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 2ovr_1_B DATA FIRST_RESID 2263 DATA SEQUENCE TQVKHMMQVI EPQFQRDFIS LLPKELALYV LSFLEPKDLL QAAQTCRYWR DATA SEQUENCE ILAEDNLLWR EKCKEEGIDE PLHIKRXXVI KPGFIHSPWK SAYIRQHRID DATA SEQUENCE TNWRRGELKS PKVLKGHDDH VITCLQFCGN RIVSGSDDNT LKVWSAVTGK DATA SEQUENCE CLRTLVGHTG GVWSSQMRDN IIISGSTDRT LKVWNAETGE CIHTLYGHTS DATA SEQUENCE TVRCMHLHEK RVVSGSRDAT LRVWDIETGQ CLHVLMGHVA AVRCVQYDGR DATA SEQUENCE RVVSGAYDFM VKVWDPETET CLHTLQGHTN RVYSLQFDGI HVVSGSLDTS DATA SEQUENCE IRVWDVETGN CIHTLTGHQS LTSGMELKDN ILVSGNADST VKIWDIKTGQ DATA SEQUENCE CLQTLQGPNK HQSAVTCLQF NKNFVITSSD DGTVKLWDLK TGEFIRNLVT DATA SEQUENCE LESGGSGGVV WRIRASNTKL VCAVGSRNGT EETKLLVLDF DVDM 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 2263 T HA 0.000 nan 4.350 nan 0.000 0.228 2263 T C 0.000 174.743 174.700 0.072 0.000 1.109 2263 T CA 0.000 62.133 62.100 0.056 0.000 1.349 2263 T CB 0.000 68.914 68.868 0.077 0.000 0.612 2264 Q N -0.522 119.362 119.800 0.140 0.000 2.384 2264 Q HA -0.255 4.085 4.340 0.001 0.000 0.179 2264 Q C 1.265 177.275 176.000 0.017 0.000 2.853 2264 Q CA 2.443 58.293 55.803 0.078 0.000 0.358 2264 Q CB -1.630 27.128 28.738 0.033 0.000 0.345 2264 Q HN 0.585 nan 8.270 nan 0.000 0.478 2265 V N 0.863 120.775 119.914 -0.005 0.000 2.649 2265 V HA -0.100 4.020 4.120 0.001 0.000 0.248 2265 V C 2.261 178.329 176.094 -0.044 0.000 1.054 2265 V CA 1.969 64.235 62.300 -0.056 0.000 1.073 2265 V CB -0.337 31.451 31.823 -0.058 0.000 0.699 2265 V HN 0.236 nan 8.190 nan 0.000 0.463 2266 K N -1.027 119.366 120.400 -0.012 0.000 2.031 2266 K HA -0.107 4.213 4.320 0.001 0.000 0.205 2266 K C 2.264 178.850 176.600 -0.024 0.000 1.049 2266 K CA 1.044 57.315 56.287 -0.027 0.000 0.939 2266 K CB -0.289 32.183 32.500 -0.047 0.000 0.717 2266 K HN 0.451 nan 8.250 nan 0.000 0.438 2267 H N 0.735 119.781 119.070 -0.040 0.000 2.321 2267 H HA -0.141 4.416 4.556 0.000 0.000 0.295 2267 H C 2.177 177.473 175.328 -0.052 0.000 1.102 2267 H CA 1.651 57.675 56.048 -0.039 0.000 1.266 2267 H CB 0.079 29.813 29.762 -0.047 0.000 1.363 2267 H HN 0.151 nan 8.280 nan 0.000 0.492 2268 M N -0.465 119.165 119.600 0.050 0.000 2.086 2268 M HA -0.180 4.300 4.480 0.001 0.000 0.261 2268 M C 2.458 178.754 176.300 -0.006 0.000 1.067 2268 M CA 1.135 56.411 55.300 -0.040 0.000 1.116 2268 M CB -0.656 31.846 32.600 -0.164 0.000 1.348 2268 M HN 0.248 nan 8.290 nan 0.000 0.407 2269 M N -0.036 119.558 119.600 -0.009 0.000 2.117 2269 M HA -0.199 4.281 4.480 0.001 0.000 0.262 2269 M C 2.077 178.407 176.300 0.050 0.000 1.065 2269 M CA 1.688 57.005 55.300 0.030 0.000 1.114 2269 M CB -1.329 31.291 32.600 0.034 0.000 1.361 2269 M HN 0.384 nan 8.290 nan 0.000 0.408 2270 Q N -0.306 119.511 119.800 0.028 0.000 2.046 2270 Q HA -0.099 4.241 4.340 0.001 0.000 0.200 2270 Q C 2.260 178.286 176.000 0.043 0.000 0.975 2270 Q CA 1.346 57.164 55.803 0.025 0.000 0.836 2270 Q CB -0.204 28.526 28.738 -0.014 0.000 0.896 2270 Q HN 0.350 nan 8.270 nan 0.000 0.428 2271 V N 0.699 120.646 119.914 0.054 0.000 2.488 2271 V HA -0.178 3.942 4.120 0.001 0.000 0.246 2271 V C 2.012 178.143 176.094 0.061 0.000 1.046 2271 V CA 1.355 63.693 62.300 0.062 0.000 1.053 2271 V CB -0.267 31.601 31.823 0.075 0.000 0.679 2271 V HN 0.319 nan 8.190 nan 0.000 0.458 2272 I N -1.111 119.498 120.570 0.065 0.000 2.585 2272 I HA 0.014 4.184 4.170 0.001 0.000 0.254 2272 I C 0.543 176.713 176.117 0.089 0.000 1.129 2272 I CA 0.342 61.690 61.300 0.080 0.000 1.455 2272 I CB 0.022 38.078 38.000 0.094 0.000 1.111 2272 I HN 0.222 nan 8.210 nan 0.000 0.433 2273 E N 0.285 120.540 120.200 0.092 0.000 2.302 2273 E HA -0.189 4.162 4.350 0.001 0.000 0.186 2273 E C -1.786 174.889 176.600 0.125 0.000 1.444 2273 E CA 0.103 56.564 56.400 0.102 0.000 0.671 2273 E CB -1.043 28.704 29.700 0.079 0.000 1.122 2273 E HN 0.348 nan 8.360 nan 0.000 0.366 2274 P HA -0.112 nan 4.420 nan 0.000 0.214 2274 P C -0.171 177.232 177.300 0.171 0.000 1.162 2274 P CA 0.740 63.954 63.100 0.190 0.000 0.874 2274 P CB 0.216 32.089 31.700 0.290 0.000 0.784 2275 Q N -3.060 116.844 119.800 0.173 0.000 3.245 2275 Q HA -0.217 4.123 4.340 0.001 0.000 0.028 2275 Q C -0.466 175.655 176.000 0.202 0.000 1.716 2275 Q CA 0.404 56.298 55.803 0.153 0.000 0.237 2275 Q CB -0.899 27.922 28.738 0.139 0.000 0.589 2275 Q HN 0.206 nan 8.270 nan 0.000 0.323 2276 F N 0.343 120.289 119.950 -0.006 0.000 2.266 2276 F HA -0.225 4.302 4.527 -0.000 0.000 0.394 2276 F C -1.188 174.597 175.800 -0.025 0.000 1.147 2276 F CA 1.048 59.038 58.000 -0.018 0.000 1.314 2276 F CB -0.196 38.802 39.000 -0.003 0.000 1.961 2276 F HN 0.395 nan 8.300 nan 0.000 0.768 2277 Q N 5.172 124.677 119.800 -0.492 0.000 2.337 2277 Q HA 0.437 4.777 4.340 0.001 0.000 0.270 2277 Q C 0.456 176.157 176.000 -0.498 0.000 1.043 2277 Q CA -0.721 54.797 55.803 -0.475 0.000 0.794 2277 Q CB 1.806 30.381 28.738 -0.271 0.000 1.281 2277 Q HN 0.715 nan 8.270 nan 0.000 0.446 2278 R N 1.060 121.274 120.500 -0.477 0.000 2.555 2278 R HA 0.121 4.461 4.340 0.001 0.000 0.272 2278 