000 1.187 2058 P CA -0.783 62.204 63.100 -0.188 0.000 0.767 2058 P CB 0.181 31.801 31.700 -0.134 0.000 0.770 2059 P HA 0.028 nan 4.420 nan 0.000 0.232 2059 P C -0.593 176.616 177.300 -0.151 0.000 1.738 2059 P CA 0.480 63.487 63.100 -0.155 0.000 0.948 2059 P CB -0.032 31.575 31.700 -0.155 0.000 1.943 2060 L N -0.287 120.860 121.223 -0.126 0.000 2.375 2060 L HA 0.568 4.908 4.340 -0.000 0.000 0.268 2060 L C 1.717 178.523 176.870 -0.108 0.000 1.058 2060 L CA -0.280 54.495 54.840 -0.108 0.000 0.803 2060 L CB 0.559 42.568 42.059 -0.083 0.000 1.212 2060 L HN 0.277 nan 8.230 nan 0.000 0.451 2061 G N 1.779 110.520 108.800 -0.099 0.000 2.660 2061 G HA2 -0.306 3.654 3.960 -0.000 0.000 0.321 2061 G HA3 -0.306 3.654 3.960 -0.000 0.000 0.321 2061 G C -1.537 173.300 174.900 -0.104 0.000 1.246 2061 G CA 0.430 45.477 45.100 -0.088 0.000 1.000 2061 G HN 0.593 nan 8.290 nan 0.000 0.550 2062 P HA 0.061 nan 4.420 nan 0.000 0.221 2062 P C 1.958 179.199 177.300 -0.098 0.000 1.145 2062 P CA 1.152 64.217 63.100 -0.058 0.000 0.795 2062 P CB -0.137 31.545 31.700 -0.029 0.000 0.775 2063 L N -1.647 119.501 121.223 -0.126 0.000 2.552 2063 L HA 0.024 4.364 4.340 -0.000 0.000 0.227 2063 L C 1.532 178.241 176.870 -0.268 0.000 1.146 2063 L CA -0.023 54.720 54.840 -0.162 0.000 0.858 2063 L CB -0.461 41.519 42.059 -0.131 0.000 0.969 2063 L HN -0.031 nan 8.230 nan 0.000 0.451 2064 R N 0.730 121.029 120.500 -0.335 0.000 2.537 2064 R HA -0.009 4.331 4.340 -0.000 0.000 0.280 2064 R C -0.221 175.659 176.300 -0.700 0.000 1.058 2064 R CA -0.134 55.600 56.100 -0.609 0.000 1.057 2064 R CB 0.239 30.089 30.300 -0.750 0.000 0.973 2064 R HN 0.060 nan 8.270 nan 0.000 0.438 2065 F N 0.102 119.661 119.950 -0.650 0.000 3.043 2065 F HA -0.265 4.262 4.527 -0.000 0.000 0.290 2065 F C 0.061 174.863 175.800 -1.663 0.000 0.844 2065 F CA 1.315 58.581 58.000 -1.223 0.000 1.184 2065 F CB -2.671 36.073 39.000 -0.426 0.000 1.246 2065 F HN 0.673 nan 8.300 nan 0.000 0.536 2066 T N -3.853 109.979 114.554 -1.204 0.000 2.883 2066 T HA 0.801 5.151 4.350 -0.000 0.000 0.296 2066 T C -2.972 171.561 174.700 -0.278 0.000 1.117 2066 T CA -2.434 59.243 62.100 -0.705 0.000 1.006 2066 T CB 3.291 72.006 68.868 -0.255 0.000 1.191 2066 T HN -0.254 nan 8.240 nan 0.000 0.508 2067 P HA 0.260 nan 4.420 nan 0.000 0.269 2067 P C -2.326 175.041 177.300 0.112 0.000 1.215 2067 P CA -0.899 62.350 63.100 0.248 0.000 0.780 2067 P CB -0.299 31.538 31.700 0.228 0.000 0.898 2068 P HA 0.076 nan 4.420 nan 0.000 0.272 2068 P C -0.870 176.472 177.300 0.069 0.000 1.223 2068 P CA 0.139 63.286 63.100 0.078 0.000 0.784 2068 P CB 0.861 32.641 31.700 0.134 0.000 0.923 2069 Q N 1.563 121.379 119.800 0.027 0.000 2.351 2069 Q HA 0.452 4.792 4.340 -0.000 0.000 0.273 2069 Q C -2.420 173.605 176.000 0.043 0.000 1.077 2069 Q CA -2.285 53.539 55.803 0.035 0.000 0.843 2069 Q CB 1.093 29.833 28.738 0.004 0.000 1.367 2069 Q HN 0.326 nan 8.270 nan 0.000 0.449 2070 P HA -0.057 nan 4.420 nan 0.000 0.265 2070 P C -1.077 176.222 177.300 -0.002 0.000 1.187 2070 P CA 0.350 63.514 63.100 0.106 0.000 0.766 2070 P CB 0.406 32.181 31.700 0.125 0.000 0.820 2071 A N 2.978 125.772 122.820 -0.043 0.000 2.407 2071 A HA 0.175 4.495 4.320 -0.000 0.000 0.248 2071 A C 0.355 177.717 177.584 -0.369 0.000 1.082 2071 A CA -0.289 51.648 52.037 -0.166 0.000 0.785 2071 A CB -0.019 18.951 19.000 -0.052 0.000 1.020 2071 A HN 0.438 nan 8.150 nan 0.000 0.489 2072 E N 2.404 122.502 120.200 -0.171 0.000 2.316 2072 E HA 0.268 4.618 4.350 -0.000 0.000 0.275 2072 E C -2.135 174.406 176.600 -0.100 0.000 1.029 2072 E CA -1.621 54.702 56.400 -0.128 0.000 0.871 2072 E CB 0.411 30.097 29.700 -0.024 0.000 1.022 2072 E HN 0.482 nan 8.360 nan 0.000 0.418 2073 P HA 0.078 nan 4.420 nan 0.000 0.272 2073 P C -0.721 176.556 177.300 -0.038 0.000 1.223 2073 P CA -0.170 62.809 63.100 -0.201 0.000 0.784 2073 P CB 0.332 31.950 31.700 -0.138 0.000 0.923 2074 W N 0.592 121.904 121.300 0.019 0.000 2.736 2074 W HA 0.686 5.346 4.660 -0.000 0.000 0.355 2074 W C -0.885 175.583 176.519 -0.086 0.000 1.102 2074 W CA -0.879 56.455 57.345 -0.019 0.000 1.164 2074 W CB 0.073 29.550 29.460 0.028 0.000 1.422 2074 W HN 0.151 nan 8.180 nan 0.000 0.572 2075 S N 0.936 116.659 115.700 0.039 0.000 2.687 2075 S HA 0.682 5.152 4.470 -0.000 0.000 0.283 2075 S C -0.275 174.206 174.600 -0.199 0.000 1.170 2075 S CA -0.404 57.562 58.200 -0.390 0.000 1.008 2075 S CB 0.483 63.112 63.200 -0.952 0.000 1.026 2075 S HN 0.616 nan 8.310 nan 0.000 0.541 2076 F N -1.267 118.782 119.950 0.166 0.000 2.182 2076 F HA -0.275 4.252 4.527 -0.000 0.000 0.318 2076 F C -0.032 175.911 175.800 0.239 0.000 0.130 2076 F CA 0.095 58.191 58.000 0.160 0.000 0.911 2076 F CB -1.167 37.907 39.000 0.122 0.000 4.132 2076 F HN 0.330 nan 8.300 nan 0.000 0.139 2077 V N 0.733 120.904 119.914 0.429 0.000 2.384 2077 V HA 0.333 4.453 4.120 -0.000 0.000 0.287 2077 V C -0.069 176.146 176.094 0.201 0.000 1.020 2077 V CA -0.893 61.591 62.300 0.306 0.000 0.850 2077 V CB 1.420 33.365 31.823 0.204 0.000 0.987 2077 V HN 0.480 nan 8.190 nan 0.000 0.436 2078 K N 4.119 124.589 120.400 0.117 0.000 2.258 2078 K HA 0.245 4.565 4.320 -0.000 0.000 0.284 2078 K C -0.027 176.542 176.600 -0.051 0.000 1.051 2078 K CA -0.485 55.718 56.287 -0.141 0.000 0.923 2078 K CB 0.593 32.687 32.500 -0.678 0.000 1.046 2078 K HN 0.688 nan 8.250 nan 0.000 0.474 2079 N N 3.245 121.909 118.700 -0.059 0.000 2.411 2079 N HA 0.103 4.843 4.740 -0.000 0.000 0.259 2079 N C -1.300 174.168 175.510 -0.070 0.000 1.103 2079 N CA -0.154 52.870 53.050 -0.044 0.000 0.954 2079 N CB 1.245 39.700 38.487 -0.054 0.000 1.085 2079 N HN 0.592 nan 8.380 nan 0.000 0.485 2080 A N 3.143 125.947 122.820 -0.027 0.000 3.173 2080 A HA 0.297 4.617 4.320 -0.000 0.000 0.304 2080 A C 0.759 178.269 177.584 -0.122 0.000 1.318 2080 A CA -0.460 51.555 52.037 -0.037 0.000 1.069 2080 A CB -0.602 18.473 19.000 0.125 0.000 1.147 2080 A HN 0.727 nan 8.150 nan 0.000 0.547 2081 T N -2.901 111.551 114.554 -0.169 0.000 3.058 2081 T HA 0.299 4.649 4.350 -0.000 0.000 0.278 2081 T C 0.557 175.090 174.700 -0.278 0.000 0.974 2081 T CA 0.502 62.467 62.100 -0.225 0.000 0.893 2081 T CB -0.367 68.395 68.868 -0.176 0.000 1.138 2081 T HN 0.790 nan 8.240 nan 0.000 0.529 2082 S N 0.499 116.037 115.700 -0.270 0.000 2.568 2082 S HA 0.702 5.172 4.470 -0.000 0.000 0.302 2082 S C -0.935 173.466 174.600 -0.331 0.000 1.082 2082 S CA -0.876 57.159 58.200 -0.274 0.000 1.009 2082 S CB 0.790 63.898 63.200 -0.153 0.000 1.069 2082 S HN 0.205 nan 8.310 nan 0.000 0.500 2083 Y N 2.890 123.129 120.300 -0.101 0.000 2.526 2083 Y HA 0.288 4.838 4.550 -0.000 0.000 0.330 2083 Y C -1.397 174.398 175.900 -0.175 0.000 1.156 2083 Y CA -1.098 56.937 58.100 -0.107 0.000 1.419 2083 Y CB 0.100 38.515 38.460 -0.074 0.000 1.250 2083 Y HN 0.551 nan 8.280 nan 0.000 0.540 2084 P HA 0.189 nan 4.420 nan 0.000 0.274 2084 P C -2.677 174.526 177.300 -0.162 0.000 1.246 2084 P CA -1.532 61.380 63.100 -0.313 0.000 0.795 2084 P CB 0.597 32.020 31.700 -0.462 0.000 1.006 2085 P HA 0.240 nan 4.420 nan 0.000 0.274 2085 P C -0.167 177.093 177.300 -0.067 0.000 1.256 2085 P CA -0.170 62.865 63.100 -0.108 0.000 0.795 2085 P CB 0.236 31.873 31.700 -0.106 0.000 1.038 2086 M N -0.619 118.932 119.600 -0.083 0.000 2.478 2086 M HA 0.493 4.973 4.480 -0.000 0.000 0.327 2086 M C -0.754 175.472 176.300 -0.124 0.000 1.187 2086 M CA -0.672 54.576 55.300 -0.087 0.000 1.022 2086 M CB 0.726 33.257 32.600 -0.115 0.000 1.629 2086 M HN 0.105 nan 8.290 nan 0.000 0.461 2087 c N 1.902 120.424 118.600 -0.131 0.000 2.665 2087 c HA 0.124 4.694 4.570 -0.000 0.000 0.416 2087 c C 0.936 174.845 174.090 -0.302 0.000 1.305 2087 c CA -0.145 56.056 56.329 -0.213 0.000 1.903 2087 c CB -0.383 42.021 42.510 -0.178 0.000 2.704 2087 c HN 0.875 nan 8.230 nan 0.000 0.629 2088 T N 4.316 118.548 114.554 -0.537 0.000 2.891 2088 T HA 0.289 4.639 4.350 -0.000 0.000 0.296 2088 T C -0.029 174.412 174.700 -0.432 0.000 1.025 2088 T CA 0.445 62.145 62.100 -0.667 0.000 1.149 2088 T CB -0.163 67.848 68.868 -1.428 0.000 1.007 2088 T HN 0.889 nan 8.240 nan 0.000 0.528 2089 Q N 0.812 120.502 119.800 -0.184 0.000 2.874 2089 Q HA 0.291 4.631 4.340 -0.000 0.000 0.303 2089 Q C -1.674 174.345 176.000 0.031 0.000 0.876 2089 Q CA -1.178 54.625 55.803 0.001 0.000 0.765 2089 Q CB 0.813 29.541 28.738 -0.016 0.000 1.478 2089 Q HN 0.406 nan 8.270 nan 0.000 0.434 2090 D N 1.249 121.696 120.400 0.078 0.000 2.451 2090 D HA 0.058 4.698 4.640 -0.000 0.000 0.254 2090 D C -1.583 174.724 176.300 0.012 0.000 1.204 2090 D CA -1.115 52.922 54.000 0.062 0.000 0.896 2090 D CB 1.114 41.959 40.800 0.074 0.000 1.136 2090 D HN 0.261 nan 8.370 nan 0.000 0.499 2091 P HA -0.133 nan 4.420 nan 0.000 0.216 2091 P C 1.093 178.375 177.300 -0.029 0.000 1.150 2091 P CA 1.388 64.472 63.100 -0.026 0.000 0.837 2091 P CB 0.310 31.996 31.700 -0.023 0.000 0.786 2092 K N -0.419 119.971 120.400 -0.016 0.000 2.001 2092 K HA -0.018 4.302 4.320 -0.000 0.000 0.208 2092 K C 2.228 178.811 176.600 -0.029 0.000 1.048 2092 K CA 1.499 57.774 56.287 -0.020 0.000 0.932 2092 K CB -0.760 31.734 32.500 -0.010 0.000 0.715 2092 K HN 0.014 nan 8.250 nan 0.000 0.437 2093 A N 1.350 124.158 122.820 -0.020 0.000 1.933 2093 A HA -0.073 4.247 4.320 -0.000 0.000 0.218 2093 A C 2.392 179.943 177.584 -0.055 0.000 1.175 2093 A CA 1.852 53.871 52.037 -0.031 0.000 0.628 2093 A CB -1.124 17.873 19.000 -0.004 0.000 0.814 2093 A HN 0.432 nan 8.150 nan 0.000 0.444 2094 G N -0.814 107.956 108.800 -0.050 0.000 2.421 2094 G HA2 -0.281 3.679 3.960 -0.000 0.000 0.216 2094 G HA3 -0.281 3.679 3.960 -0.000 0.000 0.216 2094 G C 1.639 176.480 174.900 -0.098 0.000 1.171 2094 G CA 1.098 46.153 45.100 -0.076 0.000 0.775 2094 G HN 0.616 nan 8.290 nan 0.000 0.543 2095 Q N -0.585 119.165 119.800 -0.083 0.000 2.119 2095 Q HA -0.057 4.283 4.340 -0.000 0.000 0.201 2095 Q C 2.431 178.378 176.000 -0.088 0.000 0.972 2095 Q CA 1.127 56.878 55.803 -0.087 0.000 0.847 2095 Q CB -0.217 28.480 28.738 -0.067 0.000 0.903 2095 Q HN 0.382 nan 8.270 nan 0.000 0.433 2096 L N 0.586 121.763 121.223 -0.078 0.000 1.994 2096 L HA -0.168 4.172 4.340 -0.000 0.000 0.208 2096 L C 2.153 178.953 176.870 -0.117 0.000 1.071 2096 L CA 1.673 56.470 54.840 -0.073 0.000 0.745 2096 L CB -0.981 41.042 42.059 -0.061 0.000 0.892 2096 L HN 0.426 nan 8.230 nan 0.000 0.431 2097 L N -0.902 120.216 121.223 -0.175 0.000 2.012 2097 L HA -0.192 4.148 4.340 -0.000 0.000 0.210 2097 L C 2.694 179.380 176.870 -0.307 0.000 1.073 2097 L CA 2.219 56.865 54.840 -0.323 0.000 0.748 2097 L CB -1.208 40.651 42.059 -0.334 0.000 0.891 2097 L HN 0.480 nan 8.230 nan 0.000 0.431 2098 S N -0.849 114.726 115.700 -0.209 0.000 2.370 2098 S HA -0.255 4.215 4.470 -0.000 0.000 0.226 2098 S C 1.938 176.447 174.600 -0.152 0.000 1.033 2098 S CA 1.742 59.823 58.200 -0.199 0.000 1.011 2098 S CB -0.359 62.727 63.200 -0.190 0.000 0.852 2098 S HN 0.657 nan 8.310 nan 0.000 0.457 2099 E N 0.107 120.245 120.200 -0.104 0.000 2.150 2099 E HA -0.055 4.295 4.350 -0.000 0.000 0.193 2099 E C 2.022 178.644 176.600 0.036 0.000 0.985 2099 E CA 1.121 57.495 56.400 -0.043 0.000 0.814 2099 E CB -0.140 29.544 29.700 -0.026 0.000 0.752 2099 E HN 0.510 nan 8.360 nan 0.000 0.466 2100 L N -0.483 120.765 121.223 0.042 0.000 2.240 2100 L HA -0.063 4.277 4.340 -0.000 0.000 0.211 2100 L C 1.659 178.797 176.870 0.448 0.000 1.106 2100 L CA 0.447 55.411 54.840 0.207 0.000 0.793 2100 L CB 0.034 42.168 42.059 0.125 0.000 0.927 2100 L HN 0.129 nan 8.230 nan 0.000 0.446 2101 F N -1.020 118.889 119.950 -0.068 0.000 2.717 2101 F HA 0.150 4.677 4.527 0.000 0.000 0.295 2101 F C 1.577 177.094 175.800 -0.473 0.000 1.117 2101 F CA -0.488 57.352 58.000 -0.267 0.000 1.361 2101 F CB -0.637 38.239 39.000 -0.207 0.000 1.112 2101 F HN -0.189 nan 8.300 nan 0.000 0.594 2102 T N 2.203 116.643 114.554 -0.190 0.000 2.940 2102 T HA -0.027 4.323 4.350 -0.000 0.000 0.309 2102 T C 1.259 175.819 174.700 -0.234 0.000 1.056 2102 T CA -0.019 61.880 62.100 -0.336 0.000 1.137 2102 T CB 0.296 69.013 68.868 -0.253 0.000 0.976 2102 T HN 0.347 nan 8.240 nan 0.000 0.547 2103 N N 3.947 122.461 118.700 -0.311 0.000 2.230 2103 N HA 0.054 4.794 4.740 -0.000 0.000 0.202 2103 N C 0.286 175.686 175.510 -0.182 0.000 1.119 2103 N CA -0.240 52.680 53.050 -0.217 0.000 0.851 2103 N CB 0.187 38.549 38.487 -0.207 0.000 0.990 2103 N HN 0.475 nan 8.380 nan 0.000 0.497 2104 R N 0.648 121.046 120.500 -0.169 0.000 2.577 2104 R HA 0.212 4.552 4.340 -0.000 0.000 0.269 2104 R C 1.212 177.453 176.300 -0.098 0.000 1.084 2104 R CA -0.527 55.504 56.100 -0.115 0.000 1.163 2104 R CB 1.385 31.615 30.300 -0.116 0.000 1.100 2104 R HN 0.012 nan 8.270 nan 0.000 0.547 2105 K N 0.804 121.169 120.400 -0.059 0.000 2.057 2105 K HA -0.143 4.177 4.320 -0.000 0.000 0.207 2105 K C 0.051 176.630 176.600 -0.034 0.000 1.049 2105 K CA 1.483 57.748 56.287 -0.038 0.000 0.931 2105 K CB 0.267 32.763 32.500 -0.007 0.000 0.714 2105 K HN 0.516 nan 8.250 nan 0.000 0.440 2106 E N 0.567 120.741 120.200 -0.043 0.000 2.275 2106 E HA 0.089 4.439 4.350 -0.000 0.000 0.270 2106 E C -1.438 175.114 176.600 -0.079 0.000 0.882 2106 E CA -0.685 55.687 56.400 -0.046 0.000 0.758 2106 E CB 1.069 30.750 29.700 -0.032 0.000 1.195 2106 E HN 0.175 nan 8.360 nan 0.000 0.419 2107 N N 4.572 123.221 118.700 -0.085 0.000 2.454 2107 N HA 0.028 4.768 4.740 -0.000 0.000 0.254 2107 N C -0.481 174.943 175.510 -0.143 0.000 1.228 2107 N CA 0.301 53.276 53.050 -0.125 0.000 0.900 2107 N CB 0.540 38.962 38.487 -0.108 0.000 1.089 2107 N HN 0.483 nan 8.380 nan 0.000 0.449 2108 I N 5.130 125.573 120.570 -0.212 0.000 2.297 2108 I HA 0.214 4.384 4.170 -0.000 0.000 0.291 2108 I C -1.732 174.261 176.117 -0.207 0.000 1.033 2108 I CA -1.904 59.249 61.300 -0.244 0.000 1.253 2108 I CB 1.503 39.225 38.000 -0.463 0.000 1.396 2108 I HN 0.399 nan 8.210 nan 0.000 0.476 2109 P HA 0.151 nan 4.420 nan 0.000 0.265 2109 P C -0.971 176.262 177.300 -0.112 0.000 1.193 2109 P CA 0.146 63.180 63.100 -0.109 0.000 0.765 2109 P CB 1.044 32.699 31.700 -0.075 0.000 0.823 2110 L N 2.152 123.311 121.223 -0.107 0.000 2.341 2110 L HA 0.507 4.847 4.340 -0.000 0.000 0.267 2110 L C 0.622 177.443 176.870 -0.082 0.000 1.009 2110 L CA -1.254 53.528 54.840 -0.096 0.000 0.819 2110 L CB 1.745 43.737 42.059 -0.112 0.000 1.323 2110 L HN 0.187 nan 8.230 nan 0.000 0.425 2111 K N 1.073 121.427 120.400 -0.077 0.000 2.090 2111 K HA 0.659 4.979 4.320 -0.000 0.000 0.249 2111 K C -0.941 175.603 176.600 -0.093 0.000 0.995 2111 K CA -0.264 55.977 56.287 -0.077 0.000 0.914 2111 K CB 1.044 33.500 32.500 -0.072 0.000 1.057 2111 K HN 0.346 nan 8.250 nan 0.000 0.462 2112 L N 0.602 121.766 121.223 -0.099 0.000 2.334 2112 L HA 0.631 4.971 4.340 -0.000 0.000 0.275 2112 L C -0.145 176.639 176.870 -0.143 0.000 1.036 2112 L CA -0.640 54.121 54.840 -0.132 0.000 0.807 2112 L CB 1.818 43.797 42.059 -0.134 0.000 1.231 2112 L HN 0.565 nan 8.230 nan 0.000 0.438 2113 S N 0.134 115.721 115.700 -0.188 0.000 2.586 2113 S HA 0.165 4.635 4.470 -0.000 0.000 0.277 2113 S C -0.051 174.396 174.600 -0.255 0.000 1.131 2113 S CA -0.591 57.498 58.200 -0.184 0.000 0.848 2113 S CB 1.428 64.562 63.200 -0.109 0.000 1.091 2113 S HN 0.759 nan 8.310 nan 0.000 0.453 2114 E N 0.916 120.958 120.200 -0.263 0.000 2.285 2114 E HA -0.027 4.323 4.350 -0.000 0.000 0.194 2114 E C -0.260 176.230 176.600 -0.184 0.000 0.997 2114 E CA 0.461 56.676 56.400 -0.308 0.000 0.845 2114 E CB 0.099 29.659 29.700 -0.235 0.000 0.782 2114 E HN 0.518 nan 8.360 nan 0.000 0.491 2115 D N 0.511 120.845 120.400 -0.110 0.000 2.517 2115 D HA -0.002 4.638 4.640 -0.000 0.000 0.220 2115 D C 0.005 176.365 176.300 0.099 0.000 1.158 2115 D CA -0.343 53.633 54.000 -0.040 0.000 0.992 2115 D CB -0.125 40.680 40.800 0.008 0.000 1.058 2115 D HN 0.161 nan 8.370 nan 0.000 0.516 2116 c N 2.052 120.653 118.600 0.002 0.000 3.512 2116 c HA 0.402 4.972 4.570 -0.000 0.000 0.276 2116 c C 0.753 174.859 174.090 0.028 0.000 1.592 2116 c CA -0.740 55.667 56.329 0.130 0.000 1.803 2116 c CB -1.386 41.122 42.510 -0.002 0.000 2.996 2116 c HN 0.418 nan 8.230 nan 0.000 0.590 2117 L N 2.449 123.433 121.223 -0.399 0.000 2.391 2117 L HA 0.357 4.697 4.340 -0.000 0.000 0.249 2117 L C -0.782 175.462 176.870 -1.044 0.000 1.308 2117 L CA 0.535 54.933 54.840 -0.737 0.000 1.209 2117 L CB -0.791 40.692 42.059 -0.959 0.000 1.401 2117 L HN 0.415 nan 8.230 nan 0.000 0.416 2118 Y N 1.639 121.870 120.300 -0.116 0.000 2.602 2118 Y HA 0.700 5.250 4.550 -0.000 0.000 0.342 2118 Y C -0.158 175.904 175.900 0.270 0.000 1.029 2118 Y CA -1.302 56.816 58.100 0.029 0.000 1.080 2118 Y CB 1.923 40.366 38.460 -0.028 0.000 1.284 2118 Y HN 0.134 nan 8.280 nan 0.000 0.485 2119 L N -0.222 121.185 121.223 0.307 0.000 2.434 2119 L HA 0.734 5.074 4.340 -0.000 0.000 0.260 2119 L C -1.436 175.488 176.870 0.090 0.000 0.983 2119 L CA -1.180 53.763 54.840 0.172 0.000 0.820 2119 L CB 1.714 43.764 42.059 -0.015 0.000 1.361 2119 L HN 0.400 nan 8.230 nan 0.000 0.410 2120 N N 1.962 120.750 118.700 0.146 0.000 2.361 2120 N HA 0.733 5.473 4.740 -0.000 0.000 0.302 2120 N C -1.127 174.433 175.510 0.084 0.000 1.074 2120 N CA -0.232 52.876 53.050 0.096 0.000 0.850 2120 N CB 2.489 41.100 38.487 0.206 0.000 1.228 2120 N HN 0.690 nan 8.380 nan 0.000 0.491 2121 I N 1.746 122.268 120.570 -0.080 0.000 2.465 2121 I HA 0.325 4.495 4.170 -0.000 0.000 0.291 2121 I C -1.149 174.887 176.117 -0.134 0.000 1.014 2121 I CA -0.780 60.513 61.300 -0.012 0.000 1.093 2121 I CB 1.293 39.200 38.000 -0.156 0.000 1.267 2121 I HN 0.329 nan 8.210 nan 0.000 