R C 0.100 176.321 176.300 -0.132 0.000 1.089 2278 R CA 0.006 55.922 56.100 -0.308 0.000 1.126 2278 R CB 0.177 30.312 30.300 -0.275 0.000 1.250 2278 R HN 0.472 nan 8.270 nan 0.000 0.551 2279 D N -0.665 119.689 120.400 -0.077 0.000 2.228 2279 D HA -0.007 4.633 4.640 0.001 0.000 0.247 2279 D C 0.348 176.744 176.300 0.160 0.000 0.995 2279 D CA -0.801 53.249 54.000 0.083 0.000 0.903 2279 D CB 1.199 42.105 40.800 0.177 0.000 1.205 2279 D HN -0.066 nan 8.370 nan 0.000 0.459 2280 F N 1.217 121.216 119.950 0.083 0.000 2.063 2280 F HA -0.267 4.260 4.527 -0.000 0.000 0.298 2280 F C 2.185 178.022 175.800 0.062 0.000 1.109 2280 F CA 2.179 60.218 58.000 0.066 0.000 1.212 2280 F CB -0.012 39.034 39.000 0.078 0.000 0.973 2280 F HN 0.529 nan 8.300 nan 0.000 0.480 2281 I N -2.431 118.430 120.570 0.486 0.000 2.617 2281 I HA -0.093 4.077 4.170 0.001 0.000 0.256 2281 I C 2.022 178.221 176.117 0.137 0.000 1.167 2281 I CA 1.444 62.886 61.300 0.238 0.000 1.469 2281 I CB -0.517 37.409 38.000 -0.123 0.000 1.098 2281 I HN -0.054 nan 8.210 nan 0.000 0.436 2282 S N 1.425 117.203 115.700 0.130 0.000 2.447 2282 S HA 0.117 4.587 4.470 0.001 0.000 0.233 2282 S C 1.822 176.262 174.600 -0.267 0.000 1.006 2282 S CA 1.126 59.165 58.200 -0.268 0.000 0.957 2282 S CB -0.309 62.614 63.200 -0.461 0.000 0.773 2282 S HN 0.481 nan 8.310 nan 0.000 0.507 2283 L N 0.551 121.702 121.223 -0.120 0.000 2.529 2283 L HA 0.265 4.605 4.340 0.001 0.000 0.223 2283 L C 0.447 177.269 176.870 -0.080 0.000 1.113 2283 L CA 0.059 54.827 54.840 -0.120 0.000 0.861 2283 L CB -0.179 41.794 42.059 -0.144 0.000 1.012 2283 L HN 0.178 nan 8.230 nan 0.000 0.461 2284 L N 0.688 121.890 121.223 -0.034 0.000 2.436 2284 L HA 0.217 4.558 4.340 0.001 0.000 0.265 2284 L C -1.896 174.993 176.870 0.031 0.000 1.168 2284 L CA -1.823 53.012 54.840 -0.008 0.000 0.815 2284 L CB 0.389 42.482 42.059 0.057 0.000 1.109 2284 L HN -0.206 nan 8.230 nan 0.000 0.462 2285 P HA 0.022 nan 4.420 nan 0.000 0.265 2285 P C 0.022 177.354 177.300 0.054 0.000 1.193 2285 P CA -0.300 62.820 63.100 0.034 0.000 0.765 2285 P CB 0.459 32.170 31.700 0.018 0.000 0.823 2286 K N 2.862 123.300 120.400 0.063 0.000 2.049 2286 K HA -0.258 4.063 4.320 0.001 0.000 0.219 2286 K C 1.547 178.168 176.600 0.036 0.000 1.056 2286 K CA 1.966 58.284 56.287 0.052 0.000 0.946 2286 K CB -0.611 31.908 32.500 0.033 0.000 0.723 2286 K HN 0.589 nan 8.250 nan 0.000 0.453 2287 E N 0.567 120.789 120.200 0.037 0.000 2.070 2287 E HA -0.169 4.181 4.350 0.001 0.000 0.197 2287 E C 2.236 178.885 176.600 0.082 0.000 1.004 2287 E CA 1.146 57.575 56.400 0.048 0.000 0.805 2287 E CB -0.224 29.498 29.700 0.038 0.000 0.744 2287 E HN 0.288 nan 8.360 nan 0.000 0.451 2288 L N 0.280 121.549 121.223 0.077 0.000 2.217 2288 L HA -0.086 4.254 4.340 0.001 0.000 0.211 2288 L C 2.523 179.461 176.870 0.113 0.000 1.107 2288 L CA 0.589 55.496 54.840 0.113 0.000 0.783 2288 L CB -0.407 41.698 42.059 0.078 0.000 0.919 2288 L HN 0.107 nan 8.230 nan 0.000 0.442 2289 A N 0.252 123.111 122.820 0.065 0.000 1.929 2289 A HA -0.091 4.229 4.320 0.001 0.000 0.216 2289 A C 2.254 179.823 177.584 -0.024 0.000 1.176 2289 A CA 1.063 53.108 52.037 0.013 0.000 0.628 2289 A CB -0.442 18.556 19.000 -0.004 0.000 0.816 2289 A HN 0.326 nan 8.150 nan 0.000 0.444 2290 L N -2.182 119.043 121.223 0.003 0.000 2.056 2290 L HA -0.164 4.176 4.340 0.001 0.000 0.207 2290 L C 2.569 179.445 176.870 0.009 0.000 1.078 2290 L CA 1.585 56.412 54.840 -0.022 0.000 0.749 2290 L CB -0.624 41.425 42.059 -0.017 0.000 0.901 2290 L HN 0.567 nan 8.230 nan 0.000 0.433 2291 Y N 0.410 120.720 120.300 0.017 0.000 2.207 2291 Y HA -0.246 4.304 4.550 0.000 0.000 0.287 2291 Y C 2.357 178.369 175.900 0.187 0.000 1.156 2291 Y CA 1.507 59.663 58.100 0.094 0.000 1.182 2291 Y CB -0.243 38.278 38.460 0.100 0.000 0.979 2291 Y HN -0.154 nan 8.280 nan 0.000 0.521 2292 V N 0.211 120.166 119.914 0.069 0.000 2.270 2292 V HA -0.327 3.794 4.120 0.001 0.000 0.245 2292 V C 2.425 178.497 176.094 -0.038 0.000 1.043 2292 V CA 2.057 64.331 62.300 -0.045 0.000 1.014 2292 V CB -0.813 30.960 31.823 -0.083 0.000 0.645 2292 V HN 0.410 nan 8.190 nan 0.000 0.447 2293 L N 1.089 122.252 121.223 -0.100 0.000 2.261 2293 L HA -0.163 4.178 4.340 0.001 0.000 0.216 2293 L C 2.628 179.407 176.870 -0.151 0.000 1.114 2293 L CA 1.667 56.424 54.840 -0.138 0.000 0.777 2293 L CB -0.740 41.210 42.059 -0.182 0.000 0.910 2293 L HN 0.582 nan 8.230 nan 0.000 0.440 2294 S N -0.464 115.138 115.700 -0.164 0.000 2.474 2294 S HA -0.130 4.340 4.470 0.001 0.000 0.235 2294 S C 1.559 175.972 174.600 -0.313 0.000 0.997 2294 S CA 0.707 58.731 58.200 -0.292 0.000 0.949 2294 S CB -0.527 62.436 63.200 -0.395 0.000 0.766 2294 S HN 0.343 nan 8.310 nan 0.000 0.517 2295 F N 1.664 121.422 119.950 -0.320 0.000 2.811 2295 F HA 0.453 4.981 4.527 0.001 0.000 0.301 2295 F C 0.965 176.652 175.800 -0.188 0.000 1.151 2295 F CA -0.303 57.549 58.000 -0.246 0.000 1.412 2295 F CB -0.300 38.572 39.000 -0.214 0.000 1.113 2295 F HN 0.147 nan 8.300 nan 0.000 0.579 