0.431 2122 Y N 3.210 123.645 120.300 0.225 0.000 2.426 2122 Y HA 0.368 4.918 4.550 0.000 0.000 0.325 2122 Y C 0.269 176.305 175.900 0.226 0.000 0.989 2122 Y CA -0.766 57.467 58.100 0.223 0.000 1.284 2122 Y CB 1.903 40.472 38.460 0.182 0.000 1.104 2122 Y HN 0.374 nan 8.280 nan 0.000 0.481 2123 T N 5.075 119.852 114.554 0.373 0.000 2.786 2123 T HA 0.338 4.688 4.350 -0.000 0.000 0.283 2123 T C -2.039 172.829 174.700 0.280 0.000 0.992 2123 T CA -2.327 59.969 62.100 0.328 0.000 0.954 2123 T CB 1.283 70.385 68.868 0.389 0.000 0.934 2123 T HN 0.347 nan 8.240 nan 0.000 0.440 2124 P HA 0.247 nan 4.420 nan 0.000 0.251 2124 P C 0.388 177.775 177.300 0.144 0.000 1.223 2124 P CA -0.113 63.075 63.100 0.147 0.000 0.796 2124 P CB 0.076 31.822 31.700 0.077 0.000 1.068 2125 A N 1.080 124.001 122.820 0.168 0.000 2.466 2125 A HA 0.101 4.421 4.320 -0.000 0.000 0.238 2125 A C -0.002 177.676 177.584 0.158 0.000 1.074 2125 A CA 0.047 52.171 52.037 0.146 0.000 0.774 2125 A CB -0.475 18.615 19.000 0.151 0.000 1.015 2125 A HN 0.027 nan 8.150 nan 0.000 0.498 2126 D N 1.538 122.007 120.400 0.115 0.000 2.365 2126 D HA 0.322 4.962 4.640 -0.000 0.000 0.237 2126 D C 0.781 177.149 176.300 0.115 0.000 1.190 2126 D CA -0.149 53.914 54.000 0.106 0.000 0.867 2126 D CB 0.092 40.929 40.800 0.061 0.000 1.050 2126 D HN 0.378 nan 8.370 nan 0.000 0.491 2127 L N 2.725 124.043 121.223 0.159 0.000 2.456 2127 L HA -0.040 4.300 4.340 -0.000 0.000 0.224 2127 L C 2.111 179.033 176.870 0.087 0.000 1.148 2127 L CA 1.053 55.969 54.840 0.126 0.000 0.825 2127 L CB -0.662 41.495 42.059 0.164 0.000 0.937 2127 L HN 0.534 nan 8.230 nan 0.000 0.450 2128 T N -3.832 110.774 114.554 0.087 0.000 3.129 2128 T HA 0.135 4.485 4.350 -0.000 0.000 0.251 2128 T C 0.627 175.351 174.700 0.041 0.000 1.117 2128 T CA 0.031 62.167 62.100 0.061 0.000 1.034 2128 T CB 0.102 69.004 68.868 0.058 0.000 0.968 2128 T HN 0.231 nan 8.240 nan 0.000 0.526 2129 K N -0.071 120.354 120.400 0.042 0.000 2.430 2129 K HA 0.513 4.833 4.320 -0.000 0.000 0.268 2129 K C -1.194 175.423 176.600 0.029 0.000 1.043 2129 K CA -1.104 55.201 56.287 0.030 0.000 0.899 2129 K CB 1.866 34.383 32.500 0.030 0.000 1.472 2129 K HN -0.056 nan 8.250 nan 0.000 0.451 2130 K N 1.671 122.084 120.400 0.022 0.000 2.201 2130 K HA 0.245 4.565 4.320 -0.000 0.000 0.278 2130 K C -1.015 175.601 176.600 0.027 0.000 1.027 2130 K CA -0.286 56.013 56.287 0.019 0.000 0.909 2130 K CB 0.567 33.072 32.500 0.009 0.000 1.062 2130 K HN 0.459 nan 8.250 nan 0.000 0.465 2131 N N 3.073 121.794 118.700 0.035 0.000 2.264 2131 N HA 0.326 5.066 4.740 -0.000 0.000 0.288 2131 N C -1.280 174.255 175.510 0.043 0.000 1.094 2131 N CA -0.761 52.315 53.050 0.043 0.000 0.817 2131 N CB 1.809 40.334 38.487 0.064 0.000 1.604 2131 N HN 0.449 nan 8.380 nan 0.000 0.473 2132 R N 1.930 122.452 120.500 0.037 0.000 2.674 2132 R HA 0.371 4.711 4.340 -0.000 0.000 0.270 2132 R C -0.419 175.901 176.300 0.034 0.000 1.492 2132 R CA -0.307 55.812 56.100 0.032 0.000 1.624 2132 R CB 0.261 30.568 30.300 0.012 0.000 1.307 2132 R HN 0.510 nan 8.270 nan 0.000 0.683 2133 L N 2.474 123.729 121.223 0.053 0.000 2.436 2133 L HA 0.377 4.717 4.340 -0.000 0.000 0.265 2133 L C -1.601 175.301 176.870 0.052 0.000 1.168 2133 L CA -1.785 53.086 54.840 0.053 0.000 0.815 2133 L CB 0.291 42.393 42.059 0.072 0.000 1.109 2133 L HN -0.028 nan 8.230 nan 0.000 0.462 2134 P HA 0.037 nan 4.420 nan 0.000 0.269 2134 P C -0.882 176.457 177.300 0.065 0.000 1.209 2134 P CA -0.091 63.030 63.100 0.035 0.000 0.776 2134 P CB 0.999 32.705 31.700 0.011 0.000 0.876 2135 V N 4.322 124.286 119.914 0.084 0.000 2.459 2135 V HA 0.381 4.501 4.120 -0.000 0.000 0.295 2135 V C 0.507 176.673 176.094 0.120 0.000 1.029 2135 V CA -0.409 61.962 62.300 0.119 0.000 0.874 2135 V CB 1.335 33.243 31.823 0.142 0.000 0.985 2135 V HN 0.496 nan 8.190 nan 0.000 0.438 2136 M N 4.816 124.501 119.600 0.142 0.000 2.125 2136 M HA 0.488 4.968 4.480 -0.000 0.000 0.321 2136 M C -1.109 175.447 176.300 0.428 0.000 0.983 2136 M CA -0.593 54.799 55.300 0.153 0.000 0.934 2136 M CB 1.959 34.494 32.600 -0.107 0.000 1.542 2136 M HN 0.361 nan 8.290 nan 0.000 0.424 2137 V N 3.881 124.073 119.914 0.463 0.000 2.333 2137 V HA 0.261 4.381 4.120 -0.000 0.000 0.274 2137 V C -0.602 175.790 176.094 0.496 0.000 1.028 2137 V CA -0.567 61.983 62.300 0.416 0.000 0.851 2137 V CB 0.891 32.838 31.823 0.207 0.000 1.000 2137 V HN 0.826 nan 8.190 nan 0.000 0.456 2138 W N 7.247 128.657 121.300 0.182 0.000 2.351 2138 W HA 0.590 5.250 4.660 -0.000 0.000 0.311 2138 W C -1.193 175.223 176.519 -0.171 0.000 1.168 2138 W CA -0.800 56.374 57.345 -0.285 0.000 1.200 2138 W CB 1.197 30.449 29.460 -0.347 0.000 1.221 2138 W HN 0.424 nan 8.180 nan 0.000 0.519 2139 I N 7.994 127.878 120.570 -1.144 0.000 2.390 2139 I HA 0.059 4.229 4.170 -0.000 0.000 0.283 2139 I C 0.980 176.362 176.117 -1.225 0.000 1.016 2139 I CA -0.813 59.962 61.300 -0.874 0.000 1.151 2139 I CB 0.838 38.459 38.000 -0.631 0.000 1.293 2139 I HN 0.398 nan 8.210 nan 0.000 0.458 2140 H N 4.626 123.317 119.070 -0.631 0.000 2.757 2140 H HA 0.372 4.928 4.556 -0.000 0.000 0.370 2140 H C 0.023 175.347 175.328 -0.007 0.000 1.172 2140 H CA -0.338 55.548 56.048 -0.269 0.000 1.426 2140 H CB 1.044 30.930 29.762 0.208 0.000 1.438 2140 H HN 0.616 nan 8.280 nan 0.000 0.612 2141 G N -1.287 107.694 108.800 0.303 0.000 2.671 2141 G HA2 0.466 4.426 3.960 -0.000 0.000 0.275 2141 G HA3 0.466 4.426 3.960 -0.000 0.000 0.275 2141 G C 0.328 175.487 174.900 0.432 0.000 1.368 2141 G CA -0.743 44.542 45.100 0.309 0.000 1.044 2141 G HN 1.202 nan 8.290 nan 0.000 0.543 2142 G N -2.769 106.215 108.800 0.308 0.000 2.223 2142 G HA2 0.401 4.361 3.960 -0.000 0.000 0.200 2142 G HA3 0.401 4.361 3.960 -0.000 0.000 0.200 2142 G C 1.045 176.031 174.900 0.144 0.000 1.061 2142 G CA 0.704 45.929 45.100 0.208 0.000 0.790 2142 G HN 2.328 nan 8.290 nan 0.000 0.498 2143 G N -0.072 108.809 108.800 0.135 0.000 2.233 2143 G HA2 -0.183 3.777 3.960 -0.000 0.000 0.270 2143 G HA3 -0.183 3.777 3.960 -0.000 0.000 0.270 2143 G C 1.169 176.061 174.900 -0.013 0.000 1.011 2143 G CA 0.832 45.965 45.100 0.056 0.000 0.762 2143 G HN 1.810 nan 8.290 nan 0.000 0.511 2144 L N -3.586 117.662 121.223 0.041 0.000 4.696 2144 L HA -0.276 4.064 4.340 -0.000 0.000 0.425 2144 L C 1.999 178.910 176.870 0.068 0.000 1.115 2144 L CA 1.640 56.488 54.840 0.013 0.000 0.996 2144 L CB -1.439 40.350 42.059 -0.450 0.000 2.077 2144 L HN 0.439 nan 8.230 nan 0.000 0.792 2145 M N -1.382 118.257 119.600 0.065 0.000 2.638 2145 M HA 0.327 4.807 4.480 -0.000 0.000 0.256 2145 M C 0.813 177.169 176.300 0.093 0.000 1.282 2145 M CA 1.184 56.529 55.300 0.074 0.000 1.155 2145 M CB 0.590 33.210 32.600 0.033 0.000 1.345 2145 M HN 0.238 nan 8.290 nan 0.000 0.523 2146 V N -2.946 117.018 119.914 0.082 0.000 3.103 2146 V HA 1.047 5.167 4.120 -0.000 0.000 0.311 2146 V C -0.240 175.886 176.094 0.054 0.000 1.322 2146 V CA -0.265 62.060 62.300 0.041 0.000 1.063 2146 V CB 1.196 33.025 31.823 0.010 0.000 1.090 2146 V HN 0.506 nan 8.190 nan 0.000 0.462 2147 G N -0.966 107.796 108.800 -0.064 0.000 2.440 2147 G HA2 0.603 4.563 3.960 -0.000 0.000 0.684 2147 G HA3 0.603 4.563 3.960 -0.000 0.000 0.684 2147 G C -0.636 173.925 174.900 -0.565 0.000 1.309 2147 G CA -0.177 44.783 45.100 -0.233 0.000 0.931 2147 G HN 2.719 nan 8.290 nan 0.000 0.612 2148 A N -1.004 121.354 122.820 -0.770 0.000 2.604 2148 A HA 1.036 5.356 4.320 -0.000 0.000 0.295 2148 A C 0.770 178.249 177.584 -0.176 0.000 1.067 2148 A CA 0.719 52.479 52.037 -0.462 0.000 0.683 2148 A CB 0.903 19.781 19.000 -0.203 0.000 1.281 2148 A HN 2.561 nan 8.150 nan 0.000 0.407 2149 A N 0.412 123.305 122.820 0.122 0.000 1.929 2149 A HA 0.108 4.428 4.320 -0.000 0.000 0.216 2149 A C 1.981 179.761 177.584 0.327 0.000 1.176 2149 A CA 2.300 54.566 52.037 0.381 0.000 0.628 2149 A CB -0.754 18.476 19.000 0.384 0.000 0.816 2149 A HN 1.167 nan 8.150 nan 0.000 0.444 2150 S N -0.086 115.720 115.700 0.176 0.000 2.469 2150 S HA -0.105 4.365 4.470 -0.000 0.000 0.238 2150 S C 1.739 176.275 174.600 -0.106 0.000 0.998 2150 S CA 1.460 59.721 58.200 0.101 0.000 0.957 2150 S CB -0.477 62.739 63.200 0.028 0.000 0.764 2150 S HN 0.681 nan 8.310 nan 0.000 0.514 2151 T N 0.834 115.279 114.554 -0.183 0.000 2.962 2151 T HA -0.035 4.315 4.350 -0.000 0.000 0.270 2151 T C -0.149 174.099 174.700 -0.752 0.000 1.088 2151 T CA 0.969 62.773 62.100 -0.494 0.000 1.127 2151 T CB -0.202 68.271 68.868 -0.659 0.000 0.883 2151 T HN 0.407 nan 8.240 nan 0.000 0.493 2152 Y N 1.432 121.581 120.300 -0.251 0.000 2.342 2152 Y HA 0.449 4.999 4.550 -0.000 0.000 0.338 2152 Y C -0.056 175.656 175.900 -0.314 0.000 0.965 2152 Y CA -2.166 55.622 58.100 -0.521 0.000 1.159 2152 Y CB 0.647 38.526 38.460 -0.969 0.000 1.157 2152 Y HN -0.127 nan 8.280 nan 0.000 0.486 2153 D N 2.373 122.649 120.400 -0.206 0.000 2.313 2153 D HA 0.185 4.825 4.640 -0.000 0.000 0.239 2153 D C 0.956 177.069 176.300 -0.310 0.000 1.142 2153 D CA -0.086 53.807 54.000 -0.177 0.000 0.847 2153 D CB 1.617 42.379 40.800 -0.064 0.000 1.082 2153 D HN 0.877 nan 8.370 nan 0.000 0.480 2154 G N 3.693 111.881 108.800 -1.021 0.000 2.920 2154 G HA2 -0.085 3.875 3.960 -0.000 0.000 0.208 2154 G HA3 -0.085 3.875 3.960 -0.000 0.000 0.208 2154 G C 1.531 176.175 174.900 -0.427 0.000 1.159 2154 G CA -0.202 44.460 45.100 -0.731 0.000 0.784 2154 G HN 0.558 nan 8.290 nan 0.000 0.535 2155 L N 0.454 121.502 121.223 -0.292 0.000 1.997 2155 L HA -0.208 4.132 4.340 -0.000 0.000 0.216 2155 L C 3.108 179.981 176.870 0.005 0.000 1.074 2155 L CA 2.030 56.892 54.840 0.037 0.000 0.763 2155 L CB -0.310 41.818 42.059 0.114 0.000 0.890 2155 L HN 0.345 nan 8.230 nan 0.000 0.434 2156 A N -0.632 122.193 122.820 0.009 0.000 1.873 2156 A HA -0.231 4.089 4.320 -0.000 0.000 0.215 2156 A C 2.074 179.642 177.584 -0.028 0.000 1.186 2156 A CA 1.589 53.644 52.037 0.029 0.000 0.616 2156 A CB -0.782 18.264 19.000 0.077 0.000 0.823 2156 A HN 0.455 nan 8.150 nan 0.000 0.442 2157 L N -0.019 121.162 121.223 -0.070 0.000 2.012 2157 L HA -0.104 4.236 4.340 -0.000 0.000 0.210 2157 L C 2.641 179.474 176.870 -0.063 0.000 1.073 2157 L CA 2.296 57.071 54.840 -0.107 0.000 0.748 2157 L CB -0.966 40.977 42.059 -0.194 0.000 0.891 2157 L HN 0.356 nan 8.230 nan 0.000 0.431 2158 A N -0.542 122.259 122.820 -0.032 0.000 1.877 2158 A HA -0.099 4.221 4.320 -0.000 0.000 0.216 2158 A C 2.449 179.988 177.584 -0.075 0.000 1.186 2158 A CA 2.082 54.124 52.037 0.008 0.000 0.620 2158 A CB -1.249 17.815 19.000 0.108 0.000 0.822 2158 A HN 0.587 nan 8.150 nan 0.000 0.443 2159 A N -1.280 121.422 122.820 -0.196 0.000 1.873 2159 A HA -0.172 4.148 4.320 -0.000 0.000 0.215 2159 A C 2.067 179.221 177.584 -0.717 0.000 1.186 2159 A CA 1.492 53.215 52.037 -0.523 0.000 0.616 2159 A CB -0.975 17.531 19.000 -0.823 0.000 0.823 2159 A HN 0.694 nan 8.150 nan 0.000 0.442 2160 H N -0.989 117.722 119.070 -0.598 0.000 2.423 2160 H HA -0.016 4.540 4.556 -0.000 0.000 0.297 2160 H C 1.001 176.258 175.328 -0.119 0.000 1.075 2160 H CA 1.453 57.298 56.048 -0.339 0.000 1.342 2160 H CB 0.315 29.885 29.762 -0.320 0.000 1.395 2160 H HN 0.423 nan 8.280 nan 0.000 0.530 2161 E N 0.062 120.261 120.200 -0.001 0.000 2.526 2161 E HA -0.012 4.338 4.350 -0.000 0.000 0.208 2161 E C 0.090 176.699 176.600 0.016 0.000 0.997 2161 E CA -0.212 56.199 56.400 0.019 0.000 0.961 2161 E CB 0.051 29.762 29.700 0.018 0.000 1.030 2161 E HN 0.367 nan 8.360 nan 0.000 0.483 2162 N N 0.882 119.581 118.700 -0.003 0.000 2.727 2162 N HA -0.167 4.573 4.740 -0.000 0.000 0.251 2162 N C -0.605 174.928 175.510 0.039 0.000 1.040 2162 N CA 0.642 53.704 53.050 0.021 0.000 0.712 2162 N CB -1.002 37.506 38.487 0.035 0.000 0.912 2162 N HN 0.040 nan 8.380 nan 0.000 0.545 2163 V N -2.524 117.416 119.914 0.043 0.000 2.962 2163 V HA 0.724 4.844 4.120 -0.000 0.000 0.313 2163 V C 0.410 176.565 176.094 0.101 0.000 1.099 2163 V CA -0.924 61.412 62.300 0.060 0.000 0.971 2163 V CB 2.150 33.993 31.823 0.033 0.000 1.028 2163 V HN -0.088 nan 8.190 nan 0.000 0.430 2164 V N 3.382 123.373 119.914 0.128 0.000 2.432 2164 V HA 0.412 4.532 4.120 -0.000 0.000 0.271 2164 V C 0.133 176.351 176.094 0.206 0.000 1.046 2164 V CA -0.175 62.236 62.300 0.184 0.000 0.945 2164 V CB 1.256 33.192 31.823 0.188 0.000 0.992 2164 V HN 0.746 nan 8.190 nan 0.000 0.471 2165 V N 6.164 126.241 119.914 0.272 0.000 2.398 2165 V HA 0.500 4.620 4.120 -0.000 0.000 0.286 2165 V C -0.162 176.185 176.094 0.421 0.000 1.026 2165 V CA -0.503 61.995 62.300 0.330 0.000 0.868 2165 V CB 1.855 33.843 31.823 0.276 0.000 0.982 2165 V HN 0.592 nan 8.190 nan 0.000 0.443 2166 V N 3.904 124.057 119.914 0.397 0.000 2.487 2166 V HA 0.573 4.693 4.120 -0.000 0.000 0.298 2166 V C 0.104 176.436 176.094 0.397 0.000 1.028 2166 V CA -0.497 62.011 62.300 0.348 0.000 0.860 2166 V CB 2.251 34.214 31.823 0.233 0.000 0.991 2166 V HN 1.001 nan 8.190 nan 0.000 0.427 2167 T N 3.519 118.318 114.554 0.408 0.000 2.779 2167 T HA 0.800 5.150 4.350 -0.000 0.000 0.280 2167 T C -0.442 174.454 174.700 0.327 0.000 0.987 2167 T CA -0.514 61.849 62.100 0.438 0.000 0.966 2167 T CB 1.329 70.502 68.868 0.509 0.000 0.933 2167 T HN 0.673 nan 8.240 nan 0.000 0.442 2168 I N 0.269 121.003 120.570 0.272 0.000 2.863 2168 I HA 0.674 4.844 4.170 -0.000 0.000 0.311 2168 I C -0.661 175.684 176.117 0.381 0.000 1.026 2168 I CA -1.264 60.175 61.300 0.232 0.000 1.077 2168 I CB 1.980 39.996 38.000 0.026 0.000 1.262 2168 I HN 0.568 nan 8.210 nan 0.000 0.461 2169 Q N 2.035 122.105 119.800 0.449 0.000 2.399 2169 Q HA 0.573 4.913 4.340 -0.000 0.000 0.276 2169 Q C -1.909 174.394 176.000 0.504 0.000 1.098 2169 Q CA -0.792 55.278 55.803 0.445 0.000 0.827 2169 Q CB 2.822 31.751 28.738 0.319 0.000 1.386 2169 Q HN 0.721 nan 8.270 nan 0.000 0.443 2170 Y N -2.668 117.780 120.300 0.245 0.000 2.581 2170 Y HA 0.513 5.063 4.550 0.000 0.000 0.337 2170 Y C -0.915 175.069 175.900 0.140 0.000 1.108 2170 Y CA -1.442 56.766 58.100 0.181 0.000 1.033 2170 Y CB 0.783 39.312 38.460 0.116 0.000 1.318 2170 Y HN 0.418 nan 8.280 nan 0.000 0.459 2171 R N 2.266 122.850 120.500 0.141 0.000 2.583 2171 R HA 0.332 4.672 4.340 -0.000 0.000 0.274 2171 R C -0.839 175.539 176.300 0.129 0.000 0.998 2171 R CA 0.214 56.359 56.100 0.075 0.000 1.081 2171 R CB 0.186 30.550 30.300 0.106 0.000 0.940 2171 R HN 0.685 nan 8.270 nan 0.000 0.413 2172 L N 1.552 122.875 121.223 0.167 0.000 2.313 2172 L HA 0.486 4.826 4.340 -0.000 0.000 0.268 2172 L C 1.372 178.533 176.870 0.485 0.000 1.010 2172 L CA -0.476 54.554 54.840 0.317 0.000 0.814 2172 L CB 1.457 43.596 42.059 0.132 0.000 1.304 2172 L HN 0.895 nan 8.230 nan 0.000 0.441 2173 G N 0.707 109.783 108.800 0.459 0.000 2.627 2173 G HA2 -0.349 3.611 3.960 -0.000 0.000 0.312 2173 G HA3 -0.349 3.611 3.960 -0.000 0.000 0.312 2173 G C 0.859 175.996 174.900 0.396 0.000 1.299 2173 G CA 0.710 46.013 45.100 0.338 0.000 0.989 2173 G HN 0.659 nan 8.290 nan 0.000 0.547 2174 I N -0.500 120.217 120.570 0.245 0.000 2.118 2174 I HA -0.218 3.952 4.170 -0.000 0.000 0.241 2174 I C 2.858 179.179 176.117 0.339 0.000 1.070 2174 I CA 2.483 63.874 61.300 0.152 0.000 1.327 2174 I CB -0.363 37.473 38.000 -0.274 0.000 1.034 2174 I HN 0.565 nan 8.210 nan 0.000 0.405 2175 W N 0.676 122.153 121.300 0.295 0.000 2.338 2175 W HA -0.131 4.528 4.660 -0.000 0.000 0.304 2175 W C 2.387 179.036 176.519 0.216 0.000 1.212 2175 W CA 1.339 58.778 57.345 0.157 0.000 1.264 2175 W CB -0.950 28.504 29.460 -0.010 0.000 1.142 2175 W HN 0.257 nan 8.180 nan 0.000 0.512 2176 G N -2.254 106.786 108.800 0.399 0.000 2.796 2176 G HA2 0.034 3.994 3.960 -0.000 0.000 0.210 2176 G HA3 0.034 3.994 3.960 -0.000 0.000 0.210 2176 G C 0.655 175.201 174.900 -0.590 0.000 1.146 2176 G CA 0.108 45.175 45.100 -0.055 0.000 0.779 2176 G HN 0.149 nan 8.290 nan 0.000 0.535 2177 F N -0.975 119.198 119.950 0.373 0.000 2.880 2177 F HA 0.398 4.925 4.527 0.000 0.000 0.328 2177 F C 0.115 175.996 175.800 0.135 0.000 1.146 2177 F CA -1.648 56.434 58.000 0.137 0.000 1.135 2177 F CB 0.238 39.240 39.000 0.003 0.000 1.151 2177 F HN -0.008 nan 8.300 nan 0.000 0.523 2178 F N 2.189 122.315 119.950 0.294 0.000 2.571 2178 F HA 0.390 4.917 4.527 0.000 0.000 0.384 2178 F C 0.400 176.250 175.800 0.082 0.000 1.058 2178 F CA 0.291 58.347 58.000 0.093 0.000 1.200 2178 F CB 0.458 39.361 39.000 -0.160 0.000 1.077 2178 F HN -0.088 nan 8.300 nan 0.000 0.558 2179 S N 3.632 118.862 115.700 -0.784 0.000 2.557 2179 S HA 0.341 4.811 4.470 -0.000 0.000 0.291 2179 S C 0.466 174.647 174.600 -0.699 0.000 1.116 2179 S CA -0.080 57.780 58.200 -0.567 0.000 0.992 2179 S CB 1.380 64.405 63.200 -0.292 0.000 1.028 2179 S HN 0.820 nan 8.310 nan 0.000 0.484 2180 T N 0.823 115.120 114.554 -0.428 0.000 3.060 2180 T HA 0.374 4.724 4.350 -0.000 0.000 0.249 2180 T C 1.456 176.081 174.700 -0.125 0.000 1.079 2180 T CA 0.662 62.615 62.100 -0.245 0.000 1.013 2180 T CB -0.031 68.813 68.868 -0.041 0.000 0.975 2180 T HN 1.683 nan 8.240 nan 0.000 0.518 2181 G N 2.067 110.790 108.800 -0.128 0.000 2.176 2181 G HA2 -0.187 3.773 3.960 -0.000 0.000 0.253 2181 G HA3 -0.187 3.773 3.960 -0.000 0.000 0.253 2181 G C -0.264 174.605 174.900 -0.050 0.000 0.979 2181 G CA 0.332 45.381 45.100 -0.085 0.000 0.641 2181 G HN 0.939 nan 8.290 nan 0.000 0.530 2182 D N -1.768 118.615 120.400 -0.029 0.000 2.781 2182 D HA 0.476 5.116 4.640 -0.000 0.000 0.295 2182 D C 1.323 177.601 176.300 -0.038 0.000 1.143 2182 D CA -0.022 53.962 54.000 -0.026 0.000 1.076 2182 D CB -0.249 40.553 40.800 0.002 0.000 1.444 2182 D HN 0.094 nan 8.370 nan 0.000 0.567 2183 E N -0.265 119.863 