2296 L N -0.254 120.939 121.223 -0.050 0.000 2.416 2296 L HA 0.307 4.647 4.340 0.001 0.000 0.262 2296 L C 0.422 177.206 176.870 -0.143 0.000 1.093 2296 L CA -0.851 53.943 54.840 -0.076 0.000 0.801 2296 L CB 0.665 42.676 42.059 -0.079 0.000 1.191 2296 L HN -0.177 nan 8.230 nan 0.000 0.459 2297 E N 0.842 120.980 120.200 -0.104 0.000 2.222 2297 E HA 0.242 4.592 4.350 0.001 0.000 0.272 2297 E C -1.801 174.717 176.600 -0.137 0.000 0.982 2297 E CA -1.935 54.395 56.400 -0.117 0.000 0.842 2297 E CB 1.403 31.078 29.700 -0.042 0.000 1.144 2297 E HN 0.236 nan 8.360 nan 0.000 0.397 2298 P HA -0.256 nan 4.420 nan 0.000 0.219 2298 P C 1.221 178.541 177.300 0.032 0.000 1.153 2298 P CA 1.976 64.974 63.100 -0.169 0.000 0.865 2298 P CB 0.318 31.845 31.700 -0.289 0.000 0.788 2299 K N -0.748 119.677 120.400 0.042 0.000 2.097 2299 K HA -0.162 4.158 4.320 0.001 0.000 0.206 2299 K C 1.469 178.102 176.600 0.056 0.000 1.049 2299 K CA 1.615 57.938 56.287 0.060 0.000 0.933 2299 K CB -0.294 32.245 32.500 0.066 0.000 0.717 2299 K HN 0.069 nan 8.250 nan 0.000 0.442 2300 D N 0.824 121.245 120.400 0.034 0.000 2.091 2300 D HA -0.132 4.508 4.640 0.001 0.000 0.199 2300 D C 1.955 178.298 176.300 0.071 0.000 0.980 2300 D CA 0.672 54.699 54.000 0.044 0.000 0.831 2300 D CB -0.145 40.666 40.800 0.018 0.000 0.987 2300 D HN 0.116 nan 8.370 nan 0.000 0.460 2301 L N 0.959 122.205 121.223 0.038 0.000 2.129 2301 L HA -0.145 4.195 4.340 0.001 0.000 0.212 2301 L C 2.475 179.473 176.870 0.212 0.000 1.087 2301 L CA 1.074 55.968 54.840 0.090 0.000 0.757 2301 L CB -1.208 40.833 42.059 -0.029 0.000 0.896 2301 L HN 0.126 nan 8.230 nan 0.000 0.434 2302 L N -1.444 119.898 121.223 0.198 0.000 2.240 2302 L HA -0.142 4.198 4.340 0.001 0.000 0.211 2302 L C 2.634 179.578 176.870 0.124 0.000 1.106 2302 L CA 0.600 55.540 54.840 0.167 0.000 0.793 2302 L CB -0.317 41.807 42.059 0.109 0.000 0.927 2302 L HN 0.321 nan 8.230 nan 0.000 0.446 2303 Q N -0.113 119.755 119.800 0.114 0.000 2.123 2303 Q HA -0.020 4.321 4.340 0.001 0.000 0.196 2303 Q C 2.469 178.548 176.000 0.132 0.000 0.958 2303 Q CA 1.387 57.248 55.803 0.095 0.000 0.841 2303 Q CB -0.167 28.616 28.738 0.075 0.000 0.915 2303 Q HN 0.454 nan 8.270 nan 0.000 0.455 2304 A N 1.356 124.296 122.820 0.200 0.000 1.940 2304 A HA -0.133 4.188 4.320 0.001 0.000 0.219 2304 A C 2.233 180.047 177.584 0.383 0.000 1.176 2304 A CA 1.885 54.140 52.037 0.363 0.000 0.631 2304 A CB -0.610 18.633 19.000 0.404 0.000 0.814 2304 A HN 0.347 nan 8.150 nan 0.000 0.446 2305 A N -1.174 121.811 122.820 0.275 0.000 2.172 2305 A HA -0.083 4.238 4.320 0.001 0.000 0.216 2305 A C 1.840 179.524 177.584 0.167 0.000 1.154 2305 A CA 1.310 53.496 52.037 0.248 0.000 0.701 2305 A CB -0.348 18.781 19.000 0.214 0.000 0.789 2305 A HN 0.683 nan 8.150 nan 0.000 0.465 2306 Q N -1.396 118.475 119.800 0.118 0.000 2.319 2306 Q HA 0.049 4.390 4.340 0.001 0.000 0.202 2306 Q C 1.393 177.402 176.000 0.013 0.000 0.896 2306 Q CA 0.444 56.279 55.803 0.052 0.000 0.942 2306 Q CB 0.205 28.962 28.738 0.032 0.000 1.083 2306 Q HN 0.576 nan 8.270 nan 0.000 0.510 2307 T N 0.317 114.874 114.554 0.004 0.000 2.639 2307 T HA -0.094 4.256 4.350 0.001 0.000 0.261 2307 T C 0.998 175.619 174.700 -0.132 0.000 1.053 2307 T CA 1.301 63.303 62.100 -0.164 0.000 1.158 2307 T CB -0.005 68.588 68.868 -0.459 0.000 0.863 2307 T HN 0.567 nan 8.240 nan 0.000 0.413 2308 C N -0.805 118.480 119.300 -0.025 0.000 3.306 2308 C HA 0.595 5.056 4.460 0.001 0.000 0.335 2308 C C 1.264 176.366 174.990 0.187 0.000 1.382 2308 C CA -1.496 57.550 59.018 0.047 0.000 1.254 2308 C CB 1.314 29.054 27.740 -0.000 0.000 1.555 2308 C HN 0.392 nan 8.230 nan 0.000 0.463 2309 R N -0.665 119.944 120.500 0.181 0.000 2.105 2309 R HA -0.144 4.196 4.340 0.001 0.000 0.239 2309 R C 1.652 178.120 176.300 0.279 0.000 1.135 2309 R CA 2.342 58.572 56.100 0.217 0.000 0.967 2309 R CB -0.494 29.919 30.300 0.187 0.000 0.861 2309 R HN 0.831 nan 8.270 nan 0.000 0.442 2310 Y N 0.245 120.684 120.300 0.231 0.000 2.089 2310 Y HA -0.277 4.273 4.550 0.001 0.000 0.282 2310 Y C 1.905 177.994 175.900 0.316 0.000 1.139 2310 Y CA 1.497 59.749 58.100 0.253 0.000 1.123 2310 Y CB -0.361 38.266 38.460 0.277 0.000 0.980 2310 Y HN -0.002 nan 8.280 nan 0.000 0.493 2311 W N 0.743 122.163 121.300 0.200 0.000 2.318 2311 W HA -0.212 4.449 4.660 0.002 0.000 0.313 2311 W C 2.836 179.409 176.519 0.089 0.000 1.221 2311 W CA 2.208 59.630 57.345 0.129 0.000 1.266 2311 W CB -1.067 28.475 29.460 0.137 0.000 1.150 2311 W HN 0.034 nan 8.180 nan 0.000 0.496 2312 R N 0.437 121.148 120.500 0.353 0.000 2.096 2312 R HA -0.213 4.127 4.340 0.001 0.000 0.240 2312 R C 2.076 178.568 176.300 0.320 0.000 1.139 2312 R CA 2.401 58.683 56.100 0.304 0.000 0.952 2312 R CB -0.829 29.622 30.300 0.250 0.000 0.854 2312 R HN 0.193 nan 8.270 nan 0.000 0.436 2313 I N 0.815 121.511 120.570 0.210 0.000 2.264 2313 I HA -0.319 3.851 4.170 0.001 0.000 0.248 2313 I C 2.315 178.393 176.117 -0.065 0.000 1.111 2313 I CA 1.132 62.437 61.300 0.008 0.000 1.382 2313 I CB -0.235 37.691 38.000 -0.123 0.000 1.060 2313 I HN 0.282 nan 8.210 nan 0.000 0.418 2314 L N 0.525 121.682 121.223 -0.110 0.000 1.988 2314 L HA -0.176 4.165 4.340 0.001 0.000 0.207 2314 L C 2.833 179.695 176.870 -0.012 0.000 1.071 2314 L CA 1.464 56.226 54.840 -0.130 0.000 0.744 2314 L CB -0.747 41.176 42.059 -0.226 0.000 0.893 2314 L HN 0.218 nan 8.230 nan 0.000 0.433 2315 A N -0.392 122.463 122.820 0.058 0.000 2.139 2315 A HA -0.244 4.077 4.320 0.001 0.000 0.221 2315 A C 1.885 179.675 177.584 0.343 0.000 1.159 2315 A CA 1.698 53.831 52.037 0.160 0.000 0.662 2315 A CB -0.472 18.660 19.000 0.220 0.000 0.796 2315 A HN 0.415 nan 8.150 nan 0.000 0.463 2316 E N 0.150 120.512 120.200 0.271 0.000 2.368 2316 E HA 0.123 4.474 4.350 0.001 0.000 0.188 2316 E C 0.857 177.589 176.600 0.221 0.000 1.061 2316 E CA 0.199 56.775 56.400 0.293 0.000 0.933 2316 E CB -0.347 29.501 29.700 0.246 0.000 1.091 2316 E HN 0.535 nan 8.360 nan 0.000 0.458 2317 D N 0.628 121.152 120.400 0.207 0.000 1.888 2317 D HA -0.215 4.425 4.640 0.001 0.000 0.284 2317 D C 1.072 177.496 176.300 0.208 0.000 1.384 2317 D CA 2.304 56.385 54.000 0.135 0.000 1.146 2317 D CB 0.100 40.941 40.800 0.068 0.000 2.055 2317 D HN 0.346 nan 8.370 nan 0.000 0.666 2318 N N -3.528 115.326 118.700 0.257 0.000 2.482 2318 N HA -0.115 4.625 4.740 0.001 0.000 0.285 2318 N C 1.503 177.140 175.510 0.212 0.000 1.246 2318 N CA 0.418 53.659 53.050 0.318 0.000 2.315 2318 N CB -0.900 37.742 38.487 0.259 0.000 1.995 2318 N HN 0.125 nan 8.380 nan 0.000 1.193 2319 L N 2.017 123.289 121.223 0.082 0.000 2.275 2319 L HA -0.025 4.315 4.340 0.001 0.000 0.215 2319 L C 2.397 179.204 176.870 -0.105 0.000 1.119 2319 L CA 0.703 55.518 54.840 -0.042 0.000 0.790 2319 L CB -0.214 41.825 42.059 -0.033 0.000 0.919 2319 L HN 0.374 nan 8.230 nan 0.000 0.443 2320 L N -0.948 120.225 121.223 -0.083 0.000 2.056 2320 L HA -0.114 4.226 4.340 0.001 0.000 0.207 2320 L C 1.972 178.630 176.870 -0.354 0.000 1.078 2320 L CA 1.833 56.525 54.840 -0.246 0.000 0.749 2320 L CB -0.448 41.431 42.059 -0.300 0.000 0.901 2320 L HN 0.149 nan 8.230 nan 0.000 0.433 2321 W N -0.406 120.856 121.300 -0.063 0.000 2.576 2321 W HA 0.088 4.748 4.660 -0.000 0.000 0.270 2321 W C 2.744 179.214 176.519 -0.082 0.000 1.255 2321 W CA 0.738 58.067 57.345 -0.025 0.000 1.314 2321 W CB -0.135 29.387 29.460 0.104 0.000 1.101 2321 W HN 0.036 nan 8.180 nan 0.000 0.595 2322 R N 1.216 121.628 120.500 -0.146 0.000 2.105 2322 R HA -0.220 4.121 4.340 0.001 0.000 0.239 2322 R C 1.880 177.854 176.300 -0.544 0.000 1.135 2322 R CA 2.021 57.574 56.100 -0.911 0.000 0.967 2322 R CB -0.308 29.226 30.300 -1.278 0.000 0.861 2322 R HN 0.239 nan 8.270 nan 0.000 0.442 2323 E N -0.238 119.770 120.200 -0.320 0.000 2.122 2323 E HA -0.101 4.250 4.350 0.001 0.000 0.190 2323 E C 1.422 177.932 176.600 -0.151 0.000 0.977 2323 E CA 0.537 56.794 56.400 -0.239 0.000 0.820 2323 E CB 0.302 29.866 29.700 -0.225 0.000 0.770 2323 E HN 0.092 nan 8.360 nan 0.000 0.462 2324 K N 0.175 120.491 120.400 -0.139 0.000 2.209 2324 K HA -0.086 4.235 4.320 0.001 0.000 0.204 2324 K C 1.993 178.700 176.600 0.178 0.000 1.048 2324 K CA 0.611 56.855 56.287 -0.072 0.000 0.940 2324 K CB -0.550 31.778 32.500 -0.287 0.000 0.729 2324 K HN 0.269 nan 8.250 nan 0.000 0.451 2325 C N 0.643 120.077 119.300 0.223 0.000 2.475 2325 C HA 0.048 4.508 4.460 0.001 0.000 0.279 2325 C C 2.463 177.541 174.990 0.148 0.000 1.322 2325 C CA 0.127 59.339 59.018 0.323 0.000 1.734 2325 C CB -0.309 27.702 27.740 0.451 0.000 2.005 2325 C HN 0.470 nan 8.230 nan 0.000 0.495 2326 K N 0.774 121.177 120.400 0.005 0.000 2.515 2326 K HA -0.136 4.185 4.320 0.001 0.000 0.196 2326 K C 1.693 178.294 176.600 0.002 0.000 1.038 2326 K CA 0.947 57.218 56.287 -0.026 0.000 0.967 2326 K CB 0.025 32.460 32.500 -0.109 0.000 0.780 2326 K HN 0.512 nan 8.250 nan 0.000 0.483 2327 E N 0.397 120.616 120.200 0.032 0.000 2.057 2327 E HA -0.048 4.302 4.350 0.001 0.000 0.190 2327 E C 1.057 177.691 176.600 0.058 0.000 0.969 2327 E CA 0.726 57.145 56.400 0.032 0.000 0.812 2327 E CB 0.358 30.080 29.700 0.037 0.000 0.777 2327 E HN 0.140 nan 8.360 nan 0.000 0.455 2328 E N 0.002 120.268 120.200 0.109 0.000 2.494 2328 E HA 0.077 4.428 4.350 0.001 0.000 0.193 2328 E C 0.033 176.659 176.600 0.043 0.000 1.074 2328 E CA 0.626 57.068 56.400 0.070 0.000 0.867 2328 E CB 0.295 30.033 29.700 0.063 0.000 0.924 2328 E HN 0.385 nan 8.360 nan 0.000 0.502 2329 G N 2.313 111.146 108.800 0.055 0.000 2.415 2329 G HA2 -0.218 3.743 3.960 0.001 0.000 0.283 2329 G HA3 -0.218 3.743 3.960 0.001 0.000 0.283 2329 G C 0.646 175.591 174.900 0.074 0.000 1.014 2329 G CA 0.135 45.265 45.100 0.049 0.000 1.323 2329 G HN 0.235 nan 8.290 nan 0.000 0.502 2330 I N 0.036 120.687 120.570 0.135 0.000 2.947 2330 I HA 0.074 4.244 4.170 0.001 0.000 0.263 2330 I C 1.808 178.064 176.117 0.232 0.000 1.130 2330 I CA 1.365 62.775 61.300 0.183 0.000 1.448 2330 I CB -0.817 37.349 38.000 0.278 0.000 1.222 2330 I HN 0.460 nan 8.210 nan 0.000 0.453 2331 D N 0.232 