120.200 -0.119 0.000 2.333 2183 E HA -0.241 4.109 4.350 -0.000 0.000 0.198 2183 E C 0.801 177.322 176.600 -0.132 0.000 1.007 2183 E CA 1.213 57.526 56.400 -0.145 0.000 0.845 2183 E CB -0.581 28.991 29.700 -0.213 0.000 0.766 2183 E HN 0.524 nan 8.360 nan 0.000 0.507 2184 H N 0.308 119.436 119.070 0.098 0.000 2.529 2184 H HA 0.173 4.729 4.556 0.000 0.000 0.277 2184 H C 0.333 175.778 175.328 0.194 0.000 0.999 2184 H CA 1.051 57.173 56.048 0.123 0.000 1.256 2184 H CB 0.485 30.305 29.762 0.096 0.000 1.402 2184 H HN 0.103 nan 8.280 nan 0.000 0.566 2185 S N -0.224 115.652 115.700 0.294 0.000 2.828 2185 S HA 0.175 4.645 4.470 -0.000 0.000 0.149 2185 S C 0.813 175.560 174.600 0.246 0.000 0.924 2185 S CA -0.584 57.876 58.200 0.434 0.000 1.044 2185 S CB 0.162 63.583 63.200 0.369 0.000 1.595 2185 S HN 0.179 nan 8.310 nan 0.000 0.454 2186 R N 1.531 122.135 120.500 0.173 0.000 2.091 2186 R HA 0.157 4.497 4.340 -0.000 0.000 0.238 2186 R C 1.442 177.528 176.300 -0.357 0.000 1.136 2186 R CA 1.314 57.344 56.100 -0.118 0.000 0.959 2186 R CB -0.258 29.958 30.300 -0.140 0.000 0.856 2186 R HN 0.869 nan 8.270 nan 0.000 0.437 2187 G N -0.501 107.794 108.800 -0.842 0.000 2.483 2187 G HA2 -0.210 3.750 3.960 -0.000 0.000 0.521 2187 G HA3 -0.210 3.750 3.960 -0.000 0.000 0.521 2187 G C -0.658 173.487 174.900 -1.259 0.000 1.278 2187 G CA -0.392 44.108 45.100 -0.999 0.000 0.965 2187 G HN 0.255 nan 8.290 nan 0.000 0.504 2188 N N -1.125 117.178 118.700 -0.662 0.000 2.714 2188 N HA -0.204 4.536 4.740 -0.000 0.000 0.250 2188 N C 1.186 176.416 175.510 -0.466 0.000 1.117 2188 N CA 1.975 54.824 53.050 -0.336 0.000 0.719 2188 N CB -1.529 36.919 38.487 -0.066 0.000 1.081 2188 N HN 0.711 nan 8.380 nan 0.000 0.557 2189 W N 0.393 121.553 121.300 -0.233 0.000 2.342 2189 W HA -0.094 4.566 4.660 0.000 0.000 0.297 2189 W C 2.466 178.849 176.519 -0.225 0.000 1.213 2189 W CA 0.788 58.036 57.345 -0.162 0.000 1.251 2189 W CB -0.619 28.785 29.460 -0.092 0.000 1.136 2189 W HN 0.299 nan 8.180 nan 0.000 0.526 2190 G N -0.468 108.074 108.800 -0.432 0.000 2.422 2190 G HA2 -0.236 3.724 3.960 -0.000 0.000 0.218 2190 G HA3 -0.236 3.724 3.960 -0.000 0.000 0.218 2190 G C 1.219 176.106 174.900 -0.023 0.000 1.140 2190 G CA 1.129 46.116 45.100 -0.188 0.000 0.775 2190 G HN 0.286 nan 8.290 nan 0.000 0.545 2191 H N 0.270 119.343 119.070 0.004 0.000 2.428 2191 H HA 0.128 4.684 4.556 0.000 0.000 0.296 2191 H C 2.644 177.968 175.328 -0.007 0.000 1.062 2191 H CA 0.608 56.650 56.048 -0.011 0.000 1.350 2191 H CB -0.161 29.608 29.762 0.011 0.000 1.403 2191 H HN 0.282 nan 8.280 nan 0.000 0.533 2192 L N 0.295 121.607 121.223 0.149 0.000 2.217 2192 L HA -0.114 4.226 4.340 -0.000 0.000 0.211 2192 L C 1.865 178.841 176.870 0.177 0.000 1.107 2192 L CA 0.685 55.613 54.840 0.146 0.000 0.783 2192 L CB -0.125 42.043 42.059 0.181 0.000 0.919 2192 L HN 0.076 nan 8.230 nan 0.000 0.442 2193 D N 0.056 120.579 120.400 0.204 0.000 2.123 2193 D HA -0.159 4.481 4.640 -0.000 0.000 0.200 2193 D C 2.278 178.721 176.300 0.239 0.000 0.976 2193 D CA 1.054 55.238 54.000 0.307 0.000 0.831 2193 D CB -0.070 40.940 40.800 0.349 0.000 0.974 2193 D HN 0.371 nan 8.370 nan 0.000 0.469 2194 Q N 0.259 120.118 119.800 0.098 0.000 2.124 2194 Q HA -0.089 4.251 4.340 -0.000 0.000 0.202 2194 Q C 2.363 178.330 176.000 -0.055 0.000 0.977 2194 Q CA 0.828 56.599 55.803 -0.053 0.000 0.850 2194 Q CB 0.035 28.682 28.738 -0.151 0.000 0.901 2194 Q HN 0.140 nan 8.270 nan 0.000 0.429 2195 V N 0.966 120.889 119.914 0.015 0.000 2.295 2195 V HA -0.270 3.850 4.120 -0.000 0.000 0.246 2195 V C 2.264 178.393 176.094 0.058 0.000 1.049 2195 V CA 1.809 64.126 62.300 0.029 0.000 1.024 2195 V CB -0.986 30.869 31.823 0.053 0.000 0.648 2195 V HN 0.413 nan 8.190 nan 0.000 0.447 2196 A N -0.098 122.794 122.820 0.121 0.000 1.972 2196 A HA -0.082 4.238 4.320 -0.000 0.000 0.219 2196 A C 2.382 180.032 177.584 0.110 0.000 1.169 2196 A CA 1.966 54.122 52.037 0.199 0.000 0.635 2196 A CB -0.625 18.584 19.000 0.348 0.000 0.810 2196 A HN 0.569 nan 8.150 nan 0.000 0.446 2197 A N -0.219 122.455 122.820 -0.243 0.000 1.898 2197 A HA 0.034 4.354 4.320 -0.000 0.000 0.216 2197 A C 2.081 179.590 177.584 -0.125 0.000 1.181 2197 A CA 1.314 52.962 52.037 -0.650 0.000 0.620 2197 A CB -0.515 17.860 19.000 -1.041 0.000 0.819 2197 A HN 0.464 nan 8.150 nan 0.000 0.442 2198 L N -1.256 119.935 121.223 -0.054 0.000 2.201 2198 L HA -0.111 4.229 4.340 -0.000 0.000 0.212 2198 L C 2.681 179.602 176.870 0.085 0.000 1.105 2198 L CA 1.395 56.256 54.840 0.036 0.000 0.775 2198 L CB -0.362 41.717 42.059 0.033 0.000 0.913 2198 L HN 0.372 nan 8.230 nan 0.000 0.440 2199 R N -0.301 120.259 120.500 0.100 0.000 2.090 2199 R HA -0.205 4.135 4.340 -0.000 0.000 0.228 2199 R C 2.096 178.480 176.300 0.141 0.000 1.110 2199 R CA 1.351 57.517 56.100 0.109 0.000 0.973 2199 R CB -0.523 29.853 30.300 0.127 0.000 0.869 2199 R HN 0.399 nan 8.270 nan 0.000 0.440 2200 W N -0.477 120.844 121.300 0.034 0.000 2.388 2200 W HA -0.098 4.562 4.660 -0.000 0.000 0.294 2200 W C 1.531 178.071 176.519 0.034 0.000 1.212 2200 W CA 1.177 58.561 57.345 0.066 0.000 1.271 2200 W CB -0.103 29.429 29.460 0.121 0.000 1.126 2200 W HN -0.113 nan 8.180 nan 0.000 0.535 2201 V N 1.132 121.239 119.914 0.323 0.000 2.343 2201 V HA -0.340 3.780 4.120 -0.000 0.000 0.247 2201 V C 2.548 178.636 176.094 -0.010 0.000 1.051 2201 V CA 2.036 64.450 62.300 0.191 0.000 1.036 2201 V CB -0.929 31.023 31.823 0.215 0.000 0.654 2201 V HN 0.219 nan 8.190 nan 0.000 0.451 2202 Q N -0.187 119.616 119.800 0.005 0.000 2.050 2202 Q HA -0.204 4.136 4.340 -0.000 0.000 0.202 2202 Q C 1.942 177.883 176.000 -0.098 0.000 0.980 2202 Q CA 1.683 57.475 55.803 -0.018 0.000 0.840 2202 Q CB -0.476 28.265 28.738 0.005 0.000 0.898 2202 Q HN 0.661 nan 8.270 nan 0.000 0.424 2203 D N -0.417 119.877 120.400 -0.177 0.000 2.347 2203 D HA -0.006 4.634 4.640 -0.000 0.000 0.213 2203 D C 1.030 177.107 176.300 -0.372 0.000 0.985 2203 D CA 0.427 54.281 54.000 -0.244 0.000 0.879 2203 D CB 0.148 40.802 40.800 -0.243 0.000 0.919 2203 D HN 0.275 nan 8.370 nan 0.000 0.526 2204 N N -0.094 118.279 118.700 -0.546 0.000 2.297 2204 N HA 0.014 4.754 4.740 -0.000 0.000 0.208 2204 N C 1.598 176.952 175.510 -0.260 0.000 1.176 2204 N CA -0.219 52.462 53.050 -0.616 0.000 0.882 2204 N CB 0.849 38.457 38.487 -1.465 0.000 1.134 2204 N HN -0.011 nan 8.380 nan 0.000 0.489 2205 I N 2.719 123.187 120.570 -0.170 0.000 2.399 2205 I HA -0.173 3.997 4.170 -0.000 0.000 0.254 2205 I C 2.186 178.390 176.117 0.145 0.000 1.146 2205 I CA 0.682 62.030 61.300 0.079 0.000 1.412 2205 I CB -0.306 37.744 38.000 0.083 0.000 1.076 2205 I HN 0.075 nan 8.210 nan 0.000 0.432 2206 A N -1.052 121.793 122.820 0.042 0.000 1.978 2206 A HA -0.198 4.122 4.320 -0.000 0.000 0.220 2206 A C 2.422 180.021 177.584 0.024 0.000 1.170 2206 A CA 2.017 54.072 52.037 0.030 0.000 0.636 2206 A CB -0.906 18.084 19.000 -0.018 0.000 0.810 2206 A HN 0.452 nan 8.150 nan 0.000 0.448 2207 S N -1.155 114.541 115.700 -0.007 0.000 2.474 2207 S HA -0.005 4.465 4.470 -0.000 0.000 0.235 2207 S C 0.725 175.160 174.600 -0.275 0.000 0.997 2207 S CA 0.818 58.923 58.200 -0.158 0.000 0.949 2207 S CB -0.372 62.664 63.200 -0.273 0.000 0.766 2207 S HN 0.578 nan 8.310 nan 0.000 0.517 2208 F N 0.591 120.523 119.950 -0.029 0.000 2.639 2208 F HA 0.377 4.904 4.527 -0.000 0.000 0.302 2208 F C 1.621 177.462 175.800 0.068 0.000 1.097 2208 F CA -0.096 57.911 58.000 0.010 0.000 1.294 2208 F CB 0.107 39.109 39.000 0.004 0.000 1.027 2208 F HN 0.217 nan 8.300 nan 0.000 0.550 2209 G N 0.377 109.277 108.800 0.167 0.000 2.132 2209 G HA2 -0.163 3.797 3.960 -0.000 0.000 0.234 2209 G HA3 -0.163 3.797 3.960 -0.000 0.000 0.234 2209 G C 0.533 175.512 174.900 0.132 0.000 0.989 2209 G CA -0.199 44.980 45.100 0.132 0.000 0.676 2209 G HN 0.740 nan 8.290 nan 0.000 0.522 2210 G N -0.593 108.296 108.800 0.148 0.000 2.412 2210 G HA2 0.506 4.466 3.960 -0.000 0.000 0.318 2210 G HA3 0.506 4.466 3.960 -0.000 0.000 0.318 2210 G C -0.319 174.629 174.900 0.078 0.000 1.146 2210 G CA -0.227 44.947 45.100 0.122 0.000 0.882 2210 G HN 0.447 nan 8.290 nan 0.000 0.501 2211 N N 1.674 120.411 118.700 0.062 0.000 2.462 2211 N HA 0.285 5.025 4.740 -0.000 0.000 0.242 2211 N C -1.150 174.385 175.510 0.042 0.000 1.010 2211 N CA -2.501 50.567 53.050 0.031 0.000 0.939 2211 N CB 1.937 40.428 38.487 0.006 0.000 1.127 2211 N HN 0.109 nan 8.380 nan 0.000 0.509 2212 P HA -0.011 nan 4.420 nan 0.000 0.225 2212 P C 0.895 178.259 177.300 0.106 0.000 1.148 2212 P CA 0.678 63.820 63.100 0.070 0.000 0.779 2212 P CB 0.156 31.874 31.700 0.031 0.000 0.780 2213 G N -0.784 108.010 108.800 -0.009 0.000 2.920 2213 G HA2 -0.009 3.951 3.960 -0.000 0.000 0.208 2213 G HA3 -0.009 3.951 3.960 -0.000 0.000 0.208 2213 G C 0.516 175.075 174.900 -0.569 0.000 1.159 2213 G CA 0.151 45.138 45.100 -0.189 0.000 0.784 2213 G HN 0.361 nan 8.290 nan 0.000 0.535 2214 S N 0.117 115.707 115.700 -0.183 0.000 2.293 2214 S HA 0.479 4.949 4.470 -0.000 0.000 0.154 2214 S C -0.936 173.775 174.600 0.184 0.000 1.602 2214 S CA -0.439 57.707 58.200 -0.091 0.000 1.260 2214 S CB 0.418 63.561 63.200 -0.097 0.000 1.270 2214 S HN -0.047 nan 8.310 nan 0.000 0.416 2215 V N 3.432 123.642 119.914 0.493 0.000 2.417 2215 V HA 0.569 4.689 4.120 -0.000 0.000 0.291 2215 V C 0.164 176.406 176.094 0.247 0.000 1.024 2215 V CA -0.475 61.999 62.300 0.290 0.000 0.861 2215 V CB 1.836 33.804 31.823 0.242 0.000 0.985 2215 V HN 0.673 nan 8.190 nan 0.000 0.436 2216 T N 6.262 120.917 114.554 0.169 0.000 2.779 2216 T HA 0.612 4.962 4.350 -0.000 0.000 0.280 2216 T C -0.186 174.619 174.700 0.175 0.000 0.987 2216 T CA -0.186 62.000 62.100 0.144 0.000 0.966 2216 T CB 0.921 69.814 68.868 0.043 0.000 0.933 2216 T HN 0.628 nan 8.240 nan 0.000 0.442 2217 I N 1.760 122.417 120.570 0.145 0.000 2.359 2217 I HA 0.856 5.026 4.170 -0.000 0.000 0.294 2217 I C -0.912 175.365 176.117 0.266 0.000 0.987 2217 I CA -1.015 60.363 61.300 0.129 0.000 1.225 2217 I CB 0.865 38.738 38.000 -0.210 0.000 1.366 2217 I HN 0.472 nan 8.210 nan 0.000 0.466 2218 F N 3.315 123.280 119.950 0.025 0.000 2.613 2218 F HA 1.023 5.550 4.527 0.000 0.000 0.310 2218 F C -0.406 175.304 175.800 -0.150 0.000 1.085 2218 F CA -1.547 56.499 58.000 0.078 0.000 0.945 2218 F CB 1.387 40.569 39.000 0.303 0.000 1.298 2218 F HN 0.837 nan 8.300 nan 0.000 0.455 2219 G N 1.347 109.952 108.800 -0.325 0.000 2.547 2219 G HA2 0.532 4.492 3.960 -0.000 0.000 0.291 2219 G HA3 0.532 4.492 3.960 -0.000 0.000 0.291 2219 G C -2.383 172.258 174.900 -0.431 0.000 1.471 2219 G CA -0.814 43.634 45.100 -1.087 0.000 0.798 2219 G HN 1.084 nan 8.290 nan 0.000 0.504 2220 E N -0.427 119.532 120.200 -0.402 0.000 2.277 2220 E HA 0.797 5.147 4.350 -0.000 0.000 0.266 2220 E C 0.663 177.269 176.600 0.009 0.000 0.901 2220 E CA 0.064 56.446 56.400 -0.029 0.000 0.782 2220 E CB 1.906 31.674 29.700 0.112 0.000 1.228 2220 E HN 1.263 nan 8.360 nan 0.000 0.424 2221 S N 1.300 117.059 115.700 0.098 0.000 4.064 2221 S HA -0.373 4.097 4.470 -0.000 0.000 0.625 2221 S C 1.494 176.192 174.600 0.163 0.000 2.010 2221 S CA 1.952 60.310 58.200 0.265 0.000 4.186 2221 S CB -1.791 61.655 63.200 0.410 0.000 0.211 2221 S HN 1.506 nan 8.310 nan 0.000 0.605 2222 A N 0.843 123.755 122.820 0.154 0.000 2.024 2222 A HA 0.138 4.458 4.320 -0.000 0.000 0.220 2222 A C 2.356 179.918 177.584 -0.037 0.000 1.164 2222 A CA 2.428 54.502 52.037 0.062 0.000 0.643 2222 A CB -1.443 17.605 19.000 0.079 0.000 0.806 2222 A HN 1.522 nan 8.150 nan 0.000 0.451 2223 G N -0.672 108.068 108.800 -0.100 0.000 2.403 2223 G HA2 0.088 4.048 3.960 -0.000 0.000 0.216 2223 G HA3 0.088 4.048 3.960 -0.000 0.000 0.216 2223 G C 1.456 176.197 174.900 -0.264 0.000 1.154 2223 G CA 1.098 46.011 45.100 -0.311 0.000 0.784 2223 G HN 0.654 nan 8.290 nan 0.000 0.538 2224 G N 0.238 108.956 108.800 -0.138 0.000 2.421 2224 G HA2 -0.123 3.837 3.960 -0.000 0.000 0.217 2224 G HA3 -0.123 3.837 3.960 -0.000 0.000 0.217 2224 G C 1.548 176.427 174.900 -0.035 0.000 1.143 2224 G CA 1.054 46.120 45.100 -0.058 0.000 0.784 2224 G HN 0.434 nan 8.290 nan 0.000 0.541 2225 E N 1.000 121.183 120.200 -0.027 0.000 2.107 2225 E HA -0.077 4.272 4.350 -0.000 0.000 0.191 2225 E C 2.500 179.045 176.600 -0.092 0.000 0.982 2225 E CA 1.042 57.420 56.400 -0.036 0.000 0.809 2225 E CB -0.178 29.510 29.700 -0.020 0.000 0.756 2225 E HN 0.334 nan 8.360 nan 0.000 0.459 2226 S N 0.302 115.936 115.700 -0.110 0.000 2.356 2226 S HA -0.122 4.348 4.470 -0.000 0.000 0.223 2226 S C 2.149 176.597 174.600 -0.252 0.000 1.032 2226 S CA 1.168 59.274 58.200 -0.157 0.000 1.005 2226 S CB -0.280 62.794 63.200 -0.210 0.000 0.867 2226 S HN 0.132 nan 8.310 nan 0.000 0.449 2227 V N 1.339 121.107 119.914 -0.243 0.000 2.287 2227 V HA -0.182 3.938 4.120 -0.000 0.000 0.248 2227 V C 2.611 178.544 176.094 -0.268 0.000 1.053 2227 V CA 2.047 64.175 62.300 -0.288 0.000 1.027 2227 V CB -0.822 30.883 31.823 -0.198 0.000 0.646 2227 V HN 0.548 nan 8.190 nan 0.000 0.447 2228 S N -0.720 114.905 115.700 -0.125 0.000 2.370 2228 S HA -0.175 4.295 4.470 -0.000 0.000 0.226 2228 S C 1.968 176.484 174.600 -0.140 0.000 1.033 2228 S CA 1.843 60.013 58.200 -0.051 0.000 1.011 2228 S CB -0.189 63.036 63.200 0.041 0.000 0.852 2228 S HN 0.332 nan 8.310 nan 0.000 0.457 2229 V N 2.158 121.948 119.914 -0.206 0.000 2.261 2229 V HA -0.159 3.961 4.120 -0.000 0.000 0.246 2229 V C 2.393 178.335 176.094 -0.253 0.000 1.047 2229 V CA 1.964 64.103 62.300 -0.269 0.000 1.015 2229 V CB -0.704 30.832 31.823 -0.477 0.000 0.642 2229 V HN 0.490 nan 8.190 nan 0.000 0.446 2230 L N -0.428 120.621 121.223 -0.289 0.000 2.079 2230 L HA -0.182 4.158 4.340 -0.000 0.000 0.210 2230 L C 2.466 179.275 176.870 -0.100 0.000 1.081 2230 L CA 1.127 55.824 54.840 -0.239 0.000 0.752 2230 L CB -0.755 41.064 42.059 -0.401 0.000 0.896 2230 L HN 0.206 nan 8.230 nan 0.000 0.433 2231 V N 0.141 119.963 119.914 -0.153 0.000 2.469 2231 V HA -0.257 3.863 4.120 -0.000 0.000 0.251 2231 V C 2.058 178.133 176.094 -0.031 0.000 1.064 2231 V CA 1.558 63.865 62.300 0.011 0.000 1.066 2231 V CB -0.277 31.413 31.823 -0.222 0.000 0.667 2231 V HN 0.404 nan 8.190 nan 0.000 0.461 2232 L N -1.009 120.152 121.223 -0.105 0.000 2.607 2232 L HA 0.208 4.548 4.340 -0.000 0.000 0.228 2232 L C 1.036 177.816 176.870 -0.150 0.000 1.123 2232 L CA 0.124 54.867 54.840 -0.161 0.000 0.890 2232 L CB 0.253 42.229 42.059 -0.137 0.000 1.103 2232 L HN 0.193 nan 8.230 nan 0.000 0.468 2233 S N 0.646 116.284 115.700 -0.103 0.000 2.508 2233 S HA 0.325 4.795 4.470 -0.000 0.000 0.284 2233 S C -1.391 173.175 174.600 -0.057 0.000 1.192 2233 S CA -1.485 56.664 58.200 -0.086 0.000 1.070 2233 S CB 1.167 64.315 63.200 -0.088 0.000 1.004 2233 S HN -0.050 nan 8.310 nan 0.000 0.493 2234 P HA -0.023 nan 4.420 nan 0.000 0.223 2234 P C 1.288 178.569 177.300 -0.032 0.000 1.151 2234 P CA 0.706 63.776 63.100 -0.049 0.000 0.787 2234 P CB 0.092 31.765 31.700 -0.044 0.000 0.788 2235 L N -0.824 120.387 121.223 -0.021 0.000 2.376 2235 L HA 0.032 4.372 4.340 -0.000 0.000 0.219 2235 L C 2.105 178.983 176.870 0.012 0.000 1.133 2235 L CA 1.002 55.840 54.840 -0.003 0.000 0.816 2235 L CB -0.492 41.569 42.059 0.003 0.000 0.933 2235 L HN -0.043 nan 8.230 nan 0.000 0.449 2236 A N -1.762 121.077 122.820 0.032 0.000 2.503 2236 A HA 0.111 4.431 4.320 -0.000 0.000 0.263 2236 A C 1.677 179.292 177.584 0.052 0.000 1.258 2236 A CA -0.285 51.813 52.037 0.101 0.000 0.936 2236 A CB 0.049 19.168 19.000 0.198 0.000 1.070 2236 A HN -0.054 nan 8.150 nan 0.000 0.522 2237 K N 1.570 121.933 120.400 -0.062 0.000 2.030 2237 K HA -0.176 4.144 4.320 -0.000 0.000 0.222 2237 K C 0.313 176.693 176.600 -0.367 0.000 1.056 2237 K CA 1.643 57.808 56.287 -0.202 0.000 0.957 2237 K CB -0.278 32.114 32.500 -0.180 0.000 0.727 2237 K HN 0.533 nan 8.250 nan 0.000 0.452 2238 N N 0.682 119.221 118.700 -0.269 0.000 2.320 2238 N HA 0.088 4.828 4.740 -0.000 0.000 0.237 2238 N C 0.916 176.291 175.510 -0.225 0.000 1.129 2238 N CA 0.085 52.962 53.050 -0.288 0.000 0.854 2238 N CB 0.472 38.846 38.487 -0.188 0.000 1.083 2238 N HN 0.170 nan 8.380 nan 0.000 0.504 2239 L N -0.385 120.733 121.223 -0.175 0.000 2.585 2239 L HA 0.285 4.625 4.340 -0.000 0.000 0.226 2239 L C -0.228 176.651 176.870 0.015 0.000 1.113 2239 L CA 0.207 55.034 54.840 -0.021 0.000 0.876 2239 L CB -0.171 41.952 42.059 0.106 0.000 1.072 2239 L HN 0.025 nan 8.230 nan 0.000 0.468 2240 F N -4.086 115.631 119.950 -0.388 0.000 2.686 2240 F HA 0.466 4.993 4.527 -0.000 0.000 0.311 2240 F C 0.321 175.731 175.800 -0.650 0.000 1.128 2240 F CA -1.014 56.728 58.000 -0.429 0.000 0.946 2240 F CB 0.811 39.708 39.000 -0.171 0.000 1.336 2240 F HN -0.124 nan 8.300 nan 0.000 0.457 2241 H N -0.345 118.778 119.070 0.088 0.000 3.360 2241 H HA 0.447 5.003 4.556 0.000 0.000 0.262 2241 H C -0.420 174.925 175.328 0.027 0.000 1.149 2241 H CA -0.171 55.869 56.048 -0.014 0.000 1.181 2241 H CB 0.881 30.628 29.762 -0.025 0.000 1.564 2241 H HN 0.490 nan 8.280 nan 0.000 0.565 2242 R N 0.403 121.034 120.500 0.218 0.000 2.707 2242 R HA 0.702 5.042 4.340 -0.000 0.000 0.272 2242 R C -1.345 175.127 176.300 0.286 0.000 1.011 2242 R CA -0.450 55.731 56.100 0.136 0.000 0.893 2242 R CB 2.384 32.581 30.300 -0.172 0.000 1.233 2242 R HN 0.173 nan 8.270 nan 0.000 0.464 2243 A N 2.067 125.083 122.820 0.328 0.000 2.515 2243 A HA 0.845 5.165 4.320 -0.000 0.000 0.298 2243 A C -1.326 176.457 177.584 0.330 0.000 1.059 2243 A CA -0.649 51.489 52.037 0.167 0.000 0.698 2243 A CB 1.229 20.089 19.000 -0.234 0.000 1.289 2243 A HN 0.578 nan 8.150 