120.822 120.400 0.316 0.000 2.463 2331 D HA -0.199 4.441 4.640 0.001 0.000 0.165 2331 D C 0.463 177.035 176.300 0.453 0.000 1.471 2331 D CA 1.554 55.758 54.000 0.340 0.000 1.333 2331 D CB -0.656 40.248 40.800 0.172 0.000 1.227 2331 D HN 0.384 nan 8.370 nan 0.000 0.427 2332 E N 1.155 121.505 120.200 0.249 0.000 2.191 2332 E HA 0.373 4.723 4.350 0.001 0.000 0.263 2332 E C -2.263 174.076 176.600 -0.435 0.000 0.881 2332 E CA -1.577 54.784 56.400 -0.064 0.000 0.757 2332 E CB 2.512 32.192 29.700 -0.034 0.000 1.147 2332 E HN 0.157 nan 8.360 nan 0.000 0.414 2333 P HA 0.193 nan 4.420 nan 0.000 0.274 2333 P C -0.477 176.377 177.300 -0.742 0.000 1.237 2333 P CA -0.747 61.608 63.100 -1.242 0.000 0.793 2333 P CB 1.038 31.611 31.700 -1.879 0.000 0.977 2334 L N 3.283 124.153 121.223 -0.588 0.000 2.282 2334 L HA 0.350 4.690 4.340 0.001 0.000 0.288 2334 L C -0.418 176.183 176.870 -0.448 0.000 1.033 2334 L CA -0.284 54.322 54.840 -0.390 0.000 0.807 2334 L CB 0.103 42.039 42.059 -0.205 0.000 1.209 2334 L HN 0.333 nan 8.230 nan 0.000 0.423 2335 H N 6.909 125.905 119.070 -0.124 0.000 2.690 2335 H HA 0.392 4.948 4.556 0.001 0.000 0.280 2335 H C 0.161 175.449 175.328 -0.068 0.000 1.138 2335 H CA -0.341 55.651 56.048 -0.094 0.000 1.241 2335 H CB 0.560 30.270 29.762 -0.087 0.000 1.394 2335 H HN 0.609 nan 8.280 nan 0.000 0.489 2336 I N 1.522 122.108 120.570 0.027 0.000 3.418 2336 I HA 0.172 4.342 4.170 0.001 0.000 0.279 2336 I C 0.573 176.698 176.117 0.015 0.000 1.143 2336 I CA -0.148 61.150 61.300 -0.003 0.000 0.983 2336 I CB 0.585 38.555 38.000 -0.050 0.000 1.558 2336 I HN 0.181 nan 8.210 nan 0.000 0.766 2337 K N 1.634 122.033 120.400 -0.002 0.000 2.550 2337 K HA 0.370 4.691 4.320 0.001 0.000 0.252 2337 K C -1.147 175.452 176.600 -0.001 0.000 0.943 2337 K CA -0.793 55.497 56.287 0.004 0.000 0.806 2337 K CB 1.862 34.363 32.500 0.002 0.000 1.289 2337 K HN 0.511 nan 8.250 nan 0.000 0.435 2342 I N 1.350 121.949 120.570 0.049 0.000 3.411 2342 I HA 0.020 4.191 4.170 0.001 0.000 0.291 2342 I C 1.565 177.712 176.117 0.049 0.000 1.273 2342 I CA 0.740 62.066 61.300 0.045 0.000 1.366 2342 I CB 0.554 38.582 38.000 0.046 0.000 1.327 2342 I HN 0.306 nan 8.210 nan 0.000 0.596 2343 K N 4.391 124.817 120.400 0.043 0.000 2.867 2343 K HA 0.152 4.472 4.320 0.001 0.000 0.318 2343 K C -1.906 174.729 176.600 0.058 0.000 1.081 2343 K CA -0.095 56.219 56.287 0.045 0.000 1.275 2343 K CB -1.285 31.237 32.500 0.037 0.000 1.472 2343 K HN 0.440 nan 8.250 nan 0.000 0.514 2344 P HA -0.156 nan 4.420 nan 0.000 0.075 2344 P C -0.465 176.896 177.300 0.103 0.000 0.607 2344 P CA 0.709 63.855 63.100 0.077 0.000 1.085 2344 P CB -0.771 30.975 31.700 0.077 0.000 1.717 2345 G N 1.796 110.651 108.800 0.091 0.000 2.630 2345 G HA2 0.271 4.231 3.960 0.001 0.000 0.236 2345 G HA3 0.271 4.231 3.960 0.001 0.000 0.236 2345 G C -0.898 174.094 174.900 0.154 0.000 1.248 2345 G CA -0.144 45.018 45.100 0.103 0.000 0.844 2345 G HN 0.376 nan 8.290 nan 0.000 0.588 2346 F N 0.256 120.164 119.950 -0.070 0.000 2.574 2346 F HA 0.479 5.006 4.527 0.001 0.000 0.313 2346 F C -0.159 175.519 175.800 -0.202 0.000 1.130 2346 F CA -1.134 56.761 58.000 -0.174 0.000 0.936 2346 F CB 1.779 40.592 39.000 -0.312 0.000 1.219 2346 F HN 0.307 nan 8.300 nan 0.000 0.445 2347 I N 6.569 126.832 120.570 -0.513 0.000 2.268 2347 I HA 0.153 4.323 4.170 0.001 0.000 0.290 2347 I C 0.055 176.030 176.117 -0.235 0.000 1.125 2347 I CA -0.410 60.726 61.300 -0.272 0.000 1.236 2347 I CB -0.291 37.568 38.000 -0.237 0.000 1.469 2347 I HN 0.409 nan 8.210 nan 0.000 0.512 2348 H N 3.306 122.419 119.070 0.072 0.000 2.871 2348 H HA 0.027 4.583 4.556 0.000 0.000 0.355 2348 H C 0.477 175.838 175.328 0.055 0.000 1.092 2348 H CA 0.279 56.408 56.048 0.134 0.000 1.420 2348 H CB 1.306 31.149 29.762 0.136 0.000 1.400 2348 H HN 0.421 nan 8.280 nan 0.000 0.604 2349 S N 3.295 119.102 115.700 0.178 0.000 2.475 2349 S HA 0.143 4.614 4.470 0.001 0.000 0.281 2349 S C -1.628 173.010 174.600 0.063 0.000 1.198 2349 S CA -1.476 56.804 58.200 0.134 0.000 1.063 2349 S CB 1.063 64.366 63.200 0.171 0.000 0.972 2349 S HN 0.353 nan 8.310 nan 0.000 0.486 2350 P HA 0.011 nan 4.420 nan 0.000 0.216 2350 P C 0.581 177.726 177.300 -0.257 0.000 1.153 2350 P CA 1.034 63.992 63.100 -0.237 0.000 0.848 2350 P CB 0.000 31.411 31.700 -0.483 0.000 0.787 2351 W N 0.543 121.838 121.300 -0.008 0.000 2.358 2351 W HA -0.076 4.584 4.660 0.000 0.000 0.303 2351 W C 2.544 179.089 176.519 0.043 0.000 1.208 2351 W CA 0.995 58.379 57.345 0.064 0.000 1.274 2351 W CB -0.595 28.965 29.460 0.167 0.000 1.138 2351 W HN -0.106 nan 8.180 nan 0.000 0.515 2352 K N 0.717 121.163 120.400 0.076 0.000 2.057 2352 K HA -0.186 4.134 4.320 0.001 0.000 0.207 2352 K C 2.088 178.510 176.600 -0.297 0.000 1.049 2352 K CA 1.959 57.932 56.287 -0.523 0.000 0.931 2352 K CB -0.416 31.458 32.500 -1.043 0.000 0.714 2352 K HN 0.191 nan 8.250 nan 0.000 0.440 2353 S N 0.320 115.924 115.700 -0.161 0.000 2.402 2353 S HA -0.042 4.428 4.470 0.001 0.000 0.229 2353 S C 2.192 