nan 0.000 0.404 2244 I N 1.107 121.826 120.570 0.249 0.000 2.512 2244 I HA 0.336 4.506 4.170 -0.000 0.000 0.287 2244 I C -0.384 175.880 176.117 0.245 0.000 1.069 2244 I CA -0.304 61.114 61.300 0.197 0.000 1.056 2244 I CB 2.449 40.477 38.000 0.046 0.000 1.229 2244 I HN 0.475 nan 8.210 nan 0.000 0.429 2245 S N 4.926 120.757 115.700 0.218 0.000 2.498 2245 S HA 0.360 4.830 4.470 -0.000 0.000 0.324 2245 S C -0.529 174.133 174.600 0.103 0.000 1.071 2245 S CA -0.617 57.668 58.200 0.141 0.000 1.113 2245 S CB 0.914 64.190 63.200 0.127 0.000 0.976 2245 S HN 0.479 nan 8.310 nan 0.000 0.462 2246 E N 1.775 122.075 120.200 0.167 0.000 2.081 2246 E HA 0.349 4.699 4.350 -0.000 0.000 0.276 2246 E C -0.335 176.316 176.600 0.085 0.000 0.950 2246 E CA -0.499 56.029 56.400 0.213 0.000 0.776 2246 E CB 0.960 30.877 29.700 0.361 0.000 1.094 2246 E HN 0.611 nan 8.360 nan 0.000 0.402 2247 S N 2.039 117.757 115.700 0.031 0.000 3.628 2247 S HA -0.139 4.331 4.470 -0.000 0.000 0.373 2247 S C 0.035 174.763 174.600 0.214 0.000 0.968 2247 S CA 0.547 58.748 58.200 0.002 0.000 1.215 2247 S CB -1.142 61.937 63.200 -0.202 0.000 0.912 2247 S HN 0.947 nan 8.310 nan 0.000 0.495 2248 G N -1.010 107.930 108.800 0.234 0.000 2.270 2248 G HA2 0.506 4.466 3.960 -0.000 0.000 0.295 2248 G HA3 0.506 4.466 3.960 -0.000 0.000 0.295 2248 G C -0.890 174.069 174.900 0.098 0.000 1.732 2248 G CA 0.069 45.319 45.100 0.251 0.000 0.909 2248 G HN 1.471 nan 8.290 nan 0.000 0.730 2249 V N -0.998 118.946 119.914 0.051 0.000 3.165 2249 V HA 0.928 5.048 4.120 -0.000 0.000 0.309 2249 V C 1.232 177.308 176.094 -0.031 0.000 1.267 2249 V CA -0.125 62.180 62.300 0.009 0.000 1.067 2249 V CB 1.165 32.980 31.823 -0.013 0.000 1.082 2249 V HN 2.158 nan 8.190 nan 0.000 0.451 2250 A N -0.403 122.394 122.820 -0.038 0.000 2.239 2250 A HA 0.254 4.574 4.320 -0.000 0.000 0.209 2250 A C 1.439 178.970 177.584 -0.089 0.000 1.171 2250 A CA 1.082 53.076 52.037 -0.072 0.000 0.768 2250 A CB -0.687 18.267 19.000 -0.077 0.000 0.790 2250 A HN 0.786 nan 8.150 nan 0.000 0.478 2251 L N -0.439 120.730 121.223 -0.090 0.000 2.607 2251 L HA 0.050 4.390 4.340 -0.000 0.000 0.228 2251 L C 0.258 177.022 176.870 -0.176 0.000 1.123 2251 L CA 0.146 54.912 54.840 -0.123 0.000 0.890 2251 L CB -0.147 41.851 42.059 -0.103 0.000 1.103 2251 L HN 0.121 nan 8.230 nan 0.000 0.468 2252 T N 0.662 115.112 114.554 -0.174 0.000 3.474 2252 T HA 0.011 4.361 4.350 -0.000 0.000 0.270 2252 T C 1.556 176.114 174.700 -0.236 0.000 1.079 2252 T CA 0.300 62.249 62.100 -0.252 0.000 1.110 2252 T CB 0.373 69.103 68.868 -0.230 0.000 1.087 2252 T HN 0.410 nan 8.240 nan 0.000 0.784 2253 S N 2.307 117.851 115.700 -0.259 0.000 2.409 2253 S HA -0.188 4.282 4.470 -0.000 0.000 0.237 2253 S C 2.114 176.590 174.600 -0.207 0.000 1.060 2253 S CA 1.496 59.553 58.200 -0.238 0.000 1.052 2253 S CB -0.780 62.246 63.200 -0.291 0.000 0.871 2253 S HN 0.482 nan 8.310 nan 0.000 0.465 2254 V N 0.946 120.726 119.914 -0.222 0.000 2.828 2254 V HA 0.026 4.146 4.120 -0.000 0.000 0.260 2254 V C 1.927 177.938 176.094 -0.138 0.000 1.101 2254 V CA 1.706 63.903 62.300 -0.171 0.000 1.123 2254 V CB -0.506 31.216 31.823 -0.168 0.000 0.704 2254 V HN 0.637 nan 8.190 nan 0.000 0.493 2255 L N -0.827 120.310 121.223 -0.144 0.000 2.554 2255 L HA 0.229 4.569 4.340 -0.000 0.000 0.225 2255 L C 0.216 177.004 176.870 -0.138 0.000 1.104 2255 L CA -0.018 54.739 54.840 -0.138 0.000 0.866 2255 L CB 0.729 42.719 42.059 -0.115 0.000 1.047 2255 L HN 0.063 nan 8.230 nan 0.000 0.468 2256 V N 1.158 120.996 119.914 -0.126 0.000 2.378 2256 V HA 0.259 4.379 4.120 -0.000 0.000 0.288 2256 V C -0.166 175.868 176.094 -0.101 0.000 1.016 2256 V CA -0.940 61.296 62.300 -0.107 0.000 0.840 2256 V CB 1.570 33.330 31.823 -0.106 0.000 0.994 2256 V HN 0.028 nan 8.190 nan 0.000 0.431 2257 K N 4.710 125.059 120.400 -0.085 0.000 2.292 2257 K HA 0.335 4.655 4.320 -0.000 0.000 0.290 2257 K C -0.236 176.325 176.600 -0.066 0.000 1.083 2257 K CA -0.585 55.659 56.287 -0.072 0.000 0.918 2257 K CB 1.022 33.483 32.500 -0.065 0.000 1.089 2257 K HN 0.630 nan 8.250 nan 0.000 0.473 2258 K N 0.691 121.053 120.400 -0.063 0.000 2.123 2258 K HA 0.742 5.062 4.320 -0.000 0.000 0.259 2258 K C 0.651 177.227 176.600 -0.039 0.000 0.960 2258 K CA -0.610 55.643 56.287 -0.056 0.000 0.872 2258 K CB 1.221 33.683 32.500 -0.065 0.000 1.079 2258 K HN 0.619 nan 8.250 nan 0.000 0.440 2259 G N 0.843 109.622 108.800 -0.035 0.000 2.482 2259 G HA2 -0.167 3.793 3.960 -0.000 0.000 0.214 2259 G HA3 -0.167 3.793 3.960 -0.000 0.000 0.214 2259 G C -1.495 173.388 174.900 -0.028 0.000 1.271 2259 G CA -0.201 44.884 45.100 -0.024 0.000 0.944 2259 G HN 0.868 nan 8.290 nan 0.000 0.568 2260 D N 0.372 120.760 120.400 -0.021 0.000 2.295 2260 D HA 0.449 5.089 4.640 -0.000 0.000 0.248 2260 D C 1.660 177.941 176.300 -0.033 0.000 1.154 2260 D CA 0.489 54.474 54.000 -0.026 0.000 0.857 2260 D CB 1.361 42.151 40.800 -0.016 0.000 1.117 2260 D HN 1.211 nan 8.370 nan 0.000 0.468 2261 V N 2.022 121.905 119.914 -0.052 0.000 3.650 2261 V HA 0.138 4.258 4.120 -0.000 0.000 0.271 2261 V C 2.024 178.071 176.094 -0.078 0.000 1.281 2261 V CA 0.258 62.517 62.300 -0.070 0.000 1.120 2261 V CB -0.275 31.487 31.823 -0.103 0.000 0.856 2261 V HN 0.317 nan 8.190 nan 0.000 0.443 2262 K N 2.212 122.576 120.400 -0.060 0.000 2.074 2262 K HA -0.084 4.236 4.320 -0.000 0.000 0.209 2262 K C -0.180 176.403 176.600 -0.028 0.000 1.048 2262 K CA 2.523 58.781 56.287 -0.048 0.000 0.926 2262 K CB -1.623 30.863 32.500 -0.024 0.000 0.713 2262 K HN 0.449 nan 8.250 nan 0.000 0.444 2263 P HA -0.150 nan 4.420 nan 0.000 0.215 2263 P C 1.255 178.561 177.300 0.011 0.000 1.157 2263 P CA 0.992 64.092 63.100 0.001 0.000 0.868 2263 P CB -0.034 31.667 31.700 0.001 0.000 0.788 2264 L N -0.303 120.923 121.223 0.006 0.000 2.046 2264 L HA -0.120 4.220 4.340 -0.000 0.000 0.208 2264 L C 2.189 179.089 176.870 0.051 0.000 1.077 2264 L CA 2.079 56.939 54.840 0.034 0.000 0.747 2264 L CB -1.566 40.510 42.059 0.029 0.000 0.896 2264 L HN -0.122 nan 8.230 nan 0.000 0.432 2265 A N -0.786 122.025 122.820 -0.015 0.000 1.908 2265 A HA -0.240 4.080 4.320 -0.000 0.000 0.218 2265 A C 2.181 179.854 177.584 0.148 0.000 1.181 2265 A CA 1.906 53.951 52.037 0.013 0.000 0.627 2265 A CB -0.650 18.232 19.000 -0.197 0.000 0.818 2265 A HN 0.624 nan 8.150 nan 0.000 0.445 2266 E N -0.891 119.354 120.200 0.075 0.000 2.077 2266 E HA -0.252 4.098 4.350 -0.000 0.000 0.193 2266 E C 2.271 178.911 176.600 0.067 0.000 0.989 2266 E CA 1.295 57.737 56.400 0.070 0.000 0.800 2266 E CB -0.173 29.550 29.700 0.039 0.000 0.746 2266 E HN 0.832 nan 8.360 nan 0.000 0.452 2267 Q N 0.851 120.687 119.800 0.062 0.000 2.124 2267 Q HA -0.177 4.163 4.340 -0.000 0.000 0.202 2267 Q C 2.131 178.171 176.000 0.066 0.000 0.977 2267 Q CA 1.201 57.033 55.803 0.049 0.000 0.850 2267 Q CB -0.006 28.757 28.738 0.042 0.000 0.901 2267 Q HN 0.302 nan 8.270 nan 0.000 0.429 2268 I N 0.520 121.164 120.570 0.123 0.000 2.252 2268 I HA -0.230 3.940 4.170 -0.000 0.000 0.245 2268 I C 2.441 178.602 176.117 0.073 0.000 1.102 2268 I CA 0.886 62.271 61.300 0.142 0.000 1.385 2268 I CB -0.435 37.731 38.000 0.277 0.000 1.064 2268 I HN 0.312 nan 8.210 nan 0.000 0.414 2269 A N 1.153 124.025 122.820 0.087 0.000 1.877 2269 A HA -0.165 4.155 4.320 -0.000 0.000 0.216 2269 A C 2.276 179.863 177.584 0.004 0.000 1.186 2269 A CA 1.406 53.454 52.037 0.019 0.000 0.620 2269 A CB -0.792 18.238 19.000 0.050 0.000 0.822 2269 A HN 0.356 nan 8.150 nan 0.000 0.443 2270 I N -0.333 120.248 120.570 0.019 0.000 2.226 2270 I HA -0.230 3.940 4.170 -0.000 0.000 0.245 2270 I C 2.478 178.594 176.117 -0.002 0.000 1.100 2270 I CA 1.762 63.066 61.300 0.007 0.000 1.374 2270 I CB -0.569 37.437 38.000 0.010 0.000 1.057 2270 I HN 0.257 nan 8.210 nan 0.000 0.413 2271 T N 0.607 115.161 114.554 -0.000 0.000 2.867 2271 T HA -0.071 4.279 4.350 -0.000 0.000 0.268 2271 T C 1.847 176.537 174.700 -0.016 0.000 1.057 2271 T CA 1.301 63.395 62.100 -0.010 0.000 1.136 2271 T CB -0.187 68.674 68.868 -0.012 0.000 0.874 2271 T HN 0.468 nan 8.240 nan 0.000 0.466 2272 A N 0.369 123.176 122.820 -0.022 0.000 2.206 2272 A HA 0.494 4.814 4.320 -0.000 0.000 0.211 2272 A C 1.812 179.376 177.584 -0.033 0.000 1.158 2272 A CA 0.817 52.832 52.037 -0.036 0.000 0.761 2272 A CB -0.656 18.303 19.000 -0.068 0.000 0.801 2272 A HN 0.751 nan 8.150 nan 0.000 0.473 2273 G N -2.085 106.701 108.800 -0.025 0.000 2.140 2273 G HA2 -0.202 3.758 3.960 -0.000 0.000 0.211 2273 G HA3 -0.202 3.758 3.960 -0.000 0.000 0.211 2273 G C -0.024 174.862 174.900 -0.023 0.000 1.013 2273 G CA -0.087 45.001 45.100 -0.021 0.000 0.705 2273 G HN 0.595 nan 8.290 nan 0.000 0.508 2274 c N 0.416 119.001 118.600 -0.025 0.000 2.391 2274 c HA 0.682 5.252 4.570 -0.000 0.000 0.339 2274 c C 0.963 175.049 174.090 -0.007 0.000 1.205 2274 c CA -0.941 55.375 56.329 -0.023 0.000 1.937 2274 c CB 1.417 43.903 42.510 -0.041 0.000 2.341 2274 c HN 0.512 nan 8.230 nan 0.000 0.516 2275 K N 0.800 121.199 120.400 -0.001 0.000 2.219 2275 K HA 0.302 4.622 4.320 -0.000 0.000 0.258 2275 K C 0.735 177.343 176.600 0.013 0.000 1.008 2275 K CA 0.256 56.547 56.287 0.006 0.000 0.928 2275 K CB 0.508 33.013 32.500 0.008 0.000 0.983 2275 K HN 0.872 nan 8.250 nan 0.000 0.484 2276 T N -2.421 112.143 114.554 0.016 0.000 3.266 2276 T HA 0.064 4.414 4.350 -0.000 0.000 0.278 2276 T C 1.025 175.735 174.700 0.018 0.000 1.010 2276 T CA -0.456 61.658 62.100 0.023 0.000 0.909 2276 T CB 0.081 68.965 68.868 0.027 0.000 1.122 2276 T HN 0.439 nan 8.240 nan 0.000 0.536 2277 T N 2.523 117.084 114.554 0.012 0.000 2.665 2277 T HA -0.036 4.314 4.350 -0.000 0.000 0.268 2277 T C 1.208 175.910 174.700 0.004 0.000 1.035 2277 T CA 1.912 64.016 62.100 0.007 0.000 1.151 2277 T CB -0.357 68.512 68.868 0.002 0.000 0.862 2277 T HN 0.827 nan 8.240 nan 0.000 0.438 2278 T N -2.073 112.481 114.554 -0.000 0.000 2.864 2278 T HA 0.499 4.849 4.350 -0.000 0.000 0.299 2278 T C 0.946 175.641 174.700 -0.007 0.000 1.166 2278 T CA -0.428 61.665 62.100 -0.012 0.000 1.007 2278 T CB 1.808 70.648 68.868 -0.047 0.000 1.219 2278 T HN -0.155 nan 8.240 nan 0.000 0.506 2279 S N 0.573 116.271 115.700 -0.004 0.000 2.345 2279 S HA 0.016 4.486 4.470 -0.000 0.000 0.220 2279 S C 2.512 177.095 174.600 -0.029 0.000 1.031 2279 S CA 1.360 59.584 58.200 0.040 0.000 0.996 2279 S CB -0.982 62.311 63.200 0.154 0.000 0.882 2279 S HN 0.962 nan 8.310 nan 0.000 0.445 2280 A N 1.015 123.664 122.820 -0.286 0.000 1.978 2280 A HA -0.079 4.241 4.320 -0.000 0.000 0.220 2280 A C 2.305 179.847 177.584 -0.069 0.000 1.170 2280 A CA 1.552 53.399 52.037 -0.317 0.000 0.636 2280 A CB -0.849 17.802 19.000 -0.581 0.000 0.810 2280 A HN 0.352 nan 8.150 nan 0.000 0.448 2281 V N -0.321 119.564 119.914 -0.048 0.000 2.307 2281 V HA -0.293 3.827 4.120 -0.000 0.000 0.245 2281 V C 2.620 178.743 176.094 0.048 0.000 1.045 2281 V CA 2.144 64.458 62.300 0.023 0.000 1.024 2281 V CB -0.657 31.170 31.823 0.006 0.000 0.651 2281 V HN 0.581 nan 8.190 nan 0.000 0.449 2282 M N -0.603 119.020 119.600 0.038 0.000 2.080 2282 M HA -0.184 4.296 4.480 -0.000 0.000 0.260 2282 M C 2.219 178.516 176.300 -0.006 0.000 1.068 2282 M CA 1.783 57.106 55.300 0.037 0.000 1.109 2282 M CB -0.536 32.131 32.600 0.112 0.000 1.342 2282 M HN 0.239 nan 8.290 nan 0.000 0.405 2283 V N -0.660 119.284 119.914 0.050 0.000 2.295 2283 V HA -0.298 3.822 4.120 -0.000 0.000 0.246 2283 V C 2.285 178.419 176.094 0.065 0.000 1.049 2283 V CA 2.394 64.710 62.300 0.027 0.000 1.024 2283 V CB -1.034 30.875 31.823 0.144 0.000 0.648 2283 V HN 0.494 nan 8.190 nan 0.000 0.447 2284 H N -0.759 118.314 119.070 0.004 0.000 2.387 2284 H HA -0.214 4.342 4.556 -0.000 0.000 0.299 2284 H C 2.314 177.637 175.328 -0.008 0.000 1.090 2284 H CA 2.205 58.256 56.048 0.005 0.000 1.332 2284 H CB -0.586 29.169 29.762 -0.011 0.000 1.386 2284 H HN 0.479 nan 8.280 nan 0.000 0.516 2285 c N -0.252 118.278 118.600 -0.116 0.000 2.446 2285 c HA -0.020 4.550 4.570 -0.000 0.000 0.277 2285 c C 2.756 176.752 174.090 -0.157 0.000 1.275 2285 c CA 0.760 56.991 56.329 -0.164 0.000 1.727 2285 c CB -1.400 41.068 42.510 -0.071 0.000 2.010 2285 c HN 0.659 nan 8.230 nan 0.000 0.486 2286 L N 0.268 121.408 121.223 -0.138 0.000 2.191 2286 L HA -0.087 4.253 4.340 -0.000 0.000 0.212 2286 L C 2.941 179.797 176.870 -0.023 0.000 1.103 2286 L CA 1.325 56.090 54.840 -0.126 0.000 0.769 2286 L CB -0.662 41.212 42.059 -0.309 0.000 0.908 2286 L HN 0.354 nan 8.230 nan 0.000 0.438 2287 R N -0.297 120.196 120.500 -0.011 0.000 2.189 2287 R HA -0.119 4.221 4.340 -0.000 0.000 0.218 2287 R C 1.960 178.180 176.300 -0.133 0.000 1.074 2287 R CA 0.839 56.900 56.100 -0.065 0.000 0.991 2287 R CB -0.016 30.264 30.300 -0.033 0.000 0.883 2287 R HN 0.501 nan 8.270 nan 0.000 0.457 2288 Q N -0.058 119.636 119.800 -0.176 0.000 2.425 2288 Q HA 0.046 4.386 4.340 -0.000 0.000 0.204 2288 Q C -0.106 175.833 176.000 -0.101 0.000 0.933 2288 Q CA 0.371 56.079 55.803 -0.157 0.000 0.939 2288 Q CB 0.483 29.094 28.738 -0.212 0.000 1.044 2288 Q HN -0.050 nan 8.270 nan 0.000 0.513 2289 K N 1.958 122.303 120.400 -0.093 0.000 2.295 2289 K HA 0.093 4.413 4.320 -0.000 0.000 0.270 2289 K C 0.423 177.004 176.600 -0.032 0.000 1.011 2289 K CA 0.077 56.327 56.287 -0.062 0.000 0.953 2289 K CB 0.744 33.201 32.500 -0.071 0.000 0.956 2289 K HN 0.128 nan 8.250 nan 0.000 0.477 2290 T N -2.328 112.223 114.554 -0.006 0.000 2.828 2290 T HA 0.039 4.389 4.350 -0.000 0.000 0.290 2290 T C 1.340 176.090 174.700 0.083 0.000 1.019 2290 T CA -0.515 61.599 62.100 0.023 0.000 1.031 2290 T CB 1.056 69.935 68.868 0.018 0.000 1.001 2290 T HN 0.644 nan 8.240 nan 0.000 0.531 2291 E N 0.115 120.387 120.200 0.119 0.000 2.058 2291 E HA -0.263 4.087 4.350 -0.000 0.000 0.194 2291 E C 1.923 178.664 176.600 0.236 0.000 0.997 2291 E CA 1.281 57.825 56.400 0.240 0.000 0.801 2291 E CB -0.103 29.660 29.700 0.105 0.000 0.746 2291 E HN 0.759 nan 8.360 nan 0.000 0.450 2292 E N 0.658 120.930 120.200 0.119 0.000 2.085 2292 E HA -0.236 4.114 4.350 -0.000 0.000 0.194 2292 E C 1.887 178.547 176.600 0.100 0.000 0.994 2292 E CA 1.419 57.876 56.400 0.095 0.000 0.801 2292 E CB -0.023 29.705 29.700 0.048 0.000 0.743 2292 E HN 0.418 nan 8.360 nan 0.000 0.453 2293 E N 0.075 120.320 120.200 0.075 0.000 2.072 2293 E HA -0.122 4.228 4.350 -0.000 0.000 0.191 2293 E C 2.339 178.966 176.600 0.046 0.000 0.985 2293 E CA 0.789 57.215 56.400 0.044 0.000 0.801 2293 E CB -0.043 29.664 29.700 0.011 0.000 0.750 2293 E HN 0.249 nan 8.360 nan 0.000 0.452 2294 L N 0.542 121.801 121.223 0.061 0.000 2.201 2294 L HA -0.140 4.200 4.340 -0.000 0.000 0.212 2294 L C 2.433 179.371 176.870 0.114 0.000 1.105 2294 L CA 0.203 55.019 54.840 -0.039 0.000 0.775 2294 L CB -0.217 41.670 42.059 -0.287 0.000 0.913 2294 L HN 0.213 nan 8.230 nan 0.000 0.440 2295 L N 0.005 121.420 121.223 0.320 0.000 2.093 2295 L HA -0.157 4.183 4.340 -0.000 0.000 0.208 2295 L C 2.310 179.293 176.870 0.189 0.000 1.085 2295 L CA 1.732 56.786 54.840 0.357 0.000 0.755 2295 L CB -0.422 41.800 42.059 0.273 0.000 0.904 2295 L HN 0.198 nan 8.230 nan 0.000 0.435 2296 E N -1.306 118.965 120.200 0.118 0.000 2.152 2296 E HA -0.150 4.200 4.350 -0.000 0.000 0.192 2296 E C 1.893 178.524 176.600 0.051 0.000 0.983 2296 E CA 1.456 57.898 56.400 0.069 0.000 0.818 2296 E CB -0.164 29.562 29.700 0.044 0.000 0.758 2296 E HN 0.488 nan 8.360 nan 0.000 0.467 2297 T N 0.548 115.130 114.554 0.048 0.000 2.821 2297 T HA -0.107 4.243 4.350 -0.000 0.000 0.267 2297 T C 1.998 176.734 174.700 0.061 0.000 1.046 2297 T CA 1.484 63.600 62.100 0.026 0.000 1.139 2297 T CB -0.262 68.606 68.868 0.001 0.000 0.871 2297 T HN 0.160 nan 8.240 nan 0.000 0.454 2298 T N 2.332 116.968 114.554 0.137 0.000 2.708 2298 T HA -0.032 4.318 4.350 -0.000 0.000 0.266 2298 T C 1.820 176.612 174.700 0.153 0.000 1.037 2298 T CA 0.793 63.053 62.100 0.267 0.000 1.146 2298 T CB -0.356 68.727 68.868 0.358 0.000 0.865 2298 T HN 0.080 nan 8.240 nan 0.000 0.435 2299 L N 1.045 122.330 121.223 0.104 0.000 2.083 2299 L HA 0.008 4.348 4.340 -0.000 0.000 0.209 2299 L C 2.317 179.172 176.870 -0.025 0.000 1.083 2299 L CA 1.631 56.499 54.840 0.048 0.000 0.752 2299 L CB -0.652 41.437 42.059 0.049 0.000 0.899 2299 L HN 0.212 nan 8.230 nan 0.000 0.433 2300 K N -1.420 118.957 120.400 -0.039 0.000 2.057 2300 K HA -0.122 4.198 4.320 -0.000 0.000 0.206 2300 K C 2.008 178.513 176.600 -0.160 0.000 1.050 2300 K CA 1.054 57.296 56.287 -0.075 0.000 0.935 2300 K CB -0.197 32.271 32.500 -0.052 0.000 0.715 2300 K HN 0.185 nan 8.250 nan 0.000 0.439 2301 M N 0.865 120.305 119.600 -0.267 0.000 2.202 2301 M HA -0.124 4.356 4.480 -0.000 0.000 0.262 2301 M C 0.607 176.567 176.300 -0.567 0.000 1.063 2301 M CA 1.141 56.114 55.300 -0.544 0.000 1.097 2301 M CB -0.844 31.080 32.600 -1.126 0.000 1.382 2301 M HN 0.147 nan 8.290 nan 0.000 0.413 2302 K N 0.587 120.755 120.400 -0.386 0.000 3.372 2302 K HA -0.170 4.150 4.320 -0.000 0.000 0.272 2302 K C -0.769 175.723 176.600 -0.179 0.000 1.037 2302 K CA -0.127 56.040 56.287 -0.200 0.000 0.777 2302 K CB -1.304 31.116 32.500 -0.132 0.000 1.347 2302 K HN 0.107 nan 8.250 nan 0.000 0.460 2303 F N 0.960 120.931 119.950 0.035 0.000 2.426 2303 F HA 0.161 4.688 4.527 -0.000 0.000 0.309 2303 F C 2.177 177.994 175.800 0.029 0.000 1.246 2303 F CA 0.547 58.569 58.000 0.036 0.000 1.229 2303 F CB 0.301 39.333 39.000 0.055 0.000 1.255 2303 F HN 0.224 nan 8.300 nan 0.000 0.558 2304 L N -0.754 120.627 121.223 0.262 0.000 4.988 2304 L HA -0.285 4.055 4.340 -0.000 0.000 0.439 2304 L C 0.029 176.955 176.870 0.094 0.000 1.080 