176.757 174.600 -0.057 0.000 1.021 2353 S CA 0.804 58.934 58.200 -0.117 0.000 0.974 2353 S CB -0.197 62.931 63.200 -0.121 0.000 0.800 2353 S HN 0.384 nan 8.310 nan 0.000 0.484 2354 A N 1.016 123.811 122.820 -0.041 0.000 1.902 2354 A HA -0.038 4.282 4.320 0.001 0.000 0.217 2354 A C 2.010 179.646 177.584 0.086 0.000 1.181 2354 A CA 1.468 53.500 52.037 -0.008 0.000 0.623 2354 A CB -1.174 17.809 19.000 -0.028 0.000 0.818 2354 A HN 0.613 nan 8.150 nan 0.000 0.443 2355 Y N 0.321 120.650 120.300 0.047 0.000 2.114 2355 Y HA -0.183 4.367 4.550 0.001 0.000 0.284 2355 Y C 2.086 178.024 175.900 0.064 0.000 1.143 2355 Y CA 1.976 60.136 58.100 0.100 0.000 1.135 2355 Y CB -0.208 38.347 38.460 0.158 0.000 0.980 2355 Y HN 0.257 nan 8.280 nan 0.000 0.499 2356 I N 0.110 120.799 120.570 0.198 0.000 2.286 2356 I HA -0.336 3.835 4.170 0.001 0.000 0.248 2356 I C 2.710 178.891 176.117 0.107 0.000 1.115 2356 I CA 1.560 62.947 61.300 0.145 0.000 1.392 2356 I CB -0.486 37.532 38.000 0.028 0.000 1.065 2356 I HN 0.222 nan 8.210 nan 0.000 0.418 2357 R N 0.893 121.420 120.500 0.045 0.000 2.097 2357 R HA -0.306 4.034 4.340 0.001 0.000 0.236 2357 R C 2.385 178.712 176.300 0.044 0.000 1.135 2357 R CA 2.314 58.435 56.100 0.034 0.000 0.934 2357 R CB -0.363 29.940 30.300 0.006 0.000 0.846 2357 R HN 0.208 nan 8.270 nan 0.000 0.431 2358 Q N -0.083 119.721 119.800 0.007 0.000 2.096 2358 Q HA -0.241 4.099 4.340 0.001 0.000 0.204 2358 Q C 1.923 177.921 176.000 -0.004 0.000 0.982 2358 Q CA 2.436 58.231 55.803 -0.013 0.000 0.850 2358 Q CB -0.500 28.182 28.738 -0.093 0.000 0.901 2358 Q HN 0.656 nan 8.270 nan 0.000 0.422 2359 H N -0.529 118.472 119.070 -0.115 0.000 2.387 2359 H HA -0.007 4.550 4.556 0.000 0.000 0.299 2359 H C 1.767 177.121 175.328 0.043 0.000 1.099 2359 H CA 1.969 57.988 56.048 -0.048 0.000 1.315 2359 H CB 0.150 29.913 29.762 0.001 0.000 1.380 2359 H HN 0.190 nan 8.280 nan 0.000 0.513 2360 R N -0.328 120.205 120.500 0.055 0.000 2.115 2360 R HA 0.002 4.343 4.340 0.001 0.000 0.226 2360 R C 2.436 178.762 176.300 0.042 0.000 1.100 2360 R CA 1.323 57.442 56.100 0.030 0.000 0.980 2360 R CB -0.016 30.337 30.300 0.088 0.000 0.875 2360 R HN 0.397 nan 8.270 nan 0.000 0.445 2361 I N 1.020 121.644 120.570 0.090 0.000 2.202 2361 I HA -0.265 3.905 4.170 0.001 0.000 0.242 2361 I C 1.510 177.800 176.117 0.289 0.000 1.091 2361 I CA 1.268 62.681 61.300 0.189 0.000 1.368 2361 I CB -0.344 37.787 38.000 0.218 0.000 1.058 2361 I HN 0.085 nan 8.210 nan 0.000 0.410 2362 D N 0.599 121.120 120.400 0.202 0.000 2.116 2362 D HA -0.168 4.472 4.640 0.001 0.000 0.193 2362 D C 2.187 178.623 176.300 0.227 0.000 0.998 2362 D CA 1.681 55.845 54.000 0.274 0.000 0.836 2362 D CB -0.520 40.340 40.800 0.100 0.000 0.951 2362 D HN 0.249 nan 8.370 nan 0.000 0.449 2363 T N 0.565 115.137 114.554 0.030 0.000 2.788 2363 T HA -0.147 4.203 4.350 0.001 0.000 0.268 2363 T C 1.702 176.433 174.700 0.051 0.000 1.044 2363 T CA 1.121 63.218 62.100 -0.006 0.000 1.139 2363 T CB -0.252 68.545 68.868 -0.118 0.000 0.867 2363 T HN 0.061 nan 8.240 nan 0.000 0.454 2364 N N 0.021 118.772 118.700 0.085 0.000 2.120 2364 N HA -0.091 4.649 4.740 0.001 0.000 0.188 2364 N C 1.433 177.011 175.510 0.112 0.000 1.024 2364 N CA 1.276 54.389 53.050 0.105 0.000 0.852 2364 N CB -0.315 38.246 38.487 0.123 0.000 1.003 2364 N HN 0.510 nan 8.380 nan 0.000 0.424 2365 W N 1.129 122.321 121.300 -0.179 0.000 2.358 2365 W HA 0.053 4.713 4.660 0.000 0.000 0.303 2365 W C 2.774 178.995 176.519 -0.496 0.000 1.208 2365 W CA 0.982 57.922 57.345 -0.677 0.000 1.274 2365 W CB -0.392 28.500 29.460 -0.948 0.000 1.138 2365 W HN 0.067 nan 8.180 nan 0.000 0.515 2366 R N 0.725 121.168 120.500 -0.094 0.000 2.070 2366 R HA -0.146 4.195 4.340 0.001 0.000 0.233 2366 R C 1.885 178.135 176.300 -0.082 0.000 1.137 2366 R CA 2.294 58.329 56.100 -0.108 0.000 0.945 2366 R CB -0.158 30.175 30.300 0.055 0.000 0.845 2366 R HN 0.235 nan 8.270 nan 0.000 0.430 2367 R N -1.744 118.739 120.500 -0.030 0.000 2.526 2367 R HA 0.246 4.586 4.340 0.001 0.000 0.346 2367 R C 0.009 176.303 176.300 -0.008 0.000 0.926 2367 R CA 0.146 56.228 56.100 -0.029 0.000 1.147 2367 R CB 0.421 30.708 30.300 -0.021 0.000 1.629 2367 R HN 0.108 nan 8.270 nan 0.000 0.516 2368 G N 1.594 110.403 108.800 0.015 0.000 2.442 2368 G HA2 0.013 3.973 3.960 0.001 0.000 0.249 2368 G HA3 0.013 3.973 3.960 0.001 0.000 0.249 2368 G C -0.487 174.413 174.900 -0.000 0.000 1.263 2368 G CA -0.311 44.799 45.100 0.015 0.000 0.846 2368 G HN 0.356 nan 8.290 nan 0.000 0.555 2369 E N 1.408 121.593 120.200 -0.025 0.000 2.708 2369 E HA -0.089 4.261 4.350 0.001 0.000 0.260 2369 E C -0.021 176.534 176.600 -0.075 0.000 0.937 2369 E CA -0.024 56.349 56.400 -0.045 0.000 0.953 2369 E CB 0.216 29.886 29.700 -0.050 0.000 0.915 2369 E HN 0.313 nan 8.360 nan 0.000 0.487 2370 L N 6.138 127.315 121.223 -0.077 0.000 2.433 2370 L HA 0.130 4.470 4.340 0.001 0.000 0.284 2370 L C 0.371 177.147 176.870 -0.157 0.000 1.120 2370 L CA -0.093 54.674 54.840 -0.122 0.000 0.879 2370 L CB 