2304 L CA 0.562 55.485 54.840 0.139 0.000 1.018 2304 L CB -1.916 40.209 42.059 0.111 0.000 1.945 2304 L HN 0.542 nan 8.230 nan 0.000 0.782 2305 S N -0.217 115.535 115.700 0.088 0.000 2.513 2305 S HA 0.645 5.115 4.470 -0.000 0.000 0.299 2305 S C -0.490 174.142 174.600 0.055 0.000 1.087 2305 S CA -0.729 57.504 58.200 0.056 0.000 1.012 2305 S CB 2.000 65.215 63.200 0.025 0.000 1.044 2305 S HN 0.206 nan 8.310 nan 0.000 0.485 2306 L N 4.431 125.693 121.223 0.065 0.000 2.456 2306 L HA 0.374 4.714 4.340 -0.000 0.000 0.277 2306 L C -0.222 176.648 176.870 0.000 0.000 1.124 2306 L CA 0.170 55.043 54.840 0.054 0.000 0.880 2306 L CB 0.304 42.416 42.059 0.088 0.000 1.192 2306 L HN 0.629 nan 8.230 nan 0.000 0.463 2307 D N 4.470 124.862 120.400 -0.014 0.000 2.343 2307 D HA 0.089 4.729 4.640 -0.000 0.000 0.255 2307 D C 0.605 176.872 176.300 -0.054 0.000 1.187 2307 D CA 0.178 54.156 54.000 -0.037 0.000 0.875 2307 D CB 0.785 41.559 40.800 -0.044 0.000 1.136 2307 D HN 0.604 nan 8.370 nan 0.000 0.469 2308 L N 2.547 123.739 121.223 -0.052 0.000 2.667 2308 L HA 0.171 4.511 4.340 -0.000 0.000 0.232 2308 L C 0.985 177.829 176.870 -0.044 0.000 1.138 2308 L CA -0.050 54.756 54.840 -0.056 0.000 0.921 2308 L CB -0.017 42.009 42.059 -0.055 0.000 1.180 2308 L HN 0.347 nan 8.230 nan 0.000 0.487 2309 Q N 0.951 120.725 119.800 -0.044 0.000 2.342 2309 Q HA 0.532 4.872 4.340 -0.000 0.000 0.267 2309 Q C 0.192 176.168 176.000 -0.039 0.000 1.038 2309 Q CA 0.614 56.397 55.803 -0.033 0.000 0.832 2309 Q CB 2.418 31.139 28.738 -0.028 0.000 1.323 2309 Q HN 0.255 nan 8.270 nan 0.000 0.448 2310 G N 3.499 112.284 108.800 -0.025 0.000 2.568 2310 G HA2 -0.233 3.727 3.960 -0.000 0.000 0.222 2310 G HA3 -0.233 3.727 3.960 -0.000 0.000 0.222 2310 G C -0.891 173.987 174.900 -0.037 0.000 1.321 2310 G CA -0.100 44.985 45.100 -0.025 0.000 0.893 2310 G HN 0.680 nan 8.290 nan 0.000 0.569 2311 D N 1.123 121.492 120.400 -0.051 0.000 2.313 2311 D HA 0.463 5.103 4.640 -0.000 0.000 0.239 2311 D C -0.989 175.180 176.300 -0.218 0.000 1.142 2311 D CA -1.634 52.314 54.000 -0.087 0.000 0.847 2311 D CB 1.459 42.236 40.800 -0.038 0.000 1.082 2311 D HN -0.012 nan 8.370 nan 0.000 0.480 2312 P HA -0.110 nan 4.420 nan 0.000 0.218 2312 P C 1.082 178.145 177.300 -0.396 0.000 1.146 2312 P CA 1.012 63.810 63.100 -0.503 0.000 0.813 2312 P CB 0.269 31.379 31.700 -0.983 0.000 0.778 2313 R N -0.075 120.116 120.500 -0.515 0.000 2.189 2313 R HA -0.091 4.249 4.340 -0.000 0.000 0.218 2313 R C 1.845 178.072 176.300 -0.122 0.000 1.074 2313 R CA 1.154 57.015 56.100 -0.397 0.000 0.991 2313 R CB -0.343 29.674 30.300 -0.473 0.000 0.883 2313 R HN 0.473 nan 8.270 nan 0.000 0.457 2314 E N 0.278 120.414 120.200 -0.107 0.000 2.474 2314 E HA 0.033 4.383 4.350 -0.000 0.000 0.195 2314 E C -0.392 176.192 176.600 -0.027 0.000 1.039 2314 E CA -0.133 56.239 56.400 -0.046 0.000 0.881 2314 E CB 0.514 30.189 29.700 -0.042 0.000 0.970 2314 E HN 0.017 nan 8.360 nan 0.000 0.486 2315 S N 1.141 116.821 115.700 -0.033 0.000 2.513 2315 S HA 0.242 4.712 4.470 -0.000 0.000 0.276 2315 S C -0.006 174.613 174.600 0.031 0.000 1.254 2315 S CA -0.878 57.315 58.200 -0.012 0.000 1.053 2315 S CB 1.326 64.507 63.200 -0.033 0.000 0.958 2315 S HN 0.070 nan 8.310 nan 0.000 0.491 2316 Q N 2.848 122.686 119.800 0.064 0.000 2.508 2316 Q HA 0.286 4.626 4.340 -0.000 0.000 0.247 2316 Q C -1.899 174.235 176.000 0.224 0.000 1.047 2316 Q CA -1.905 53.974 55.803 0.126 0.000 0.783 2316 Q CB 1.716 30.550 28.738 0.161 0.000 1.172 2316 Q HN 0.621 nan 8.270 nan 0.000 0.515 2317 P HA -0.024 nan 4.420 nan 0.000 0.229 2317 P C -0.002 177.472 177.300 0.290 0.000 1.160 2317 P CA 0.709 63.943 63.100 0.223 0.000 0.777 2317 P CB 0.822 32.592 31.700 0.116 0.000 0.814 2318 L N -1.327 119.985 121.223 0.149 0.000 2.469 2318 L HA 0.460 4.800 4.340 -0.000 0.000 0.256 2318 L C -0.420 176.333 176.870 -0.194 0.000 1.006 2318 L CA -1.184 53.608 54.840 -0.081 0.000 0.832 2318 L CB 2.186 44.191 42.059 -0.090 0.000 1.421 2318 L HN -0.307 nan 8.230 nan 0.000 0.410 2319 L N 0.927 121.933 121.223 -0.362 0.000 2.287 2319 L HA 0.795 5.135 4.340 -0.000 0.000 0.287 2319 L C 0.282 176.981 176.870 -0.286 0.000 1.022 2319 L CA -0.104 54.589 54.840 -0.245 0.000 0.814 2319 L CB 1.555 43.486 42.059 -0.213 0.000 1.217 2319 L HN 0.817 nan 8.230 nan 0.000 0.420 2320 G N 1.343 109.994 108.800 -0.248 0.000 3.166 2320 G HA2 0.401 4.361 3.960 -0.000 0.000 0.267 2320 G HA3 0.401 4.361 3.960 -0.000 0.000 0.267 2320 G C -0.830 173.938 174.900 -0.221 0.000 1.256 2320 G CA -0.385 44.451 45.100 -0.440 0.000 0.859 2320 G HN 0.341 nan 8.290 nan 0.000 0.590 2321 T N 0.521 114.986 114.554 -0.148 0.000 2.940 2321 T HA 0.426 4.776 4.350 -0.000 0.000 0.309 2321 T C 0.444 175.146 174.700 0.002 0.000 1.056 2321 T CA 0.423 62.569 62.100 0.076 0.000 1.137 2321 T CB 0.912 69.850 68.868 0.116 0.000 0.976 2321 T HN 1.281 nan 8.240 nan 0.000 0.547 2322 V N -0.070 119.847 119.914 0.005 0.000 3.141 2322 V HA 0.605 4.725 4.120 -0.000 0.000 0.312 2322 V C -0.630 175.428 176.094 -0.060 0.000 1.157 2322 V CA -1.399 60.872 62.300 -0.049 0.000 1.041 2322 V CB 1.839 33.616 31.823 -0.076 0.000 1.071 2322 V HN 0.615 nan 8.190 nan 0.000 0.441 2323 I N 3.660 124.190 120.570 -0.068 0.000 2.260 2323 I HA 0.246 4.416 4.170 -0.000 0.000 0.297 2323 I C 0.959 177.031 176.117 -0.075 0.000 1.143 2323 I CA 0.108 61.367 61.300 -0.068 0.000 1.271 2323 I CB -0.271 37.693 38.000 -0.060 0.000 1.461 2323 I HN 0.971 nan 8.210 nan 0.000 0.530 2324 D N 3.790 124.138 120.400 -0.088 0.000 2.289 2324 D HA -0.016 4.624 4.640 -0.000 0.000 0.207 2324 D C 1.435 177.689 176.300 -0.076 0.000 0.966 2324 D CA 1.086 55.025 54.000 -0.102 0.000 0.868 2324 D CB 0.416 41.125 40.800 -0.151 0.000 0.943 2324 D HN 0.661 nan 8.370 nan 0.000 0.514 2325 G N -0.177 108.585 108.800 -0.063 0.000 2.194 2325 G HA2 -0.273 3.687 3.960 -0.000 0.000 0.236 2325 G HA3 -0.273 3.687 3.960 -0.000 0.000 0.236 2325 G C 0.933 175.808 174.900 -0.041 0.000 0.987 2325 G CA 0.607 45.679 45.100 -0.047 0.000 0.635 2325 G HN 0.243 nan 8.290 nan 0.000 0.520 2326 M N -1.200 118.371 119.600 -0.048 0.000 3.127 2326 M HA 0.460 4.940 4.480 -0.000 0.000 0.228 2326 M C 2.249 178.525 176.300 -0.040 0.000 1.558 2326 M CA 1.047 56.327 55.300 -0.034 0.000 1.349 2326 M CB -1.349 31.236 32.600 -0.025 0.000 1.098 2326 M HN 0.230 nan 8.290 nan 0.000 0.582 2327 L N 0.719 121.910 121.223 -0.054 0.000 2.072 2327 L HA 0.152 4.492 4.340 -0.000 0.000 0.205 2327 L C 0.293 177.116 176.870 -0.078 0.000 1.079 2327 L CA 1.474 56.278 54.840 -0.061 0.000 0.752 2327 L CB 0.152 42.174 42.059 -0.063 0.000 0.906 2327 L HN 0.136 nan 8.230 nan 0.000 0.436 2328 L N -0.181 120.995 121.223 -0.079 0.000 2.376 2328 L HA 0.249 4.589 4.340 -0.000 0.000 0.275 2328 L C 0.309 177.140 176.870 -0.066 0.000 0.987 2328 L CA -0.396 54.396 54.840 -0.081 0.000 0.828 2328 L CB 1.966 43.970 42.059 -0.090 0.000 1.249 2328 L HN 0.062 nan 8.230 nan 0.000 0.409 2329 L N 1.798 122.986 121.223 -0.059 0.000 2.375 2329 L HA 0.192 4.532 4.340 -0.000 0.000 0.215 2329 L C 0.492 177.336 176.870 -0.043 0.000 1.108 2329 L CA 0.809 55.621 54.840 -0.046 0.000 0.830 2329 L CB -0.111 41.925 42.059 -0.038 0.000 0.959 2329 L HN 0.586 nan 8.230 nan 0.000 0.457 2330 K N -0.972 119.398 120.400 -0.049 0.000 2.499 2330 K HA 0.332 4.652 4.320 -0.000 0.000 0.277 2330 K C -0.445 176.124 176.600 -0.052 0.000 1.025 2330 K CA -0.715 55.547 56.287 -0.043 0.000 0.900 2330 K CB 1.494 33.974 32.500 -0.033 0.000 1.494 2330 K HN -0.157 nan 8.250 nan 0.000 0.442 2331 T N -1.385 113.140 114.554 -0.048 0.000 2.932 2331 T HA 0.076 4.426 4.350 -0.000 0.000 0.312 2331 T C -2.023 172.643 174.700 -0.056 0.000 1.071 2331 T CA -1.050 61.017 62.100 -0.056 0.000 1.128 2331 T CB 0.520 69.356 68.868 -0.053 0.000 0.984 2331 T HN 0.175 nan 8.240 nan 0.000 0.549 2332 P HA -0.117 nan 4.420 nan 0.000 0.216 2332 P C 1.287 178.562 177.300 -0.041 0.000 1.150 2332 P CA 1.137 64.200 63.100 -0.062 0.000 0.843 2332 P CB 0.057 31.713 31.700 -0.073 0.000 0.787 2333 E N -0.188 119.986 120.200 -0.044 0.000 2.051 2333 E HA -0.195 4.155 4.350 -0.000 0.000 0.192 2333 E C 1.928 178.522 176.600 -0.010 0.000 0.991 2333 E CA 1.293 57.675 56.400 -0.029 0.000 0.799 2333 E CB -0.770 28.904 29.700 -0.043 0.000 0.748 2333 E HN 0.414 nan 8.360 nan 0.000 0.449 2334 E N 0.085 120.275 120.200 -0.016 0.000 2.204 2334 E HA -0.079 4.271 4.350 -0.000 0.000 0.194 2334 E C 1.772 178.374 176.600 0.003 0.000 0.989 2334 E CA 0.451 56.848 56.400 -0.005 0.000 0.824 2334 E CB -0.016 29.676 29.700 -0.012 0.000 0.756 2334 E HN 0.233 nan 8.360 nan 0.000 0.477 2335 L N 0.686 121.901 121.223 -0.013 0.000 2.478 2335 L HA -0.113 4.227 4.340 -0.000 0.000 0.223 2335 L C 2.116 178.995 176.870 0.016 0.000 1.140 2335 L CA 0.669 55.495 54.840 -0.022 0.000 0.842 2335 L CB -0.092 41.926 42.059 -0.067 0.000 0.953 2335 L HN 0.150 nan 8.230 nan 0.000 0.452 2336 Q N -0.511 119.315 119.800 0.042 0.000 2.302 2336 Q HA 0.011 4.351 4.340 -0.000 0.000 0.202 2336 Q C 2.464 178.534 176.000 0.116 0.000 0.936 2336 Q CA 0.848 56.709 55.803 0.095 0.000 0.886 2336 Q CB 0.085 28.869 28.738 0.076 0.000 0.986 2336 Q HN 0.511 nan 8.270 nan 0.000 0.487 2337 A N 2.375 125.243 122.820 0.079 0.000 1.865 2337 A HA -0.196 4.124 4.320 -0.000 0.000 0.217 2337 A C 1.066 178.708 177.584 0.097 0.000 1.191 2337 A CA 1.145 53.224 52.037 0.071 0.000 0.623 2337 A CB -0.706 18.322 19.000 0.046 0.000 0.826 2337 A HN 0.508 nan 8.150 nan 0.000 0.444 2338 E N 0.064 120.340 120.200 0.127 0.000 2.392 2338 E HA 0.274 4.624 4.350 -0.000 0.000 0.264 2338 E C -0.229 176.554 176.600 0.305 0.000 1.024 2338 E CA -0.120 56.384 56.400 0.173 0.000 0.903 2338 E CB 0.208 30.017 29.700 0.181 0.000 0.963 2338 E HN 0.610 nan 8.360 nan 0.000 0.432 2339 R N 2.084 122.652 120.500 0.113 0.000 2.533 2339 R HA 0.238 4.578 4.340 -0.000 0.000 0.268 2339 R C -0.605 175.378 176.300 -0.529 0.000 1.303 2339 R CA -0.515 55.456 56.100 -0.215 0.000 1.429 2339 R CB -0.065 30.162 30.300 -0.122 0.000 1.361 2339 R HN 0.456 nan 8.270 nan 0.000 0.745 2340 N N 1.574 120.003 118.700 -0.451 0.000 2.664 2340 N HA 0.158 4.898 4.740 -0.000 0.000 0.287 2340 N C -1.302 174.088 175.510 -0.200 0.000 1.869 2340 N CA -0.217 52.636 53.050 -0.327 0.000 0.832 2340 N CB 0.515 38.929 38.487 -0.122 0.000 1.293 2340 N HN 0.313 nan 8.380 nan 0.000 0.498 2341 F N -1.007 118.936 119.950 -0.011 0.000 2.782 2341 F HA 0.539 5.066 4.527 0.000 0.000 0.366 2341 F C 0.308 176.117 175.800 0.014 0.000 1.171 2341 F CA -1.248 56.759 58.000 0.012 0.000 1.064 2341 F CB 0.165 39.177 39.000 0.020 0.000 1.449 2341 F HN -0.077 nan 8.300 nan 0.000 0.520 2342 H N 0.912 120.177 119.070 0.325 0.000 2.690 2342 H HA 0.398 4.954 4.556 0.000 0.000 0.314 2342 H C -0.753 174.732 175.328 0.260 0.000 1.069 2342 H CA 0.515 56.661 56.048 0.163 0.000 1.436 2342 H CB 1.058 30.853 29.762 0.055 0.000 1.462 2342 H HN 0.899 nan 8.280 nan 0.000 0.511 2343 T N 1.870 116.217 114.554 -0.345 0.000 2.927 2343 T HA 0.628 4.978 4.350 -0.000 0.000 0.286 2343 T C 0.032 174.580 174.700 -0.253 0.000 1.040 2343 T CA -0.408 61.618 62.100 -0.123 0.000 1.010 2343 T CB 1.540 70.358 68.868 -0.084 0.000 1.177 2343 T HN 0.516 nan 8.240 nan 0.000 0.546 2344 V N -3.446 116.494 119.914 0.044 0.000 3.147 2344 V HA 0.767 4.887 4.120 -0.000 0.000 0.306 2344 V C -3.363 172.904 176.094 0.287 0.000 1.209 2344 V CA -3.035 59.314 62.300 0.082 0.000 1.023 2344 V CB 1.309 33.168 31.823 0.060 0.000 1.059 2344 V HN 0.748 nan 8.190 nan 0.000 0.435 2345 P HA 0.222 nan 4.420 nan 0.000 0.268 2345 P C -1.514 176.120 177.300 0.557 0.000 1.204 2345 P CA 0.516 63.839 63.100 0.372 0.000 0.768 2345 P CB -0.071 31.690 31.700 0.101 0.000 0.842 2346 Y N 3.551 124.052 120.300 0.336 0.000 2.346 2346 Y HA 0.482 5.032 4.550 -0.000 0.000 0.332 2346 Y C -0.720 175.139 175.900 -0.068 0.000 0.985 2346 Y CA -1.441 56.664 58.100 0.009 0.000 1.112 2346 Y CB 1.402 39.434 38.460 -0.713 0.000 1.170 2346 Y HN 0.225 nan 8.280 nan 0.000 0.447 2347 M N 7.724 127.332 119.600 0.013 0.000 2.180 2347 M HA 0.574 5.054 4.480 -0.000 0.000 0.350 2347 M C -2.125 173.962 176.300 -0.355 0.000 1.125 2347 M CA -0.633 54.436 55.300 -0.385 0.000 1.031 2347 M CB 0.884 32.930 32.600 -0.924 0.000 1.623 2347 M HN 0.422 nan 8.290 nan 0.000 0.451 2348 V N 4.598 124.252 119.914 -0.434 0.000 2.531 2348 V HA 0.884 5.004 4.120 -0.000 0.000 0.301 2348 V C 0.177 175.977 176.094 -0.491 0.000 1.034 2348 V CA -0.582 61.425 62.300 -0.488 0.000 0.865 2348 V CB 1.489 32.919 31.823 -0.655 0.000 0.995 2348 V HN 1.011 nan 8.190 nan 0.000 0.424 2349 G N 3.944 112.382 108.800 -0.604 0.000 2.672 2349 G HA2 0.900 4.860 3.960 -0.000 0.000 0.292 2349 G HA3 0.900 4.860 3.960 -0.000 0.000 0.292 2349 G C -1.246 173.293 174.900 -0.602 0.000 1.375 2349 G CA -0.677 43.709 45.100 -1.189 0.000 0.890 2349 G HN 0.925 nan 8.290 nan 0.000 0.476 2350 I N -2.492 117.809 120.570 -0.449 0.000 3.174 2350 I HA 0.603 4.773 4.170 -0.000 0.000 0.313 2350 I C -1.070 175.100 176.117 0.090 0.000 1.155 2350 I CA -1.376 59.862 61.300 -0.103 0.000 0.977 2350 I CB 2.464 40.435 38.000 -0.049 0.000 1.248 2350 I HN 0.431 nan 8.210 nan 0.000 0.453 2351 N N 1.427 120.200 118.700 0.122 0.000 2.430 2351 N HA 0.247 4.987 4.740 -0.000 0.000 0.298 2351 N C 0.111 175.729 175.510 0.180 0.000 1.130 2351 N CA -0.815 52.376 53.050 0.236 0.000 0.894 2351 N CB 2.124 40.738 38.487 0.212 0.000 1.209 2351 N HN 0.532 nan 8.380 nan 0.000 0.503 2352 K N 0.823 121.343 120.400 0.200 0.000 2.044 2352 K HA -0.174 4.146 4.320 -0.000 0.000 0.210 2352 K C 0.108 176.797 176.600 0.147 0.000 1.049 2352 K CA 1.873 58.252 56.287 0.153 0.000 0.927 2352 K CB 0.126 32.704 32.500 0.131 0.000 0.713 2352 K HN 0.545 nan 8.250 nan 0.000 0.443 2353 Q N 0.199 120.094 119.800 0.159 0.000 2.851 2353 Q HA 0.107 4.447 4.340 -0.000 0.000 0.331 2353 Q C -0.173 175.932 176.000 0.174 0.000 0.979 2353 Q CA -0.316 55.586 55.803 0.165 0.000 0.955 2353 Q CB 1.372 30.205 28.738 0.158 0.000 1.298 2353 Q HN 0.160 nan 8.270 nan 0.000 0.432 2354 E N 0.111 120.405 120.200 0.157 0.000 2.171 2354 E HA -0.184 4.166 4.350 -0.000 0.000 0.197 2354 E C 0.291 176.995 176.600 0.173 0.000 0.997 2354 E CA 1.289 57.746 56.400 0.096 0.000 0.810 2354 E CB 0.163 29.849 29.700 -0.023 0.000 0.738 2354 E HN 0.425 nan 8.360 nan 0.000 0.467 2355 F N -0.090 119.899 119.950 0.064 0.000 2.908 2355 F HA 0.326 4.853 4.527 -0.000 0.000 0.328 2355 F C 1.489 177.312 175.800 0.039 0.000 1.211 2355 F CA -0.278 57.732 58.000 0.017 0.000 1.291 2355 F CB 0.634 39.606 39.000 -0.047 0.000 0.962 2355 F HN -0.105 nan 8.300 nan 0.000 0.505 2356 G N -0.307 108.568 108.800 0.124 0.000 2.494 2356 G HA2 -0.172 3.788 3.960 -0.000 0.000 0.216 2356 G HA3 -0.172 3.788 3.960 -0.000 0.000 0.216 2356 G C 0.912 175.942 174.900 0.217 0.000 1.140 2356 G CA 0.968 46.168 45.100 0.168 0.000 0.801 2356 G HN 0.635 nan 8.290 nan 0.000 0.536 2357 W N -1.606 119.643 121.300 -0.086 0.000 5.315 2357 W HA 0.216 4.876 4.660 0.000 0.000 0.156 2357 W C 1.719 178.178 176.519 -0.099 0.000 1.387 2357 W CA 0.136 57.438 57.345 -0.073 0.000 1.815 2357 W CB -0.606 28.855 29.460 0.002 0.000 0.537 2357 W HN -0.033 nan 8.180 nan 0.000 1.106 2358 L N 1.870 123.156 121.223 0.104 0.000 1.971 2358 L HA -0.197 4.143 4.340 -0.000 0.000 0.215 2358 L C 2.156 178.837 176.870 -0.314 0.000 1.072 2358 L CA 3.012 57.791 54.840 -0.102 0.000 0.758 2358 L CB -0.878 41.354 42.059 0.287 0.000 0.889 2358 L HN 0.205 nan 8.230 nan 0.000 0.433 2359 I N 0.090 120.476 120.570 -0.306 0.000 2.127 2359 I HA -0.206 3.964 4.170 -0.000 0.000 0.241 2359 I C -0.380 175.426 176.117 -0.519 0.000 1.075 2359 I CA 1.562 62.624 61.300 -0.398 0.000 1.334 2359 I CB -1.953 35.779 38.000 -0.446 0.000 1.040 2359 I HN 0.334 nan 8.210 nan 0.000 0.405 2360 P HA -0.169 nan 4.420 nan 0.000 0.220 2360 P C 1.117 178.230 177.300 -0.312 0.000 1.148 2360 P CA 1.318 64.070 63.100 -0.579 0.000 0.803 2360 P CB -0.078 31.189 31.700 -0.722 0.000 0.782 2364 M N -0.336 119.227 119.600 -0.063 0.000 2.383 2364 M HA 0.232 4.712 4.480 -0.000 0.000 0.247 2364 M C 0.551 176.886 176.300 0.057 0.000 1.117 2364 M CA 0.140 55.458 55.300 0.029 0.000 0.995 2364 M CB 0.628 33.288 32.600 0.101 0.000 1.480 2364 M HN 0.179 nan 8.290 nan 0.000 0.485 2365 S N 0.337 116.047 115.700 0.016 0.000 3.682 2365 S HA -0.200 4.270 4.470 -0.000 0.000 0.354 2365 S C -0.240 174.405 174.600 0.075 0.000 1.034 2365 S CA 0.329 58.543 58.200 0.023 0.000 1.084 2365 S CB -2.192 61.013 63.200 0.007 0.000 0.903 2365 S HN 0.581 nan 8.310 nan 0.000 0.470 2366 Y N 2.313 122.606 120.300 -0.010 0.000 2.620 2366 Y HA 0.298 4.848 4.550 -0.000 0.000 0.330 2366 Y C -1.931 174.002 175.900 0.056 0.000 1.186 2366 Y CA -1.325 56.810 58.100 0.058 0.000 1.467 2366 Y CB 0.487 39.007 38.460 0.101 0.000 1.262 2366 Y HN 0.055 nan 8.280 nan 0.000 0.550 2367 P HA 0.141 nan 4.420 nan 0.000 0.244 2367 P C -1.018 176.288 177.300 0.009 0.000 1.769 2367 P CA 0.195 63.244 63.100 -0.086 0.000 1.102 2367 P CB 0.033 31.642 31.700 -0.152 0.000 1.937 2368 L N 1.676 122.978 121.223 0.132 0.000 2.574 2368 L HA 0.244 4.584 4.340 -0.000 0.000 0.258 2368 L C 0.779 177.731 176.870 0.137 0.000 1.520 2368 L CA 0.273 55.220 54.840 0.179 0.000 0.775 2368 L CB 0.473 42.750 42.059 0.363 0.000 1.028 2368 L HN -0.016 nan 8.230 nan 0.000 0.516 2369 S N -0.330 115.423 115.700 0.088 0.000 2.679 2369 S HA 0.225 4.695 4.470 -0.000 0.000 0.233 2369 S C 1.142 175.783 174.600 0.068 0.000 0.951 2369 S CA 0.137 58.383 58.200 0.077 0.000 0.973 2369 S CB 0.039 63.272 63.200 0.055 0.000 0.778 2369 S HN 0.529 nan 8.310 nan 0.000 0.477 2370 E N -0.255 119.988 120.200 0.071 0.000 2.399 2370 E HA 0.253 4.603 4.350 -0.000 0.000 0.206 2370 E C 1.593 178.233 176.600 0.067 0.000 0.812 2370 E CA 0.884 57.319 56.400 0.058 0.000 1.138 2370 E CB 0.287 30.011 29.700 0.040 0.000 1.140 2370 E HN 0.488 nan 8.360 nan 0.000 0.536 2371 G N 1.915 110.766 108.800 0.085 0.000 2.284 2371 G HA2 -0.280 3.680 3.960 -0.000 0.000 0.247 2371 G HA3 -0.280 3.680 3.960 -0.000 0.000 0.247 2371 G C 0.303 175.248 174.900 0.076 0.000 1.012 2371 G CA 0.643 45.799 45.100 0.092 0.000 0.618 2371 G HN 0.294 nan 8.290 nan 0.000 0.521 2372 Q N 0.019 119.852 119.800 0.055 0.000 2.290 2372 Q HA 0.761 5.101 4.340 -0.000 0.000 0.259 2372 Q C -1.185 174.830 176.000 0.026 0.000 0.941 2372 Q CA -0.741 55.087 55.803 0.041 0.000 0.912 2372 Q CB 2.642 31.399 28.738 0.032 0.000 1.244 2372 Q HN 0.445 nan 8.270 nan 0.000 0.441 2373 L N 3.600 124.834 121.223 0.019 0.000 2.404 2373 L HA 0.294 4.634 4.340 -0.000 0.000 0.272 2373 L C -0.979 175.879 176.870 -0.019 0.000 0.980 2373 L CA -0.271 54.556 54.840 -0.022 0.000 0.836 2373 L CB 1.666 43.690 42.059 -0.058 0.000 1.238 2373 L HN 0.685 nan 8.230 nan 0.000 0.408 2374 D N 2.738 123.122 120.400 -0.026 0.000 2.329 2374 D HA 0.046 4.686 4.640 -0.000 0.000 0.246 2374 D C 0.265 176.551 176.300 -0.024 0.000 1.111 2374 D CA -0.479 53.513 54.000 -0.013 0.000 0.941 2374 D CB 1.285 42.080 40.800 -0.008 0.000 1.169 2374 D HN 0.604 nan 8.370 nan 0.000 0.441 2375 Q N 0.021 119.820 119.800 -0.000 0.000 2.181 2375 Q HA -0.196 4.144 4.340 -0.000 0.000 0.205 2375 Q C 2.096 178.097 176.000 0.002 0.000 0.980 2375 Q CA 1.480 57.289 55.803 0.011 0.000 0.862 2375 Q CB 0.073 28.828 28.738 0.029 0.000 0.905 2375 Q HN 0.505 nan 8.270 nan 0.000 0.429 2376 K N -0.767 119.631 120.400 -0.003 0.000 2.026 2376 K HA -0.129 4.191 4.320 -0.000 0.000 0.208 2376 K C 1.786 178.379 176.600 -0.013 0.000 1.048 2376 K CA 1.716 58.002 56.287 -0.002 0.000 0.929 2376 K CB 0.008 32.506 32.500 -0.002 0.000 0.713 2376 K HN 0.148 nan 8.250 nan 0.000 0.439 2377 T N 0.801 115.333 114.554 -0.036 0.000 2.821 2377 T HA -0.065 4.285 4.350 -0.000 0.000 0.267 2377 T C 1.866 176.497 174.700 -0.116 0.000 1.046 2377 T CA 1.122 63.187 62.100 -0.059 0.000 1.139 2377 T CB -0.248 68.578 68.868 -0.070 0.000 0.871 2377 T HN 0.397 nan 8.240 nan 0.000 0.454 2378 A N 1.721 124.435 122.820 -0.176 0.000 1.908 2378 A HA -0.100 4.220 4.320 -0.000 0.000 0.218 2378 A C 2.340 179.888 177.584 -0.059 0.000 1.181 2378 A CA 1.595 53.426 52.037 -0.343 0.000 0.627 2378 A CB -0.717 18.135 19.000 -0.246 0.000 0.818 2378 A HN 0.456 nan 8.150 nan 0.000 0.445 2379 M N -0.510 119.114 119.600 0.040 0.000 2.159 2379 M HA -0.123 4.357 4.480 -0.000 0.000 0.263 2379 M C 2.373 178.771 176.300 0.163 0.000 1.063 2379 M CA 1.659 57.033 55.300 0.124 0.000 1.110 2379 M CB -0.371 32.276 32.600 0.078 0.000 1.374 2379 M HN 0.421 nan 8.290 nan 0.000 0.411 2380 S N 0.850 116.615 115.700 0.109 0.000 2.368 2380 S HA -0.023 4.447 4.470 -0.000 0.000 0.224 2380 S C 1.867 176.581 174.600 0.190 0.000 1.029 2380 S CA 0.996 59.289 58.200 0.156 0.000 0.988 2380 S CB -0.298 62.952 63.200 0.083 0.000 0.838 2380 S HN 0.390 nan 8.310 nan 0.000 0.462 2381 L N 0.687 121.979 121.223 0.115 0.000 2.056 2381 L HA -0.079 4.261 4.340 -0.000 0.000 0.207 2381 L C 2.346 179.422 176.870 0.344 0.000 1.078 2381 L CA 0.687 55.617 54.840 0.150 0.000 0.749 2381 L CB -0.469 41.634 42.059 0.073 0.000 0.901 2381 L HN 0.275 nan 8.230 nan 0.000 0.433 2382 L N -0.507 120.986 121.223 0.450 0.000 2.083 2382 L HA -0.260 4.080 4.340 -0.000 0.000 0.209 2382 L C 2.188 179.302 176.870 0.408 0.000 1.083 2382 L CA 1.791 56.903 54.840 0.454 0.000 0.752 2382 L CB -0.728 41.604 42.059 0.455 0.000 0.899 2382 L HN 0.368 nan 8.230 nan 0.000 0.433 2383 W N 0.110 121.519 121.300 0.182 0.000 2.381 2383 W HA -0.204 4.456 4.660 0.000 0.000 0.301 2383 W C 1.975 178.590 176.519 0.160 0.000 1.205 2383 W CA 0.655 58.099 57.345 0.165 0.000 1.285 2383 W CB 0.136 29.657 29.460 0.103 0.000 1.133 2383 W HN 0.028 nan 8.180 nan 0.000 0.521 2384 K N 0.584 121.017 120.400 0.056 0.000 2.283 2384 K HA -0.062 4.258 4.320 -0.000 0.000 0.202 2384 K C 1.680 178.256 176.600 -0.039 0.000 1.048 2384 K CA 1.112 57.333 56.287 -0.110 0.000 0.948 2384 K CB -0.627 31.843 32.500 -0.049 0.000 0.742 2384 K HN 0.033 nan 8.250 nan 0.000 0.458 2385 S N 0.723 116.477 115.700 0.090 0.000 2.650 2385 S HA -0.017 4.453 4.470 -0.000 0.000 0.219 2385 S C 1.243 175.868 174.600 0.042 0.000 0.960 2385 S CA -0.305 57.965 58.200 0.116 0.000 0.925 2385 S CB -0.335 62.975 63.200 0.184 0.000 0.775 2385 S HN 0.280 nan 8.310 nan 0.000 0.525 2386 Y N 3.942 124.171 120.300 -0.118 0.000 2.096 2386 Y HA -0.193 4.357 4.550 -0.000 0.000 0.278 2386 Y C -0.686 175.152 175.900 -0.103 0.000 1.192 2386 Y CA 2.013 60.035 58.100 -0.130 0.000 1.143 2386 Y CB -1.102 37.148 38.460 -0.350 0.000 0.963 2386 Y HN 0.266 nan 8.280 nan 0.000 0.505 2387 P HA -0.169 nan 4.420 nan 0.000 0.222 2387 P C 1.304 178.531 177.300 -0.123 0.000 1.147 2387 P CA 1.669 64.747 63.100 -0.037 0.000 0.790 2387 P CB -0.076 31.635 31.700 0.019 0.000 0.780 2388 L N -0.720 120.425 121.223 -0.130 0.000 2.221 2388 L HA 0.018 4.358 4.340 -0.000 0.000 0.202 2388 L C 2.439 179.140 176.870 -0.282 0.000 1.074 2388 L CA 0.881 55.614 54.840 -0.178 0.000 0.795 2388 L CB -0.402 41.576 42.059 -0.135 0.000 0.960 2388 L HN -0.138 nan 8.230 nan 0.000 0.458 2389 V N -6.019 113.726 119.914 -0.283 0.000 3.661 2389 V HA 0.128 4.248 4.120 -0.000 0.000 0.271 2389 V C 1.147 177.064 176.094 -0.295 0.000 1.315 2389 V CA -0.567 61.556 62.300 -0.294 0.000 1.072 2389 V CB -0.266 31.412 31.823 -0.241 0.000 0.830 2389 V HN 0.469 nan 8.190 nan 0.000 0.443 2390 C N 1.582 120.554 119.300 -0.547 0.000 4.028 2390 C HA -0.181 4.279 4.460 -0.000 0.000 0.300 2390 C C 0.578 175.387 174.990 -0.301 0.000 1.399 2390 C CA 0.294 58.779 59.018 -0.888 0.000 2.051 2390 C CB -2.976 24.414 27.740 -0.584 0.000 1.318 2390 C HN 0.667 nan 8.230 nan 0.000 0.696 2391 I N 1.147 121.713 120.570 -0.006 0.000 2.307 2391 I HA 0.466 4.636 4.170 -0.000 0.000 0.289 2391 I C 1.018 177.473 176.117 0.564 0.000 1.021 2391 I CA 0.000 61.520 61.300 0.366 0.000 1.224 2391 I CB 0.936 39.130 38.000 0.324 0.000 1.376 2391 I HN 0.488 nan 8.210 nan 0.000 0.470 2392 A N 6.024 129.154 122.820 0.517 0.000 2.587 2392 A HA -0.041 4.279 4.320 -0.000 0.000 0.233 2392 A C 1.504 179.253 177.584 0.275 0.000 1.049 2392 A CA 0.167 52.479 52.037 0.458 0.000 0.754 2392 A CB 0.151 19.316 19.000 0.275 0.000 0.977 2392 A HN 0.916 nan 8.150 nan 0.000 0.509 2393 K N 0.708 121.125 120.400 0.029 0.000 2.211 2393 K HA -0.201 4.119 4.320 -0.000 0.000 0.204 2393 K C 1.674 178.169 176.600 -0.175 0.000 1.047 2393 K CA 1.979 58.046 56.287 -0.366 0.000 0.935 2393 K CB -0.085 31.781 32.500 -1.056 0.000 0.728 2393 K HN 0.913 nan 8.250 nan 0.000 0.452 2394 E N 0.081 120.232 120.200 -0.081 0.000 2.274 2394 E HA -0.157 4.193 4.350 -0.000 0.000 0.194 2394 E C 1.535 178.130 176.600 -0.009 0.000 0.996 2394 E CA 0.769 57.140 56.400 -0.048 0.000 0.840 2394 E CB -0.096 29.589 29.700 -0.024 0.000 0.772 2394 E HN 0.317 nan 8.360 nan 0.000 0.491 2395 L N 0.586 121.829 121.223 0.033 0.000 2.567 2395 L HA 0.078 4.418 4.340 -0.000 0.000 0.225 2395 L C 2.058 178.969 176.870 0.070 0.000 1.119 2395 L CA -0.301 54.560 54.840 0.035 0.000 0.871 2395 L CB -0.124 41.957 42.059 0.036 0.000 1.036 2395 L HN 0.111 nan 8.230 nan 0.000 0.459 2396 I N 1.116 121.742 120.570 0.093 0.000 2.151 2396 I HA -0.188 3.982 4.170 -0.000 0.000 0.243 2396 I C 0.044 176.229 176.117 0.113 0.000 1.080 2396 I CA 1.967 63.349 61.300 0.137 0.000 1.339 2396 I CB -2.187 35.890 38.000 0.127 0.000 1.039 2396 I HN 0.175 nan 8.210 nan 0.000 0.409 2397 P HA -0.155 nan 4.420 nan 0.000 0.215 2397 P C 1.577 178.919 177.300 0.071 0.000 1.157 2397 P CA 1.466 64.600 63.100 0.057 0.000 0.868 2397 P CB -0.035 31.679 31.700 0.023 0.000 0.788 2398 E N -0.329 119.909 120.200 0.063 0.000 2.058 2398 E HA -0.182 4.168 4.350 -0.000 0.000 0.194 2398 E C 2.130 178.820 176.600 0.149 0.000 0.997 2398 E CA 1.345 57.794 56.400 0.081 0.000 0.801 2398 E CB -0.693 29.033 29.700 0.043 0.000 0.746 2398 E HN 0.146 nan 8.360 nan 0.000 0.450 2399 A N 1.050 123.967 122.820 0.161 0.000 1.877 2399 A HA -0.196 4.124 4.320 -0.000 0.000 0.216 2399 A C 2.423 180.143 177.584 0.226 0.000 1.186 2399 A CA 2.069 54.235 52.037 0.214 0.000 0.620 2399 A CB -0.978 18.181 19.000 0.265 0.000 0.822 2399 A HN 0.198 nan 8.150 nan 0.000 0.443 2400 T N -0.562 114.115 114.554 0.205 0.000 2.746 2400 T HA -0.125 4.225 4.350 -0.000 0.000 0.267 2400 T C 1.911 176.708 174.700 0.162 0.000 1.039 2400 T CA 1.676 63.904 62.100 0.213 0.000 1.142 2400 T CB -0.243 68.734 68.868 0.183 0.000 0.866 2400 T HN 0.594 nan 8.240 nan 0.000 0.444 2401 E N 1.481 121.743 120.200 0.104 0.000 2.085 2401 E HA -0.157 4.193 4.350 -0.000 0.000 0.194 2401 E C 2.079 178.682 176.600 0.006 0.000 0.994 2401 E CA 1.352 57.783 56.400 0.053 0.000 0.801 2401 E CB -0.211 29.510 29.700 0.035 0.000 0.743 2401 E HN 0.303 nan 8.360 nan 0.000 0.453 2402 K N -0.776 119.600 120.400 -0.040 0.000 2.097 2402 K HA -0.158 4.162 4.320 -0.000 0.000 0.206 2402 K C 1.743 178.188 176.600 -0.258 0.000 1.049 2402 K CA 1.627 57.755 56.287 -0.264 0.000 0.933 2402 K CB -0.636 31.448 32.500 -0.693 0.000 0.717 2402 K HN 0.274 nan 8.250 nan 0.000 0.442 2403 Y N -0.184 120.027 120.300 -0.148 0.000 2.347 2403 Y HA 0.194 4.744 4.550 0.000 0.000 0.294 2403 Y C 1.637 177.545 175.900 0.013 0.000 1.117 2403 Y CA 0.930 58.999 58.100 -0.052 0.000 1.184 2403 Y CB 0.327 38.813 38.460 0.043 0.000 1.047 2403 Y HN -0.075 nan 8.280 nan 0.000 0.546 2404 L N -2.209 119.127 121.223 0.189 0.000 2.638 2404 L HA 0.333 4.673 4.340 -0.000 0.000 0.232 2404 L C 2.298 179.209 176.870 0.068 0.000 1.099 2404 L CA 0.581 55.502 54.840 0.135 0.000 0.883 2404 L CB -0.552 41.601 42.059 0.157 0.000 1.136 2404 L HN 0.131 nan 8.230 nan 0.000 0.492 2405 G N 1.049 109.873 108.800 0.040 0.000 2.422 2405 G HA2 -0.193 3.767 3.960 -0.000 0.000 0.218 2405 G HA3 -0.193 3.767 3.960 -0.000 0.000 0.218 2405 G C 1.569 176.469 174.900 0.000 0.000 1.146 2405 G CA 0.820 45.928 45.100 0.014 0.000 0.769 2405 G HN 0.451 nan 8.290 nan 0.000 0.547 2406 G N -0.962 107.829 108.800 -0.015 0.000 2.470 2406 G HA2 0.131 4.091 3.960 -0.000 0.000 0.220 2406 G HA3 0.131 4.091 3.960 -0.000 0.000 0.220 2406 G C 0.799 175.697 174.900 -0.002 0.000 1.121 2406 G CA 1.343 46.431 45.100 -0.020 0.000 0.766 2406 G HN 0.589 nan 8.290 nan 0.000 0.553 2407 T N -1.494 113.068 114.554 0.013 0.000 2.930 2407 T HA 0.490 4.840 4.350 -0.000 0.000 0.290 2407 T C -0.702 174.013 174.700 0.025 0.000 1.052 2407 T CA -0.594 61.518 62.100 0.021 0.000 1.017 2407 T CB 2.022 70.909 68.868 0.031 0.000 1.137 2407 T HN -0.092 nan 8.240 nan 0.000 0.511 2408 D N 0.688 121.101 120.400 0.023 0.000 2.469 2408 D HA 0.238 4.878 4.640 -0.000 0.000 0.215 2408 D C -0.760 175.555 176.300 0.025 0.000 1.154 2408 D CA -0.199 53.814 54.000 0.022 0.000 0.832 2408 D CB 0.410 41.219 40.800 0.016 0.000 1.008 2408 D HN 0.449 nan 8.370 nan 0.000 0.506 2409 D N 0.513 120.931 120.400 0.031 0.000 2.313 2409 D HA 0.019 4.659 4.640 -0.000 0.000 0.239 2409 D C 1.493 177.817 176.300 0.040 0.000 1.142 2409 D CA 0.152 54.172 54.000 0.033 0.000 0.847 2409 D CB 1.707 42.528 40.800 0.035 0.000 1.082 2409 D HN 0.073 nan 8.370 nan 0.000 0.480 2410 T N -1.228 113.347 114.554 0.035 0.000 2.996 2410 T HA -0.107 4.243 4.350 -0.000 0.000 0.271 2410 T C 1.617 176.347 174.700 0.050 0.000 1.126 2410 T CA 0.559 62.681 62.100 0.037 0.000 1.103 2410 T CB -0.067 68.817 68.868 0.027 0.000 0.870 2410 T HN 0.189 nan 8.240 nan 0.000 0.528 2411 V N 1.267 121.213 119.914 0.052 0.000 2.331 2411 V HA 0.000 4.120 4.120 -0.000 0.000 0.242 2411 V C 2.736 178.879 176.094 0.080 0.000 1.034 2411 V CA 1.345 63.683 62.300 0.063 0.000 1.027 2411 V CB -0.436 31.419 31.823 0.053 0.000 0.667 2411 V HN 0.423 nan 8.190 nan 0.000 0.457 2412 K N 0.353 120.798 120.400 0.074 0.000 2.147 2412 K HA -0.149 4.171 4.320 -0.000 0.000 0.205 2412 K C 2.199 178.868 176.600 0.114 0.000 1.049 2412 K CA 1.187 57.526 56.287 0.087 0.000 0.936 2412 K CB -0.205 32.336 32.500 0.069 0.000 0.722 2412 K HN 0.390 nan 8.250 nan 0.000 0.446 2413 K N 1.137 121.600 120.400 0.105 0.000 2.063 2413 K HA -0.170 4.150 4.320 -0.000 0.000 0.208 2413 K C 2.195 178.903 176.600 0.180 0.000 1.048 2413 K CA 1.137 57.502 56.287 0.129 0.000 0.928 2413 K CB -0.024 32.528 32.500 0.087 0.000 0.713 2413 K HN 0.053 nan 8.250 nan 0.000 0.442 2414 K N 1.296 121.789 120.400 0.156 0.000 2.057 2414 K HA -0.180 4.140 4.320 -0.000 0.000 0.206 2414 K C 1.322 178.085 176.600 0.272 0.000 1.050 2414 K CA 1.618 58.029 56.287 0.207 0.000 0.935 2414 K CB -0.006 32.587 32.500 0.155 0.000 0.715 2414 K HN 0.098 nan 8.250 nan 0.000 0.439 2415 D N 1.060 121.583 120.400 0.205 0.000 2.144 2415 D HA -0.133 4.507 4.640 -0.000 0.000 0.199 2415 D C 2.082 178.511 176.300 0.216 0.000 0.984 2415 D CA 0.944 55.061 54.000 0.194 0.000 0.834 2415 D CB -0.007 40.880 40.800 0.145 0.000 0.955 2415 D HN 0.252 nan 8.370 nan 0.000 0.465 2416 L N -0.134 121.227 121.223 0.230 0.000 2.156 2416 L HA -0.105 4.235 4.340 -0.000 0.000 0.208 2416 L C 2.338 179.389 176.870 0.301 0.000 1.095 2416 L CA 0.364 55.366 54.840 0.271 0.000 0.770 2416 L CB -0.320 41.894 42.059 0.257 0.000 0.914 2416 L HN -0.046 nan 8.230 nan 0.000 0.439 2417 F N 0.727 120.762 119.950 0.141 0.000 2.186 2417 F HA -0.160 4.367 4.527 -0.000 0.000 0.299 2417 F C 2.054 177.882 175.800 0.047 0.000 1.090 2417 F CA 1.366 59.419 58.000 0.088 0.000 1.307 2417 F CB -0.071 38.998 39.000 0.114 0.000 1.019 2417 F HN -0.107 nan 8.300 nan 0.000 0.489 2418 L N -0.396 120.885 121.223 0.096 0.000 2.217 2418 L HA -0.139 4.201 4.340 -0.000 0.000 0.211 2418 L C 1.945 178.807 176.870 -0.013 0.000 1.107 2418 L CA 0.870 55.733 54.840 0.038 0.000 0.783 2418 L CB -0.734 41.466 42.059 0.235 0.000 0.919 2418 L HN 0.030 nan 8.230 nan 0.000 0.442 2419 D N 0.227 120.662 120.400 0.058 0.000 2.144 2419 D HA -0.148 4.492 4.640 -0.000 0.000 0.200 2419 D C 2.069 178.347 176.300 -0.037 0.000 0.978 2419 D CA 0.915 54.981 54.000 0.111 0.000 0.833 2419 D CB -0.050 40.905 40.800 0.258 0.000 0.961 2419 D HN 0.140 nan 8.370 nan 0.000 0.470 2420 L N 1.255 122.292 121.223 -0.311 0.000 1.989 2420 L HA -0.148 4.192 4.340 -0.000 0.000 0.211 2420 L C 1.914 178.441 176.870 -0.573 0.000 1.071 2420 L CA 1.577 55.963 54.840 -0.756 0.000 0.749 2420 L CB -0.941 40.584 42.059 -0.890 0.000 0.890 2420 L HN -0.069 nan 8.230 nan 0.000 0.431 2421 I N 0.600 120.771 120.570 -0.666 0.000 2.208 2421 I HA -0.248 3.922 4.170 -0.000 0.000 0.245 2421 I C 2.751 178.552 176.117 -0.527 0.000 1.097 2421 I CA 1.498 62.333 61.300 -0.774 0.000 1.363 2421 I CB -2.007 35.199 38.000 -1.324 0.000 1.051 2421 I HN 0.399 nan 8.210 nan 0.000 0.413 2422 A N 0.662 123.326 122.820 -0.261 0.000 1.902 2422 A HA -0.206 4.114 4.320 -0.000 0.000 0.217 2422 A C 1.990 179.587 177.584 0.021 0.000 1.181 2422 A CA 1.861 53.933 52.037 0.059 0.000 0.623 2422 A CB -0.568 18.538 19.000 0.178 0.000 0.818 2422 A HN 0.359 nan 8.150 nan 0.000 0.443 2423 D N -0.317 120.044 120.400 -0.066 0.000 2.144 2423 D HA -0.085 4.555 4.640 -0.000 0.000 0.200 2423 D C 2.024 178.149 176.300 -0.291 0.000 0.978 2423 D CA 1.394 55.363 54.000 -0.051 0.000 0.833 2423 D CB -0.281 40.611 40.800 0.153 0.000 0.961 2423 D HN 0.248 nan 8.370 nan 0.000 0.470 2424 V N 0.664 120.251 119.914 -0.545 0.000 2.453 2424 V HA -0.143 3.977 4.120 -0.000 0.000 0.247 2424 V C 2.372 178.169 176.094 -0.496 0.000 1.048 2424 V CA 1.122 63.020 62.300 -0.671 0.000 1.049 2424 V CB -0.270 31.066 31.823 -0.811 0.000 0.672 2424 V HN 0.178 nan 8.190 nan 0.000 0.457 2425 M N -1.745 117.536 119.600 -0.531 0.000 2.287 2425 M HA 0.093 4.573 4.480 -0.000 0.000 0.266 2425 M C 1.740 177.497 176.300 -0.905 0.000 1.079 2425 M CA 1.977 56.797 55.300 -0.799 0.000 1.146 2425 M CB -0.010 31.920 32.600 -1.117 0.000 1.374 2425 M HN 0.351 nan 8.290 nan 0.000 0.435 2426 F N -1.791 118.092 119.950 -0.111 0.000 2.463 2426 F HA 0.352 4.879 4.527 -0.000 0.000 0.271 2426 F C 2.381 178.135 175.800 -0.076 0.000 0.888 2426 F CA 0.177 58.139 58.000 -0.064 0.000 1.149 2426 F CB -1.235 37.769 39.000 0.006 0.000 1.071 2426 F HN 0.022 nan 8.300 nan 0.000 0.802 2427 G N 1.065 109.951 108.800 0.144 0.000 2.586 2427 G HA2 -0.241 3.719 3.960 -0.000 0.000 0.218 2427 G HA3 -0.241 3.719 3.960 -0.000 0.000 0.218 2427 G C 1.686 176.592 174.900 0.009 0.000 1.216 2427 G CA 1.916 47.050 45.100 0.058 0.000 0.786 2427 G HN 0.175 nan 8.290 nan 0.000 0.583 2428 V N 2.187 122.100 119.914 -0.001 0.000 2.295 2428 V HA -0.100 4.020 4.120 -0.000 0.000 0.246 2428 V C 0.380 176.462 176.094 -0.019 0.000 1.049 2428 V CA 2.268 64.581 62.300 0.021 0.000 1.024 2428 V CB -1.066 30.782 31.823 0.042 0.000 0.648 2428 V HN 0.299 nan 8.190 nan 0.000 0.447 2429 P HA -0.101 nan 4.420 nan 0.000 0.215 2429 P C 2.004 179.263 177.300 -0.068 0.000 1.153 2429 P CA 1.732 64.783 63.100 -0.082 0.000 0.853 2429 P CB -0.065 31.555 31.700 -0.133 0.000 0.788 2430 S N -0.754 114.904 115.700 -0.070 0.000 2.356 2430 S HA -0.112 4.357 4.470 -0.000 0.000 0.223 2430 S C 2.021 176.520 174.600 -0.167 0.000 1.032 2430 S CA 1.277 59.403 58.200 -0.123 0.000 1.005 2430 S CB -1.280 61.845 63.200 -0.125 0.000 0.867 2430 S HN -0.049 nan 8.310 nan 0.000 0.449 2431 V N 2.231 122.068 119.914 -0.129 0.000 2.343 2431 V HA -0.162 3.958 4.120 -0.000 0.000 0.247 2431 V C 2.084 178.157 176.094 -0.034 0.000 1.051 2431 V CA 1.490 63.719 62.300 -0.119 0.000 1.036 2431 V CB -0.670 31.132 31.823 -0.036 0.000 0.654 2431 V HN 0.449 nan 8.190 nan 0.000 0.451 2432 I N -0.416 120.153 120.570 -0.002 0.000 2.208 2432 I HA -0.232 3.938 4.170 -0.000 0.000 0.245 2432 I C 2.384 178.517 176.117 0.027 0.000 1.097 2432 I CA 1.335 62.654 61.300 0.031 0.000 1.363 2432 I CB -0.402 37.614 38.000 0.027 0.000 1.051 2432 I HN 0.163 nan 8.210 nan 0.000 0.413 2433 V N 0.935 120.839 119.914 -0.017 0.000 2.358 2433 V HA -0.269 3.851 4.120 -0.000 0.000 0.246 2433 V C 2.673 178.769 176.094 0.003 0.000 1.047 2433 V CA 1.948 64.248 62.300 -0.001 0.000 1.035 2433 V CB -0.828 30.968 31.823 -0.046 0.000 0.658 2433 V HN 0.491 nan 8.190 nan 0.000 0.452 2434 A N -0.180 122.576 122.820 -0.107 0.000 1.898 2434 A HA -0.202 4.118 4.320 -0.000 0.000 0.216 2434 A C 2.359 180.041 177.584 0.164 0.000 1.181 2434 A CA 1.630 53.591 52.037 -0.127 0.000 0.620 2434 A CB -0.462 18.237 19.000 -0.501 0.000 0.819 2434 A HN 0.493 nan 8.150 nan 0.000 0.442 2435 R N -0.477 120.149 120.500 0.209 0.000 2.096 2435 R HA -0.132 4.208 4.340 -0.000 0.000 0.235 2435 R C 1.910 178.317 176.300 0.179 0.000 1.127 2435 R CA 1.746 58.005 56.100 0.265 0.000 0.968 2435 R CB -0.394 30.025 30.300 0.198 0.000 0.861 2435 R HN 0.633 nan 8.270 nan 0.000 0.440 2436 N N -0.680 118.115 118.700 0.158 0.000 2.216 2436 N HA -0.151 4.589 4.740 -0.000 0.000 0.183 2436 N C 1.621 177.246 175.510 0.192 0.000 1.017 2436 N CA 0.927 54.068 53.050 0.151 0.000 0.861 2436 N CB -0.098 38.477 38.487 0.148 0.000 0.986 2436 N HN 0.258 nan 8.380 nan 0.000 0.428 2437 H N 0.783 119.944 119.070 0.152 0.000 2.357 2437 H HA 0.059 4.615 4.556 -0.000 0.000 0.301 2437 H C 2.191 177.599 175.328 0.134 0.000 1.082 2437 H CA 1.439 57.602 56.048 0.191 0.000 1.342 2437 H CB 0.159 30.062 29.762 0.235 0.000 1.389 2437 H HN 0.030 nan 8.280 nan 0.000 0.511 2438 R N 0.313 120.932 120.500 0.199 0.000 2.070 2438 R HA -0.130 4.210 4.340 -0.000 0.000 0.233 2438 R C 1.266 177.568 176.300 0.003 0.000 1.137 2438 R CA 1.979 58.139 56.100 0.101 0.000 0.945 2438 R CB -0.178 30.209 30.300 0.146 0.000 0.845 2438 R HN 0.391 nan 8.270 nan 0.000 0.430 2439 D N 0.355 120.769 120.400 0.024 0.000 2.309 2439 D HA -0.117 4.523 4.640 -0.000 0.000 0.212 2439 D C 1.436 177.698 176.300 -0.064 0.000 0.968 2439 D CA 1.195 55.188 54.000 -0.013 0.000 0.882 2439 D CB -0.045 40.764 40.800 0.014 0.000 0.918 2439 D HN 0.429 nan 8.370 nan 0.000 0.503 2440 A N -0.105 122.660 122.820 -0.092 0.000 2.167 2440 A HA 0.336 4.656 4.320 -0.000 0.000 0.214 2440 A C 1.823 179.250 177.584 -0.261 0.000 1.151 2440 A CA 1.177 53.085 52.037 -0.214 0.000 0.735 2440 A CB -0.128 18.744 19.000 -0.215 0.000 0.802 2440 A HN 0.263 nan 8.150 nan 0.000 0.467 2441 G N -2.495 106.193 108.800 -0.188 0.000 2.131 2441 G HA2 0.187 4.147 3.960 -0.000 0.000 0.223 2441 G HA3 0.187 4.147 3.960 -0.000 0.000 0.223 2441 G C 0.202 175.001 174.900 -0.169 0.000 0.990 2441 G CA 0.246 45.249 45.100 -0.162 0.000 0.671 2441 G HN 1.548 nan 8.290 nan 0.000 0.521 2442 A N -0.195 122.489 122.820 -0.227 0.000 2.311 2442 A HA 0.916 5.236 4.320 -0.000 0.000 0.334 2442 A C -2.471 175.111 177.584 -0.004 0.000 1.139 2442 A CA -1.716 50.217 52.037 -0.173 0.000 0.830 2442 A CB 1.246 20.028 19.000 -0.363 0.000 1.234 2442 A HN 0.068 nan 8.150 nan 0.000 0.483 2443 P HA 0.255 nan 4.420 nan 0.000 0.267 2443 P C -0.602 176.818 177.300 0.200 0.000 1.209 2443 P CA 0.700 63.856 63.100 0.095 0.000 0.763 2443 P CB 0.709 32.505 31.700 0.161 0.000 0.816 2444 T N 3.118 117.656 114.554 -0.025 0.000 2.893 2444 T HA 0.566 4.916 4.350 -0.000 0.000 0.293 2444 T C -1.089 173.412 174.700 -0.332 0.000 1.027 2444 T CA -0.298 61.822 62.100 0.034 0.000 0.988 2444 T CB 0.831 69.839 68.868 0.235 0.000 1.043 2444 T HN 0.110 nan 8.240 nan 0.000 0.461 2445 Y N 0.974 121.248 120.300 -0.043 0.000 2.524 2445 Y HA 0.717 5.267 4.550 -0.000 0.000 0.347 2445 Y C -0.096 175.770 175.900 -0.057 0.000 1.005 2445 Y CA -1.142 56.902 58.100 -0.093 0.000 1.025 2445 Y CB 2.131 40.258 38.460 -0.555 0.000 1.275 2445 Y HN 0.379 nan 8.280 nan 0.000 0.460 2446 M N 3.125 122.953 119.600 0.380 0.000 2.550 2446 M HA 0.517 4.997 4.480 -0.000 0.000 0.292 2446 M C -1.650 174.947 176.300 0.494 0.000 1.221 2446 M CA -0.967 54.435 55.300 0.171 0.000 0.873 2446 M CB 3.208 35.680 32.600 -0.213 0.000 1.727 2446 M HN 0.765 nan 8.290 nan 0.000 0.459 2447 Y N -1.307 119.138 120.300 0.242 0.000 2.625 2447 Y HA 0.743 5.293 4.550 -0.000 0.000 0.338 2447 Y C -1.519 174.480 175.900 0.165 0.000 1.123 2447 Y CA -0.975 57.217 58.100 0.153 0.000 1.046 2447 Y CB 1.578 40.053 38.460 0.025 0.000 1.299 2447 Y HN 0.692 nan 8.280 nan 0.000 0.464 2448 E N 2.651 123.109 120.200 0.429 0.000 2.255 2448 E HA 0.293 4.643 4.350 -0.000 0.000 0.256 2448 E C -2.167 174.683 176.600 0.418 0.000 0.887 2448 E CA -0.790 55.806 56.400 0.327 0.000 0.782 2448 E CB 1.133 30.987 29.700 0.256 0.000 1.214 2448 E HN 0.650 nan 8.360 nan 0.000 0.417 2449 F N 3.747 123.912 119.950 0.359 0.000 2.438 2449 F HA 0.199 4.726 4.527 0.000 0.000 0.356 2449 F C -0.108 175.805 175.800 0.188 0.000 1.099 2449 F CA 0.104 58.257 58.000 0.254 0.000 1.185 2449 F CB 0.986 40.148 39.000 0.271 0.000 1.115 2449 F HN 0.466 nan 8.300 nan 0.000 0.526 2450 Q N 6.942 126.543 119.800 -0.332 0.000 2.695 2450 Q HA 0.291 4.631 4.340 -0.000 0.000 0.246 2450 Q C -2.285 173.584 176.000 -0.219 0.000 0.961 2450 Q CA -0.558 55.157 55.803 -0.147 0.000 0.708 2450 Q CB 0.789 29.509 28.738 -0.031 0.000 1.282 2450 Q HN 0.779 nan 8.270 nan 0.000 0.482 2451 Y N 0.723 120.815 120.300 -0.347 0.000 2.604 2451 Y HA 0.420 4.970 4.550 -0.000 0.000 0.331 2451 Y C -1.935 173.982 175.900 0.028 0.000 1.158 2451 Y CA -0.940 57.025 58.100 -0.225 0.000 1.056 2451 Y CB 1.626 39.833 38.460 -0.422 0.000 1.330 2451 Y HN 0.498 nan 8.280 nan 0.000 0.457 2452 R N 6.131 126.246 120.500 -0.641 0.000 2.312 2452 R HA 0.455 4.795 4.340 -0.000 0.000 0.310 2452 R C -2.835 173.196 176.300 -0.448 0.000 1.064 2452 R CA -2.042 53.841 56.100 -0.361 0.000 0.983 2452 R CB 0.946 31.054 30.300 -0.319 0.000 1.139 2452 R HN 0.409 nan 8.270 nan 0.000 0.536 2453 P HA -0.023 nan 4.420 nan 0.000 0.268 2453 P C 0.275 177.352 177.300 -0.372 0.000 1.205 2453 P CA 0.087 63.110 63.100 -0.128 0.000 0.771 2453 P CB 1.415 33.116 31.700 0.002 0.000 0.858 2454 S N 1.291 116.660 115.700 -0.552 0.000 2.547 2454 S HA -0.066 4.404 4.470 -0.000 0.000 0.235 2454 S C 1.230 175.461 174.600 -0.615 0.000 0.980 2454 S CA 0.394 58.251 58.200 -0.572 0.000 0.941 2454 S CB -1.134 61.702 63.200 -0.607 0.000 0.763 2454 S HN 0.411 nan 8.310 nan 0.000 0.532 2455 F N 2.172 121.848 119.950 -0.456 0.000 2.797 2455 F HA 0.292 4.819 4.527 0.000 0.000 0.302 2455 F C 1.391 176.902 175.800 -0.481 0.000 1.130 2455 F CA -0.497 57.158 58.000 -0.574 0.000 1.387 2455 F CB -0.220 38.142 39.000 -1.064 0.000 1.107 2455 F HN 0.063 nan 8.300 nan 0.000 0.577 2456 S N 0.103 115.655 115.700 -0.247 0.000 2.580 2456 S HA -0.006 4.464 4.470 -0.000 0.000 0.266 2456 S C 0.544 175.099 174.600 -0.075 0.000 1.354 2456 S CA -0.556 57.584 58.200 -0.100 0.000 1.008 2456 S CB 0.789 63.903 63.200 -0.143 0.000 0.898 2456 S HN 0.246 nan 8.310 nan 0.000 0.555 2457 S N 0.371 116.048 115.700 -0.039 0.000 2.568 2457 S HA -0.010 4.460 4.470 -0.000 0.000 0.282 2457 S C 0.799 175.309 174.600 -0.151 0.000 1.338 2457 S CA -0.507 57.672 58.200 -0.035 0.000 1.045 2457 S CB 0.147 63.391 63.200 0.074 0.000 0.873 2457 S HN 0.615 nan 8.310 nan 0.000 0.516 2458 D N 3.509 123.862 120.400 -0.078 0.000 2.264 2458 D HA -0.064 4.576 4.640 -0.000 0.000 0.208 2458 D C 1.486 177.716 176.300 -0.117 0.000 0.966 2458 D CA 1.282 55.226 54.000 -0.094 0.000 0.864 2458 D CB -0.041 40.733 40.800 -0.042 0.000 0.933 2458 D HN 0.636 nan 8.370 nan 0.000 0.499 2459 M N 0.003 119.545 119.600 -0.095 0.000 2.595 2459 M HA -0.006 4.474 4.480 -0.000 0.000 0.248 2459 M C 0.976 177.081 176.300 -0.326 0.000 1.119 2459 M CA 0.339 55.614 55.300 -0.041 0.000 1.079 2459 M CB 0.277 33.014 32.600 0.229 0.000 1.472 2459 M HN -0.280 nan 8.290 nan 0.000 0.501 2460 K N 3.416 123.342 120.400 -0.790 0.000 2.316 2460 K HA 0.212 4.532 4.320 -0.000 0.000 0.289 2460 K C -2.260 173.969 176.600 -0.619 0.000 1.070 2460 K CA -1.730 53.763 56.287 -1.323 0.000 0.928 2460 K CB 0.709 32.372 32.500 -1.395 0.000 1.039 2460 K HN -0.078 nan 8.250 nan 0.000 0.480 2461 P HA -0.063 nan 4.420 nan 0.000 0.267 2461 P C -0.258 176.922 177.300 -0.200 0.000 1.200 2461 P CA 0.050 63.015 63.100 -0.225 0.000 0.772 2461 P CB 0.755 32.386 31.700 -0.114 0.000 0.855 2462 K N 0.856 121.167 120.400 -0.149 0.000 2.281 2462 K HA -0.139 4.181 4.320 -0.000 0.000 0.203 2462 K C 1.304 177.839 176.600 -0.109 0.000 1.046 2462 K CA 1.965 58.170 56.287 -0.136 0.000 0.938 2462 K CB -1.226 31.207 32.500 -0.112 0.000 0.737 2462 K HN 0.483 nan 8.250 nan 0.000 0.458 2463 T N -1.043 113.465 114.554 -0.077 0.000 3.055 2463 T HA 0.068 4.418 4.350 -0.000 0.000 0.265 2463 T C 0.852 175.537 174.700 -0.026 0.000 1.111 2463 T CA -0.044 62.032 62.100 -0.042 0.000 1.118 2463 T CB -0.225 68.636 68.868 -0.011 0.000 0.909 2463 T HN 0.004 nan 8.240 nan 0.000 0.501 2464 V N 2.716 122.606 119.914 -0.040 0.000 2.439 2464 V HA 0.359 4.479 4.120 -0.000 0.000 0.271 2464 V C 0.060 176.148 176.094 -0.010 0.000 1.040 2464 V CA -0.349 61.953 62.300 0.004 0.000 1.002 2464 V CB -0.046 31.782 31.823 0.008 0.000 1.000 2464 V HN 0.451 nan 8.190 nan 0.000 0.477 2465 I N 3.770 124.355 120.570 0.024 0.000 2.466 2465 I HA 0.614 4.784 4.170 -0.000 0.000 0.289 2465 I C 0.857 177.028 176.117 0.090 0.000 1.026 2465 I CA -0.558 60.749 61.300 0.012 0.000 1.078 2465 I CB 1.805 39.790 38.000 -0.026 0.000 1.249 2465 I HN 0.781 nan 8.210 nan 0.000 0.429 2466 G N 3.630 112.522 108.800 0.154 0.000 2.289 2466 G HA2 -0.226 3.734 3.960 -0.000 0.000 0.280 2466 G HA3 -0.226 3.734 3.960 -0.000 0.000 0.280 2466 G C -0.353 174.694 174.900 0.245 0.000 1.089 2466 G CA -0.072 45.194 45.100 0.276 0.000 0.939 2466 G HN 0.732 nan 8.290 nan 0.000 0.499 2467 D N -0.804 119.734 120.400 0.230 0.000 2.358 2467 D HA 0.382 5.022 4.640 -0.000 0.000 0.244 2467 D C 0.930 177.365 176.300 0.225 0.000 1.163 2467 D CA -0.539 53.599 54.000 0.230 0.000 0.945 2467 D CB 0.405 41.362 40.800 0.260 0.000 1.152 2467 D HN 0.377 nan 8.370 nan 0.000 0.451 2468 H N -0.026 119.102 119.070 0.096 0.000 3.167 2468 H HA 0.252 4.808 4.556 -0.000 0.000 0.306 2468 H C 1.408 176.786 175.328 0.083 0.000 0.965 2468 H CA 1.992 58.055 56.048 0.025 0.000 1.408 2468 H CB 0.036 29.803 29.762 0.008 0.000 1.406 2468 H HN 0.597 nan 8.280 nan 0.000 0.576 2469 G N 4.172 112.734 108.800 -0.397 0.000 2.225 2469 G HA2 -0.352 3.608 3.960 -0.000 0.000 0.254 2469 G HA3 -0.352 3.608 3.960 -0.000 0.000 0.254 2469 G C 1.265 175.970 174.900 -0.326 0.000 0.988 2469 G CA 0.521 45.305 45.100 -0.527 0.000 0.625 2469 G HN 0.652 nan 8.290 nan 0.000 0.527 2470 D N 0.969 121.351 120.400 -0.030 0.000 2.221 2470 D HA -0.056 4.584 4.640 -0.000 0.000 0.204 2470 D C 2.414 178.671 176.300 -0.073 0.000 0.982 2470 D CA 1.411 55.521 54.000 0.183 0.000 0.857 2470 D CB -0.061 40.965 40.800 0.378 0.000 0.934 2470 D HN 0.731 nan 8.370 nan 0.000 0.475 2471 E N 1.062 120.890 120.200 -0.619 0.000 2.347 2471 E HA -0.120 4.230 4.350 -0.000 0.000 0.196 2471 E C 2.149 178.403 176.600 -0.577 0.000 1.008 2471 E CA 0.198 55.875 56.400 -1.204 0.000 0.852 2471 E CB -0.614 28.350 29.700 -1.227 0.000 0.783 2471 E HN 0.322 nan 8.360 nan 0.000 0.505 2472 L N -0.148 120.797 121.223 -0.464 0.000 2.042 2472 L HA -0.147 4.193 4.340 -0.000 0.000 0.210 2472 L C 2.539 179.192 176.870 -0.362 0.000 1.076 2472 L CA 1.537 56.115 54.840 -0.436 0.000 0.749 2472 L CB -0.617 41.033 42.059 -0.681 0.000 0.893 2472 L HN 0.027 nan 8.230 nan 0.000 0.432 2473 F N -0.526 119.354 119.950 -0.118 0.000 2.216 2473 F HA -0.214 4.313 4.527 -0.000 0.000 0.300 2473 F C 2.641 178.416 175.800 -0.041 0.000 1.085 2473 F CA 1.305 59.277 58.000 -0.046 0.000 1.326 2473 F CB -0.468 38.611 39.000 0.132 0.000 1.027 2473 F HN -0.000 nan 8.300 nan 0.000 0.497 2474 S N -0.143 115.593 115.700 0.059 0.000 2.348 2474 S HA -0.103 4.367 4.470 -0.000 0.000 0.219 2474 S C 2.288 176.770 174.600 -0.195 0.000 1.033 2474 S CA 0.970 59.145 58.200 -0.042 0.000 0.974 2474 S CB -0.587 62.572 63.200 -0.068 0.000 0.868 2474 S HN 0.098 nan 8.310 nan 0.000 0.459 2475 V N 1.016 120.708 119.914 -0.371 0.000 2.324 2475 V HA -0.187 3.933 4.120 -0.000 0.000 0.250 2475 V C 1.540 177.369 176.094 -0.442 0.000 1.060 2475 V CA 1.758 63.723 62.300 -0.558 0.000 1.042 2475 V CB -0.715 30.766 31.823 -0.571 0.000 0.650 2475 V HN 0.449 nan 8.190 nan 0.000 0.450 2476 F N 0.285 120.069 119.950 -0.276 0.000 2.660 2476 F HA 0.453 4.980 4.527 0.000 0.000 0.302 2476 F C 1.643 177.369 175.800 -0.123 0.000 1.103 2476 F CA 0.424 58.294 58.000 -0.217 0.000 1.340 2476 F CB -0.327 38.501 39.000 -0.286 0.000 1.048 2476 F HN 0.244 nan 8.300 nan 0.000 0.551 2477 G N 0.930 109.757 108.800 0.046 0.000 2.338 2477 G HA2 -0.280 3.680 3.960 -0.000 0.000 0.296 2477 G HA3 -0.280 3.680 3.960 -0.000 0.000 0.296 2477 G C 1.255 176.228 174.900 0.122 0.000 1.040 2477 G CA 0.316 45.514 45.100 0.164 0.000 1.004 2477 G HN 0.580 nan 8.290 nan 0.000 0.509 2478 A N 0.183 123.011 122.820 0.013 0.000 1.940 2478 A HA 0.113 4.433 4.320 -0.000 0.000 0.219 2478 A C 0.681 178.126 177.584 -0.233 0.000 1.176 2478 A CA 2.100 54.034 52.037 -0.171 0.000 0.631 2478 A CB -0.757 18.064 19.000 -0.298 0.000 0.814 2478 A HN 0.484 nan 8.150 nan 0.000 0.446 2479 P HA -0.137 nan 4.420 nan 0.000 0.220 2479 P C 0.516 177.547 177.300 -0.449 0.000 1.144 2479 P CA 1.035 63.992 63.100 -0.239 0.000 0.800 2479 P CB -0.158 31.239 31.700 -0.505 0.000 0.772 2480 F N -2.874 117.097 119.950 0.036 0.000 2.695 2480 F HA 0.226 4.753 4.527 -0.000 0.000 0.303 2480 F C 1.768 177.602 175.800 0.056 0.000 1.091 2480 F CA 0.225 58.266 58.000 0.067 0.000 1.300 2480 F CB -0.178 38.871 39.000 0.081 0.000 1.071 2480 F HN -0.183 nan 8.300 nan 0.000 0.578 2481 L N -1.307 119.980 121.223 0.107 0.000 2.624 2481 L HA 0.224 4.564 4.340 -0.000 0.000 0.222 2481 L C 0.805 177.672 176.870 -0.004 0.000 1.046 2481 L CA 0.193 55.069 54.840 0.059 0.000 0.872 2481 L CB 0.127 42.199 42.059 0.021 0.000 1.190 2481 L HN -0.196 nan 8.230 nan 0.000 0.487 2482 K N 0.843 121.193 120.400 -0.084 0.000 2.109 2482 K HA 0.271 4.591 4.320 -0.000 0.000 0.243 2482 K C -0.354 176.278 176.600 0.054 0.000 1.006 2482 K CA -0.394 55.846 56.287 -0.078 0.000 0.917 2482 K CB 1.349 33.652 32.500 -0.328 0.000 1.081 2482 K HN -0.093 nan 8.250 nan 0.000 0.468 2483 E N -0.546 119.713 120.200 0.097 0.000 2.204 2483 E HA 0.305 4.655 4.350 -0.000 0.000 0.276 2483 E C -0.095 176.588 176.600 0.138 0.000 0.974 2483 E CA -0.186 56.273 56.400 0.099 0.000 0.815 2483 E CB 1.116 30.852 29.700 0.061 0.000 1.119 2483 E HN 0.714 nan 8.360 nan 0.000 0.393 2484 G N 2.207 111.052 108.800 0.075 0.000 2.130 2484 G HA2 -0.212 3.748 3.960 -0.000 0.000 0.216 2484 G HA3 -0.212 3.748 3.960 -0.000 0.000 0.216 2484 G C 0.073 174.928 174.900 -0.076 0.000 0.999 2484 G CA -0.058 45.047 45.100 0.009 0.000 0.686 2484 G HN 0.736 nan 8.290 nan 0.000 0.515 2485 A N 0.209 123.013 122.820 -0.027 0.000 2.340 2485 A HA 0.813 5.133 4.320 -0.000 0.000 0.268 2485 A C 1.018 178.523 177.584 -0.131 0.000 1.100 2485 A CA 0.819 52.764 52.037 -0.153 0.000 0.803 2485 A CB 0.567 19.581 19.000 0.023 0.000 1.043 2485 A HN 1.980 nan 8.150 nan 0.000 0.488 2486 S N 0.515 116.122 115.700 -0.155 0.000 2.632 2486 S HA 0.228 4.698 4.470 -0.000 0.000 0.267 2486 S C 0.858 175.419 174.600 -0.066 0.000 1.276 2486 S CA 0.366 58.510 58.200 -0.093 0.000 0.998 2486 S CB 1.083 64.235 63.200 -0.079 0.000 0.953 2486 S HN 0.773 nan 8.310 nan 0.000 0.547 2487 E N 0.798 120.973 120.200 -0.042 0.000 2.118 2487 E HA -0.213 4.137 4.350 -0.000 0.000 0.195 2487 E C 1.820 178.402 176.600 -0.029 0.000 0.992 2487 E CA 2.005 58.389 56.400 -0.027 0.000 0.804 2487 E CB -0.375 29.318 29.700 -0.012 0.000 0.741 2487 E HN 0.872 nan 8.360 nan 0.000 0.458 2488 E N 0.075 120.262 120.200 -0.023 0.000 2.072 2488 E HA -0.238 4.112 4.350 -0.000 0.000 0.191 2488 E C 1.982 178.543 176.600 -0.065 0.000 0.985 2488 E CA 1.231 57.616 56.400 -0.025 0.000 0.801 2488 E CB -0.146 29.569 29.700 0.024 0.000 0.750 2488 E HN 0.394 nan 8.360 nan 0.000 0.452 2489 E N 0.090 120.268 120.200 -0.036 0.000 2.153 2489 E HA -0.162 4.188 4.350 -0.000 0.000 0.194 2489 E C 2.053 178.593 176.600 -0.101 0.000 0.988 2489 E CA 1.026 57.394 56.400 -0.054 0.000 0.811 2489 E CB 0.017 29.697 29.700 -0.033 0.000 0.746 2489 E HN 0.364 nan 8.360 nan 0.000 0.466 2490 I N 0.236 120.735 120.570 -0.117 0.000 2.233 2490 I HA -0.242 3.928 4.170 -0.000 0.000 0.243 2490 I C 2.464 178.570 176.117 -0.017 0.000 1.093 2490 I CA 0.928 62.129 61.300 -0.166 0.000 1.380 2490 I CB -0.153 37.766 38.000 -0.134 0.000 1.067 2490 I HN 0.030 nan 8.210 nan 0.000 0.413 2491 R N 0.177 120.668 120.500 -0.014 0.000 2.096 2491 R HA -0.177 4.163 4.340 -0.000 0.000 0.235 2491 R C 2.265 178.544 176.300 -0.035 0.000 1.127 2491 R CA 1.186 57.286 56.100 0.002 0.000 0.968 2491 R CB -0.476 29.813 30.300 -0.019 0.000 0.861 2491 R HN 0.236 nan 8.270 nan 0.000 0.440 2492 L N 0.469 121.633 121.223 -0.099 0.000 2.046 2492 L HA -0.134 4.206 4.340 -0.000 0.000 0.208 2492 L C 2.333 179.162 176.870 -0.070 0.000 1.077 2492 L CA 1.834 56.589 