0.133 42.145 42.059 -0.078 0.000 1.232 2370 L HN 0.406 nan 8.230 nan 0.000 0.454 2371 K N 2.379 122.643 120.400 -0.228 0.000 2.368 2371 K HA 0.141 4.461 4.320 0.001 0.000 0.282 2371 K C 0.480 176.963 176.600 -0.195 0.000 1.035 2371 K CA -0.353 55.813 56.287 -0.202 0.000 0.973 2371 K CB 0.513 32.869 32.500 -0.241 0.000 0.957 2371 K HN 0.601 nan 8.250 nan 0.000 0.474 2372 S N 3.817 119.432 115.700 -0.142 0.000 2.563 2372 S HA 0.052 4.522 4.470 0.001 0.000 0.294 2372 S C -1.548 172.964 174.600 -0.147 0.000 1.279 2372 S CA -1.213 56.912 58.200 -0.126 0.000 1.069 2372 S CB -0.364 62.780 63.200 -0.095 0.000 0.828 2372 S HN 0.480 nan 8.310 nan 0.000 0.497 2373 P HA 0.278 nan 4.420 nan 0.000 0.276 2373 P C -0.710 176.510 177.300 -0.132 0.000 1.244 2373 P CA -0.728 62.277 63.100 -0.158 0.000 0.801 2373 P CB 0.620 32.229 31.700 -0.153 0.000 1.006 2374 K N 0.543 120.861 120.400 -0.137 0.000 2.350 2374 K HA 0.294 4.615 4.320 0.001 0.000 0.279 2374 K C -0.321 176.199 176.600 -0.134 0.000 1.027 2374 K CA -0.459 55.757 56.287 -0.118 0.000 0.969 2374 K CB 0.532 32.965 32.500 -0.112 0.000 0.954 2374 K HN 0.204 nan 8.250 nan 0.000 0.474 2375 V N 5.148 124.994 119.914 -0.112 0.000 2.427 2375 V HA 0.279 4.399 4.120 0.001 0.000 0.286 2375 V C -0.145 175.864 176.094 -0.141 0.000 1.034 2375 V CA -0.745 61.480 62.300 -0.124 0.000 0.893 2375 V CB 1.134 32.907 31.823 -0.083 0.000 0.982 2375 V HN 0.556 nan 8.190 nan 0.000 0.452 2376 L N 4.383 125.461 121.223 -0.242 0.000 2.408 2376 L HA 0.501 4.841 4.340 0.001 0.000 0.257 2376 L C -0.198 176.518 176.870 -0.257 0.000 1.053 2376 L CA -0.772 53.853 54.840 -0.358 0.000 0.922 2376 L CB 0.947 42.412 42.059 -0.990 0.000 1.261 2376 L HN 0.503 nan 8.230 nan 0.000 0.458 2377 K N 1.959 122.354 120.400 -0.008 0.000 2.412 2377 K HA 0.594 4.914 4.320 0.001 0.000 0.281 2377 K C 0.416 177.141 176.600 0.208 0.000 1.027 2377 K CA 0.340 56.667 56.287 0.066 0.000 0.989 2377 K CB 1.190 33.728 32.500 0.063 0.000 0.935 2377 K HN 0.740 nan 8.250 nan 0.000 0.475 2378 G N 0.781 109.683 108.800 0.169 0.000 2.387 2378 G HA2 0.279 4.239 3.960 0.001 0.000 0.294 2378 G HA3 0.279 4.239 3.960 0.001 0.000 0.294 2378 G C -1.374 173.588 174.900 0.104 0.000 1.509 2378 G CA -0.835 44.342 45.100 0.129 0.000 0.806 2378 G HN 0.833 nan 8.290 nan 0.000 0.546 2379 H N -0.966 118.190 119.070 0.143 0.000 2.839 2379 H HA -0.148 4.408 4.556 0.000 0.000 0.298 2379 H C -0.138 175.293 175.328 0.171 0.000 1.224 2379 H CA 0.599 56.709 56.048 0.104 0.000 1.144 2379 H CB -1.090 28.727 29.762 0.092 0.000 1.372 2379 H HN 0.637 nan 8.280 nan 0.000 0.408 2380 D N 1.858 122.389 120.400 0.218 0.000 2.730 2380 D HA -0.089 4.551 4.640 0.001 0.000 0.225 2380 D C 0.914 177.372 176.300 0.263 0.000 1.107 2380 D CA 1.512 55.633 54.000 0.201 0.000 0.837 2380 D CB 0.322 41.204 40.800 0.138 0.000 1.171 2380 D HN 0.415 nan 8.370 nan 0.000 0.498 2381 D N 0.409 120.905 120.400 0.160 0.000 2.955 2381 D HA -0.227 4.413 4.640 0.001 0.000 0.226 2381 D C 0.168 176.401 176.300 -0.112 0.000 1.178 2381 D CA 1.134 55.159 54.000 0.041 0.000 0.808 2381 D CB -0.912 39.873 40.800 -0.025 0.000 1.099 2381 D HN 0.604 nan 8.370 nan 0.000 0.421 2382 H N -1.651 117.485 119.070 0.110 0.000 2.864 2382 H HA 0.558 5.115 4.556 0.001 0.000 0.354 2382 H C 0.084 175.388 175.328 -0.039 0.000 1.208 2382 H CA -0.748 55.318 56.048 0.030 0.000 1.191 2382 H CB 1.800 31.559 29.762 -0.004 0.000 1.889 2382 H HN -0.227 nan 8.280 nan 0.000 0.574 2383 V N 2.191 121.999 119.914 -0.176 0.000 2.539 2383 V HA 0.212 4.333 4.120 0.001 0.000 0.292 2383 V C 0.589 176.196 176.094 -0.810 0.000 1.045 2383 V CA -0.569 61.246 62.300 -0.807 0.000 0.945 2383 V CB 1.405 32.711 31.823 -0.862 0.000 0.993 2383 V HN 0.431 nan 8.190 nan 0.000 0.464 2384 I N 4.252 124.247 120.570 -0.957 0.000 2.287 2384 I HA 0.139 4.310 4.170 0.001 0.000 0.290 2384 I C 1.530 177.288 176.117 -0.598 0.000 1.069 2384 I CA -0.010 60.964 61.300 -0.544 0.000 1.237 2384 I CB 1.430 39.365 38.000 -0.108 0.000 1.418 2384 I HN 0.889 nan 8.210 nan 0.000 0.481 2385 T N 1.042 115.213 114.554 -0.638 0.000 3.067 2385 T HA 0.027 4.377 4.350 0.001 0.000 0.261 2385 T C 0.532 175.075 174.700 -0.263 0.000 1.110 2385 T CA -0.080 61.683 62.100 -0.562 0.000 1.113 2385 T CB -0.291 68.007 68.868 -0.949 0.000 0.917 2385 T HN 0.682 nan 8.240 nan 0.000 0.499 2386 C N 0.001 119.175 119.300 -0.209 0.000 3.082 2386 C HA 0.876 5.337 4.460 0.001 0.000 0.324 2386 C C -1.490 173.480 174.990 -0.033 0.000 1.210 2386 C CA -1.650 57.323 59.018 -0.075 0.000 1.366 2386 C CB 0.771 28.474 27.740 -0.061 0.000 1.756 2386 C HN 0.409 nan 8.230 nan 0.000 0.485 2387 L N 1.800 123.044 121.223 0.034 0.000 2.431 2387 L HA 0.848 5.189 4.340 0.001 0.000 0.266 2387 L C -0.866 176.070 176.870 0.110 0.000 0.978 2387 L CA 0.095 54.975 54.840 0.067 0.000 0.822 2387 L CB 2.093 44.197 42.059 0.075 0.000 1.310 2387 L HN 0.938 nan 8.230 nan 0.000 0.409 2388 Q N 2.816 122.698 119.800 0.135 0.000 2.331 2388 Q HA 0.623 4.963 4.340 0.001 0.000 0.272 2388 