54.840 -0.142 0.000 0.747 2492 L CB -0.618 41.247 42.059 -0.325 0.000 0.896 2492 L HN 0.012 nan 8.230 nan 0.000 0.432 2493 S N -1.035 114.646 115.700 -0.032 0.000 2.383 2493 S HA -0.186 4.284 4.470 -0.000 0.000 0.227 2493 S C 2.067 176.696 174.600 0.049 0.000 1.026 2493 S CA 1.274 59.483 58.200 0.014 0.000 0.981 2493 S CB -0.192 63.041 63.200 0.055 0.000 0.818 2493 S HN 0.508 nan 8.310 nan 0.000 0.472 2494 K N 0.497 120.967 120.400 0.116 0.000 2.057 2494 K HA -0.092 4.228 4.320 -0.000 0.000 0.207 2494 K C 2.319 178.903 176.600 -0.026 0.000 1.049 2494 K CA 1.649 57.978 56.287 0.070 0.000 0.931 2494 K CB -0.295 32.281 32.500 0.126 0.000 0.714 2494 K HN 0.453 nan 8.250 nan 0.000 0.440 2495 M N 0.844 120.406 119.600 -0.062 0.000 2.086 2495 M HA -0.176 4.304 4.480 -0.000 0.000 0.261 2495 M C 2.016 178.228 176.300 -0.146 0.000 1.067 2495 M CA 1.581 56.777 55.300 -0.173 0.000 1.116 2495 M CB 0.012 32.520 32.600 -0.153 0.000 1.348 2495 M HN -0.050 nan 8.290 nan 0.000 0.407 2496 V N 1.037 120.931 119.914 -0.034 0.000 2.295 2496 V HA -0.330 3.790 4.120 -0.000 0.000 0.246 2496 V C 2.465 178.520 176.094 -0.064 0.000 1.049 2496 V CA 2.085 64.369 62.300 -0.027 0.000 1.024 2496 V CB -0.640 31.004 31.823 -0.299 0.000 0.648 2496 V HN 0.563 nan 8.190 nan 0.000 0.447 2497 M N -0.633 118.892 119.600 -0.124 0.000 2.149 2497 M HA -0.242 4.238 4.480 -0.000 0.000 0.261 2497 M C 2.340 178.682 176.300 0.071 0.000 1.064 2497 M CA 1.900 57.149 55.300 -0.084 0.000 1.102 2497 M CB -0.507 32.026 32.600 -0.112 0.000 1.369 2497 M HN 0.227 nan 8.290 nan 0.000 0.408 2498 K N 0.191 120.618 120.400 0.045 0.000 2.097 2498 K HA -0.097 4.223 4.320 -0.000 0.000 0.205 2498 K C 1.746 178.465 176.600 0.198 0.000 1.050 2498 K CA 1.256 57.577 56.287 0.057 0.000 0.938 2498 K CB -0.063 32.405 32.500 -0.052 0.000 0.718 2498 K HN 0.212 nan 8.250 nan 0.000 0.442 2499 F N -0.490 119.614 119.950 0.257 0.000 2.102 2499 F HA -0.244 4.283 4.527 -0.000 0.000 0.298 2499 F C 2.266 178.287 175.800 0.367 0.000 1.105 2499 F CA 0.643 58.860 58.000 0.363 0.000 1.239 2499 F CB -0.127 39.255 39.000 0.637 0.000 0.991 2499 F HN 0.231 nan 8.300 nan 0.000 0.474 2500 W N -0.050 121.377 121.300 0.212 0.000 2.358 2500 W HA -0.212 4.448 4.660 -0.000 0.000 0.303 2500 W C 2.571 179.118 176.519 0.047 0.000 1.208 2500 W CA 0.915 58.302 57.345 0.070 0.000 1.274 2500 W CB -0.492 28.945 29.460 -0.038 0.000 1.138 2500 W HN -0.011 nan 8.180 nan 0.000 0.515 2501 A N 0.474 123.445 122.820 0.252 0.000 1.929 2501 A HA -0.191 4.129 4.320 -0.000 0.000 0.216 2501 A C 1.676 179.318 177.584 0.096 0.000 1.176 2501 A CA 1.633 53.737 52.037 0.113 0.000 0.628 2501 A CB -0.927 18.118 19.000 0.075 0.000 0.816 2501 A HN 0.205 nan 8.150 nan 0.000 0.444 2502 N N -0.877 117.906 118.700 0.139 0.000 2.166 2502 N HA -0.127 4.613 4.740 -0.000 0.000 0.186 2502 N C 1.306 176.853 175.510 0.061 0.000 1.019 2502 N CA 1.330 54.439 53.050 0.099 0.000 0.856 2502 N CB -0.566 38.008 38.487 0.143 0.000 0.993 2502 N HN 0.530 nan 8.380 nan 0.000 0.426 2503 F N 1.380 121.279 119.950 -0.085 0.000 2.234 2503 F HA 0.046 4.573 4.527 -0.000 0.000 0.299 2503 F C 2.091 177.822 175.800 -0.114 0.000 1.087 2503 F CA 0.878 58.768 58.000 -0.184 0.000 1.340 2503 F CB -0.281 38.517 39.000 -0.336 0.000 1.031 2503 F HN 0.019 nan 8.300 nan 0.000 0.500 2504 A N 1.363 124.146 122.820 -0.063 0.000 1.930 2504 A HA -0.177 4.143 4.320 -0.000 0.000 0.217 2504 A C 2.305 179.809 177.584 -0.134 0.000 1.175 2504 A CA 1.745 53.712 52.037 -0.116 0.000 0.627 2504 A CB -0.657 18.315 19.000 -0.047 0.000 0.815 2504 A HN 0.564 nan 8.150 nan 0.000 0.443 2505 R N -1.850 118.593 120.500 -0.095 0.000 2.189 2505 R HA 0.157 4.497 4.340 -0.000 0.000 0.203 2505 R C 0.551 176.788 176.300 -0.106 0.000 1.012 2505 R CA 1.078 57.130 56.100 -0.080 0.000 1.015 2505 R CB -0.168 30.111 30.300 -0.034 0.000 0.938 2505 R HN 0.352 nan 8.270 nan 0.000 0.472 2506 N N 0.065 118.683 118.700 -0.137 0.000 2.210 2506 N HA 0.092 4.832 4.740 -0.000 0.000 0.203 2506 N C 0.658 176.052 175.510 -0.194 0.000 1.175 2506 N CA 0.886 53.863 53.050 -0.122 0.000 0.894 2506 N CB 1.465 39.919 38.487 -0.056 0.000 1.041 2506 N HN 0.442 nan 8.380 nan 0.000 0.506 2507 G N 1.544 110.087 108.800 -0.429 0.000 2.160 2507 G HA2 -0.261 3.699 3.960 -0.000 0.000 0.251 2507 G HA3 -0.261 3.699 3.960 -0.000 0.000 0.251 2507 G C -0.167 174.597 174.900 -0.226 0.000 1.008 2507 G CA 0.283 44.996 45.100 -0.644 0.000 0.724 2507 G HN 0.455 nan 8.290 nan 0.000 0.514 2508 N N -0.575 118.047 118.700 -0.130 0.000 2.503 2508 N HA 0.366 5.106 4.740 -0.000 0.000 0.287 2508 N C -1.670 173.756 175.510 -0.139 0.000 1.096 2508 N CA -1.233 51.770 53.050 -0.079 0.000 0.936 2508 N CB 2.283 40.792 38.487 0.036 0.000 1.570 2508 N HN -0.058 nan 8.380 nan 0.000 0.504 2509 P HA -0.051 nan 4.420 nan 0.000 0.222 2509 P C -0.161 177.233 177.300 0.156 0.000 1.153 2509 P CA 0.504 63.482 63.100 -0.203 0.000 0.798 2509 P CB 0.337 31.535 31.700 -0.836 0.000 0.796 2510 N N 0.839 119.582 118.700 0.072 0.000 2.395 2510 N HA 0.233 4.973 4.740 -0.000 0.000 0.246 2510 N C 0.887 176.513 175.510 0.193 0.000 1.246 2510 N CA 1.230 54.421 53.050 0.236 0.000 0.879 2510 N CB 0.412 39.018 38.487 0.199 0.000 1.098 2510 N HN 0.169 nan 8.380 nan 0.000 0.444 2511 G N -0.185 108.731 108.800 0.194 0.000 2.523 2511 G HA2 0.213 4.173 3.960 -0.000 0.000 0.291 2511 G HA3 0.213 4.173 3.960 -0.000 0.000 0.291 2511 G C -1.283 173.673 174.900 0.093 0.000 1.450 2511 G CA -0.764 44.406 45.100 0.116 0.000 0.790 2511 G HN 0.591 nan 8.290 nan 0.000 0.496 2512 E N -0.678 119.560 120.200 0.064 0.000 2.415 2512 E HA 0.406 4.756 4.350 -0.000 0.000 0.262 2512 E C 1.119 177.735 176.600 0.026 0.000 1.038 2512 E CA 0.348 56.778 56.400 0.050 0.000 0.921 2512 E CB 0.856 30.578 29.700 0.038 0.000 0.950 2512 E HN 2.093 nan 8.360 nan 0.000 0.438 2513 G N 2.432 111.248 108.800 0.026 0.000 2.184 2513 G HA2 -0.274 3.686 3.960 -0.000 0.000 0.264 2513 G HA3 -0.274 3.686 3.960 -0.000 0.000 0.264 2513 G C -0.018 174.869 174.900 -0.022 0.000 0.975 2513 G CA 0.453 45.555 45.100 0.004 0.000 0.642 2513 G HN 0.430 nan 8.290 nan 0.000 0.536 2514 L N 1.375 122.593 121.223 -0.007 0.000 2.342 2514 L HA 0.569 4.909 4.340 -0.000 0.000 0.271 2514 L C -1.639 175.308 176.870 0.128 0.000 1.008 2514 L CA -2.413 52.396 54.840 -0.050 0.000 0.818 2514 L CB 1.838 43.755 42.059 -0.236 0.000 1.296 2514 L HN -0.075 nan 8.230 nan 0.000 0.427 2515 P HA -0.000 nan 4.420 nan 0.000 0.269 2515 P C -0.869 176.655 177.300 0.373 0.000 1.209 2515 P CA -0.187 63.060 63.100 0.246 0.000 0.776 2515 P CB 0.452 32.270 31.700 0.196 0.000 0.876 2516 H N 2.117 121.325 119.070 0.230 0.000 3.004 2516 H HA 0.091 4.647 4.556 0.000 0.000 0.316 2516 H C -0.947 174.567 175.328 0.311 0.000 1.014 2516 H CA 0.329 56.533 56.048 0.260 0.000 1.454 2516 H CB 0.116 29.985 29.762 0.180 0.000 1.472 2516 H HN 0.382 nan 8.280 nan 0.000 0.571 2517 W N 9.925 130.924 121.300 -0.501 0.000 2.296 2517 W HA 0.313 4.973 4.660 -0.000 0.000 0.316 2517 W C -2.810 173.442 176.519 -0.445 0.000 1.022 2517 W CA -3.238 53.887 57.345 -0.366 0.000 1.324 2517 W CB 0.893 30.141 29.460 -0.354 0.000 1.227 2517 W HN 0.570 nan 8.180 nan 0.000 0.409 2518 P HA 0.038 nan 4.420 nan 0.000 0.275 2518 P C -0.321 177.199 177.300 0.366 0.000 1.228 2518 P CA 0.154 63.402 63.100 0.246 0.000 0.786 2518 P CB 1.463 33.334 31.700 0.284 0.000 0.927 2519 E N 1.779 122.096 120.200 0.195 0.000 2.383 2519 E HA -0.024 4.326 4.350 -0.000 0.000 0.264 2519 E C -0.908 175.677 176.600 -0.025 0.000 1.050 2519 E CA -0.529 55.763 56.400 -0.180 0.000 0.896 2519 E CB 0.209 29.762 29.700 -0.246 0.000 0.982 2519 E HN 0.352 nan 8.360 nan 0.000 0.424 2520 Y N 5.537 125.705 120.300 -0.220 0.000 2.530 2520 Y HA 0.091 4.641 4.550 0.000 0.000 0.340 2520 Y C -0.461 175.412 175.900 -0.046 0.000 1.247 2520 Y CA -0.302 57.771 58.100 -0.045 0.000 1.727 2520 Y CB -0.767 37.677 38.460 -0.028 0.000 1.613 2520 Y HN 0.517 nan 8.280 nan 0.000 0.464 2521 N N 0.329 118.876 118.700 -0.255 0.000 2.909 2521 N HA 0.115 4.855 4.740 -0.000 0.000 0.326 2521 N C 0.720 176.052 175.510 -0.296 0.000 1.368 2521 N CA -0.395 52.524 53.050 -0.218 0.000 0.797 2521 N CB 0.186 38.611 38.487 -0.102 0.000 1.150 2521 N HN 0.201 nan 8.380 nan 0.000 0.550 2522 Q N -0.320 119.381 119.800 -0.166 0.000 2.291 2522 Q HA -0.028 4.312 4.340 -0.000 0.000 0.206 2522 Q C 0.903 176.828 176.000 -0.125 0.000 0.976 2522 Q CA 1.272 56.993 55.803 -0.136 0.000 0.875 2522 Q CB -0.333 28.361 28.738 -0.073 0.000 0.927 2522 Q HN 0.618 nan 8.270 nan 0.000 0.450 2523 K N 0.520 120.855 120.400 -0.108 0.000 2.418 2523 K HA -0.002 4.317 4.320 -0.000 0.000 0.195 2523 K C -0.094 176.465 176.600 -0.067 0.000 1.035 2523 K CA -0.043 56.212 56.287 -0.053 0.000 1.003 2523 K CB 0.308 32.804 32.500 -0.006 0.000 0.793 2523 K HN 0.172 nan 8.250 nan 0.000 0.494 2524 E N 0.316 120.372 120.200 -0.240 0.000 2.252 2524 E HA -0.165 4.185 4.350 -0.000 0.000 0.218 2524 E C -0.011 176.674 176.600 0.142 0.000 1.253 2524 E CA 0.086 56.270 56.400 -0.360 0.000 0.705 2524 E CB -1.622 27.970 29.700 -0.180 0.000 1.172 2524 E HN 0.503 nan 8.360 nan 0.000 0.369 2525 G N 0.747 109.648 108.800 0.168 0.000 2.503 2525 G HA2 0.455 4.415 3.960 -0.000 0.000 0.257 2525 G HA3 0.455 4.415 3.960 -0.000 0.000 0.257 2525 G C -0.374 174.833 174.900 0.513 0.000 1.214 2525 G CA 0.006 45.277 45.100 0.286 0.000 0.839 2525 G HN 0.341 nan 8.290 nan 0.000 0.559 2526 Y N -0.622 119.822 120.300 0.239 0.000 2.656 2526 Y HA 0.657 5.207 4.550 0.000 0.000 0.334 2526 Y C -1.581 174.313 175.900 -0.010 0.000 1.179 2526 Y CA -1.754 56.479 58.100 0.221 0.000 1.050 2526 Y CB 1.386 39.958 38.460 0.186 0.000 1.308 2526 Y HN 0.569 nan 8.280 nan 0.000 0.456 2527 L N 2.827 123.884 121.223 -0.277 0.000 2.289 2527 L HA 0.464 4.804 4.340 -0.000 0.000 0.285 2527 L C -0.713 175.986 176.870 -0.285 0.000 1.049 2527 L CA -0.335 54.133 54.840 -0.619 0.000 0.804 2527 L CB 1.583 42.731 42.059 -1.519 0.000 1.195 2527 L HN 0.773 nan 8.230 nan 0.000 0.428 2528 Q N 6.131 125.772 119.800 -0.266 0.000 2.398 2528 Q HA 0.436 4.776 4.340 -0.000 0.000 0.251 2528 Q C -0.969 174.964 176.000 -0.113 0.000 0.999 2528 Q CA -0.150 55.603 55.803 -0.084 0.000 0.874 2528 Q CB 1.302 29.988 28.738 -0.086 0.000 1.215 2528 Q HN 0.576 nan 8.270 nan 0.000 0.470 2529 I N 1.946 122.467 120.570 -0.082 0.000 2.331 2529 I HA 0.634 4.804 4.170 -0.000 0.000 0.292 2529 I C 0.693 176.633 176.117 -0.295 0.000 0.998 2529 I CA -0.158 61.062 61.300 -0.133 0.000 1.267 2529 I CB 1.306 39.289 38.000 -0.028 0.000 1.386 2529 I HN 0.736 nan 8.210 nan 0.000 0.476 2530 G N 3.221 111.857 108.800 -0.273 0.000 2.364 2530 G HA2 0.368 4.328 3.960 -0.000 0.000 0.286 2530 G HA3 0.368 4.328 3.960 -0.000 0.000 0.286 2530 G C 0.316 175.093 174.900 -0.205 0.000 1.241 2530 G CA 0.030 44.946 45.100 -0.307 0.000 0.887 2530 G HN 0.555 nan 8.290 nan 0.000 0.484 2531 A N -0.452 122.337 122.820 -0.050 0.000 1.927 2531 A HA -0.001 4.319 4.320 -0.000 0.000 0.220 2531 A C 1.019 178.576 177.584 -0.046 0.000 1.185 2531 A CA 1.901 53.927 52.037 -0.017 0.000 0.639 2531 A CB -0.687 18.370 19.000 0.095 0.000 0.820 2531 A HN 0.597 nan 8.150 nan 0.000 0.451 2532 N N -0.625 118.052 118.700 -0.038 0.000 2.443 2532 N HA 0.409 5.149 4.740 -0.000 0.000 0.269 2532 N C -1.492 173.989 175.510 -0.047 0.000 0.985 2532 N CA -0.237 52.793 53.050 -0.033 0.000 0.921 2532 N CB 1.622 40.098 38.487 -0.018 0.000 1.195 2532 N HN 0.060 nan 8.380 nan 0.000 0.492 2533 T N 3.007 117.538 114.554 -0.039 0.000 2.767 2533 T HA 0.340 4.690 4.350 -0.000 0.000 0.284 2533 T C -0.486 174.197 174.700 -0.029 0.000 0.973 2533 T CA -0.611 61.465 62.100 -0.042 0.000 0.996 2533 T CB 0.867 69.735 68.868 -0.000 0.000 0.927 2533 T HN 0.455 nan 8.240 nan 0.000 0.456 2534 Q N 1.536 121.294 119.800 -0.071 0.000 2.522 2534 Q HA 0.677 5.017 4.340 -0.000 0.000 0.285 2534 Q C -1.517 174.397 176.000 -0.144 0.000 0.982 2534 Q CA -1.179 54.587 55.803 -0.063 0.000 0.805 2534 Q CB 1.536 30.250 28.738 -0.040 0.000 1.457 2534 Q HN 0.600 nan 8.270 nan 0.000 0.394 2535 A N 0.604 123.360 122.820 -0.106 0.000 2.351 2535 A HA 0.836 5.156 4.320 -0.000 0.000 0.257 2535 A C -0.334 177.113 177.584 -0.228 0.000 1.087 2535 A CA 0.493 52.430 52.037 -0.168 0.000 0.798 2535 A CB 0.349 19.344 19.000 -0.009 0.000 1.033 2535 A HN 1.145 nan 8.150 nan 0.000 0.488 2536 A N 0.932 123.497 122.820 -0.424 0.000 2.567 2536 A HA 0.766 5.086 4.320 -0.000 0.000 0.289 2536 A C -0.803 176.633 177.584 -0.246 0.000 1.177 2536 A CA -0.594 51.206 52.037 -0.395 0.000 0.694 2536 A CB 1.049 19.706 19.000 -0.572 0.000 1.292 2536 A HN 0.837 nan 8.150 nan 0.000 0.425 2537 Q N 0.190 120.025 119.800 0.059 0.000 2.451 2537 Q HA 0.522 4.862 4.340 -0.000 0.000 0.281 2537 Q C -1.325 174.911 176.000 0.394 0.000 1.099 2537 Q CA -1.158 54.804 55.803 0.265 0.000 0.806 2537 Q CB 1.742 30.563 28.738 0.138 0.000 1.419 2537 Q HN 0.544 nan 8.270 nan 0.000 0.427 2538 K N 1.026 121.622 120.400 0.326 0.000 3.939 2538 K HA -0.186 4.134 4.320 -0.000 0.000 0.281 2538 K C -1.052 175.644 176.600 0.161 0.000 0.981 2538 K CA 0.193 56.609 56.287 0.215 0.000 0.833 2538 K CB -1.431 31.156 32.500 0.146 0.000 1.501 2538 K HN 0.572 nan 8.250 nan 0.000 0.445 2539 L N 2.616 123.836 121.223 -0.004 0.000 2.361 2539 L HA 0.124 4.464 4.340 -0.000 0.000 0.278 2539 L C 0.761 177.570 176.870 -0.102 0.000 1.113 2539 L CA 0.592 55.234 54.840 -0.330 0.000 0.849 2539 L CB 0.368 41.888 42.059 -0.898 0.000 1.155 2539 L HN 0.398 nan 8.230 nan 0.000 0.452 2540 K N 2.847 123.226 120.400 -0.034 0.000 3.130 2540 K HA -0.293 4.027 4.320 -0.000 0.000 0.282 2540 K C 1.050 177.703 176.600 0.087 0.000 1.145 2540 K CA 1.255 57.569 56.287 0.045 0.000 0.831 2540 K CB -1.648 30.878 32.500 0.042 0.000 1.226 2540 K HN 0.979 nan 8.250 nan 0.000 0.478 2541 D N 1.171 121.619 120.400 0.080 0.000 2.106 2541 D HA -0.182 4.458 4.640 -0.000 0.000 0.191 2541 D C 1.428 177.788 176.300 0.100 0.000 0.997 2541 D CA 1.645 55.701 54.000 0.093 0.000 0.834 2541 D CB 0.239 41.089 40.800 0.084 0.000 0.956 2541 D HN 0.476 nan 8.370 nan 0.000 0.448 2542 K N -0.055 120.393 120.400 0.081 0.000 2.147 2542 K HA -0.154 4.166 4.320 -0.000 0.000 0.205 2542 K C 2.209 178.881 176.600 0.121 0.000 1.049 2542 K CA 1.089 57.417 56.287 0.069 0.000 0.936 2542 K CB 0.021 32.528 32.500 0.011 0.000 0.722 2542 K HN 0.116 nan 8.250 nan 0.000 0.446 2543 E N 0.409 120.711 120.200 0.169 0.000 2.072 2543 E HA -0.132 4.218 4.350 -0.000 0.000 0.191 2543 E C 1.979 178.856 176.600 0.462 0.000 0.985 2543 E CA 0.868 57.475 56.400 0.345 0.000 0.801 2543 E CB -0.188 29.750 29.700 0.397 0.000 0.750 2543 E HN -0.022 nan 8.360 nan 0.000 0.452 2544 V N 1.101 121.201 119.914 0.309 0.000 2.287 2544 V HA -0.308 3.812 4.120 -0.000 0.000 0.248 2544 V C 2.216 178.455 176.094 0.242 0.000 1.053 2544 V CA 1.909 64.375 62.300 0.277 0.000 1.027 2544 V CB -0.919 31.009 31.823 0.176 0.000 0.646 2544 V HN 0.365 nan 8.190 nan 0.000 0.447 2545 A N -0.262 122.666 122.820 0.180 0.000 1.865 2545 A HA -0.264 4.056 4.320 -0.000 0.000 0.217 2545 A C 2.128 179.775 177.584 0.105 0.000 1.191 2545 A CA 2.196 54.308 52.037 0.125 0.000 0.623 2545 A CB -0.821 18.237 19.000 0.097 0.000 0.826 2545 A HN 0.521 nan 8.150 nan 0.000 0.444 2546 F N -0.720 119.208 119.950 -0.036 0.000 2.065 2546 F HA -0.240 4.287 4.527 -0.000 0.000 0.298 2546 F C 2.048 177.711 175.800 -0.228 0.000 1.112 2546 F CA 2.050 59.935 58.000 -0.191 0.000 1.212 2546 F CB -0.663 38.127 39.000 -0.351 0.000 0.975 2546 F HN 0.398 nan 8.300 nan 0.000 0.476 2547 W N 0.436 121.712 121.300 -0.039 0.000 2.358 2547 W HA -0.149 4.511 4.660 0.000 0.000 0.303 2547 W C 2.635 179.098 176.519 -0.093 0.000 1.208 2547 W CA 1.748 58.981 57.345 -0.185 0.000 1.274 2547 W CB -1.117 28.421 29.460 0.130 0.000 1.138 2547 W HN -0.115 nan 8.180 nan 0.000 0.515 2548 T N 0.009 114.705 114.554 0.236 0.000 2.720 2548 T HA -0.288 4.062 4.350 -0.000 0.000 0.268 2548 T C 1.419 176.161 174.700 0.070 0.000 1.037 2548 T CA 1.843 64.058 62.100 0.192 0.000 1.144 2548 T CB -0.596 68.355 68.868 0.138 0.000 0.864 2548 T HN 0.151 nan 8.240 nan 0.000 0.444 2549 N N 0.679 119.342 118.700 -0.062 0.000 2.188 2549 N HA -0.028 4.712 4.740 -0.000 0.000 0.184 2549 N C 1.690 177.074 175.510 -0.210 0.000 1.018 2549 N CA 0.595 53.572 53.050 -0.122 0.000 0.858 2549 N CB -0.384 38.013 38.487 -0.150 0.000 0.989 2549 N HN 0.213 nan 8.380 nan 0.000 0.426 2550 L N -0.518 120.445 121.223 -0.434 0.000 2.056 2550 L HA 0.122 4.462 4.340 -0.000 0.000 0.207 2550 L C 1.466 178.189 176.870 -0.244 0.000 1.078 2550 L CA 1.572 56.107 54.840 -0.509 0.000 0.749 2550 L CB -0.721 40.759 42.059 -0.964 0.000 0.901 2550 L HN 0.193 nan 8.230 nan 0.000 0.433 2551 F N -0.791 119.144 119.950 -0.025 0.000 2.699 2551 F HA 0.003 4.530 4.527 0.000 0.000 0.298 2551 F C 2.208 178.011 175.800 0.005 0.000 1.154 2551 F CA 0.355 58.371 58.000 0.027 0.000 1.457 2551 F CB -0.275 38.760 39.000 0.057 0.000 1.106 2551 F HN 0.214 nan 8.300 nan 0.000 0.585 2552 A N -0.289 122.612 122.820 0.135 0.000 2.178 2552 A HA 0.043 4.363 4.320 -0.000 0.000 0.211 2552 A C 1.179 178.793 177.584 0.051 0.000 1.157 2552 A CA 0.094 52.179 52.037 0.081 0.000 0.780 2552 A CB -0.185 18.841 19.000 0.044 0.000 0.828 2552 A HN 0.145 nan 8.150 nan 0.000 0.476 2553 K N 0.000 120.422 120.400 0.036 0.000 2.780 2553 K HA 0.000 4.320 4.320 -0.000 0.000 0.191 2553 K CA 0.000 56.299 56.287 0.021 0.000 0.838 2553 K CB 0.000 32.492 32.500 -0.014 0.000 1.064 2553 K HN 0.000 nan 8.250 nan 0.000 0.543