Q C -1.981 174.184 176.000 0.274 0.000 1.062 2388 Q CA -0.216 55.696 55.803 0.181 0.000 0.806 2388 Q CB 2.275 31.101 28.738 0.146 0.000 1.312 2388 Q HN 0.477 nan 8.270 nan 0.000 0.431 2389 F N 2.763 122.763 119.950 0.084 0.000 2.659 2389 F HA 0.581 5.108 4.527 0.000 0.000 0.342 2389 F C -1.772 174.075 175.800 0.079 0.000 1.168 2389 F CA -1.589 56.461 58.000 0.084 0.000 1.003 2389 F CB 0.983 40.035 39.000 0.085 0.000 1.267 2389 F HN 0.622 nan 8.300 nan 0.000 0.463 2390 C N 6.344 125.773 119.300 0.215 0.000 2.381 2390 C HA 0.692 5.153 4.460 0.001 0.000 0.328 2390 C C 0.815 175.810 174.990 0.008 0.000 1.190 2390 C CA 0.791 59.814 59.018 0.009 0.000 1.369 2390 C CB -0.164 27.618 27.740 0.069 0.000 2.029 2390 C HN 1.415 nan 8.230 nan 0.000 0.448 2391 G N 6.095 114.820 108.800 -0.126 0.000 2.596 2391 G HA2 -0.343 3.617 3.960 0.001 0.000 0.304 2391 G HA3 -0.343 3.617 3.960 0.001 0.000 0.304 2391 G C 0.591 175.544 174.900 0.087 0.000 1.189 2391 G CA 1.014 46.091 45.100 -0.038 0.000 0.986 2391 G HN 0.831 nan 8.290 nan 0.000 0.548 2392 N N 0.930 119.719 118.700 0.149 0.000 2.230 2392 N HA 0.209 4.949 4.740 0.001 0.000 0.202 2392 N C 0.213 175.869 175.510 0.244 0.000 1.119 2392 N CA -0.323 52.857 53.050 0.217 0.000 0.851 2392 N CB 0.327 38.894 38.487 0.133 0.000 0.990 2392 N HN 0.134 nan 8.380 nan 0.000 0.497 2393 R N 1.174 121.831 120.500 0.261 0.000 2.338 2393 R HA 0.444 4.784 4.340 0.001 0.000 0.317 2393 R C -0.629 175.862 176.300 0.318 0.000 0.968 2393 R CA -0.464 55.779 56.100 0.238 0.000 0.849 2393 R CB 1.571 31.969 30.300 0.164 0.000 1.128 2393 R HN 0.070 nan 8.270 nan 0.000 0.448 2394 I N 2.181 122.903 120.570 0.254 0.000 2.441 2394 I HA 0.373 4.544 4.170 0.001 0.000 0.295 2394 I C -0.268 176.023 176.117 0.290 0.000 0.994 2394 I CA -1.068 60.356 61.300 0.207 0.000 1.144 2394 I CB 2.197 40.197 38.000 -0.001 0.000 1.314 2394 I HN 0.060 nan 8.210 nan 0.000 0.445 2395 V N 4.554 124.607 119.914 0.231 0.000 2.409 2395 V HA 0.296 4.417 4.120 0.001 0.000 0.290 2395 V C -0.160 176.044 176.094 0.182 0.000 1.017 2395 V CA -0.572 61.851 62.300 0.205 0.000 0.841 2395 V CB 1.706 33.593 31.823 0.105 0.000 1.003 2395 V HN 0.849 nan 8.190 nan 0.000 0.426 2396 S N 3.278 119.149 115.700 0.286 0.000 2.508 2396 S HA 0.841 5.311 4.470 0.001 0.000 0.284 2396 S C 0.140 174.765 174.600 0.041 0.000 1.192 2396 S CA -0.409 57.919 58.200 0.213 0.000 1.070 2396 S CB 1.848 65.336 63.200 0.480 0.000 1.004 2396 S HN 1.009 nan 8.310 nan 0.000 0.493 2397 G N 0.337 109.041 108.800 -0.160 0.000 2.452 2397 G HA2 0.619 4.579 3.960 0.001 0.000 0.324 2397 G HA3 0.619 4.579 3.960 0.001 0.000 0.324 2397 G C -0.966 173.605 174.900 -0.548 0.000 1.214 2397 G CA -0.723 44.195 45.100 -0.302 0.000 0.947 2397 G HN 0.863 nan 8.290 nan 0.000 0.478 2398 S N -0.461 114.869 115.700 -0.617 0.000 2.588 2398 S HA 0.420 4.890 4.470 0.001 0.000 0.275 2398 S C 0.090 174.332 174.600 -0.597 0.000 1.130 2398 S CA -0.444 57.335 58.200 -0.702 0.000 0.855 2398 S CB 1.791 64.480 63.200 -0.853 0.000 1.116 2398 S HN 0.664 nan 8.310 nan 0.000 0.472 2399 D N 1.164 121.210 120.400 -0.589 0.000 2.324 2399 D HA -0.009 4.631 4.640 0.001 0.000 0.235 2399 D C 0.670 176.869 176.300 -0.168 0.000 1.095 2399 D CA 0.115 53.886 54.000 -0.381 0.000 0.871 2399 D CB -0.299 40.377 40.800 -0.207 0.000 0.906 2399 D HN 0.620 nan 8.370 nan 0.000 0.522 2400 D N -0.194 120.007 120.400 -0.333 0.000 2.328 2400 D HA -0.069 4.571 4.640 0.001 0.000 0.226 2400 D C 0.026 176.167 176.300 -0.266 0.000 1.066 2400 D CA -0.309 53.341 54.000 -0.583 0.000 0.861 2400 D CB -0.261 40.058 40.800 -0.802 0.000 0.912 2400 D HN -0.071 nan 8.370 nan 0.000 0.521 2401 N N -1.233 117.362 118.700 -0.176 0.000 2.980 2401 N HA -0.155 4.585 4.740 0.001 0.000 0.219 2401 N C -0.109 175.375 175.510 -0.044 0.000 0.883 2401 N CA 1.675 54.682 53.050 -0.072 0.000 1.018 2401 N CB -1.646 36.836 38.487 -0.008 0.000 1.041 2401 N HN 0.654 nan 8.380 nan 0.000 0.592 2402 T N -2.194 112.306 114.554 -0.091 0.000 2.905 2402 T HA 0.835 5.186 4.350 0.001 0.000 0.283 2402 T C -0.330 174.311 174.700 -0.098 0.000 1.031 2402 T CA -0.781 61.277 62.100 -0.071 0.000 1.002 2402 T CB 2.268 71.112 68.868 -0.038 0.000 1.200 2402 T HN 0.049 nan 8.240 nan 0.000 0.560 2403 L N -0.014 121.123 121.223 -0.144 0.000 2.393 2403 L HA 0.662 5.002 4.340 0.001 0.000 0.260 2403 L C -0.541 176.252 176.870 -0.129 0.000 1.002 2403 L CA -0.771 53.987 54.840 -0.137 0.000 0.818 2403 L CB 2.496 44.354 42.059 -0.334 0.000 1.369 2403 L HN 0.707 nan 8.230 nan 0.000 0.412 2404 K N 1.236 121.613 120.400 -0.038 0.000 2.471 2404 K HA 0.650 4.970 4.320 0.001 0.000 0.252 2404 K C -1.489 174.916 176.600 -0.325 0.000 0.938 2404 K CA -0.758 55.341 56.287 -0.312 0.000 0.796 2404 K CB 2.641 34.816 32.500 -0.543 0.000 1.161 2404 K HN 0.189 nan 8.250 nan 0.000 0.425 2405 V N 3.276 122.959 119.914 -0.385 0.000 2.432 2405 V HA 0.347 4.467 4.120 0.001 0.000 0.275 2405 V C -0.839 175.089 176.094 -0.277 0.000 1.043 2405 V CA -0.452 61.738 62.300 -0.184 0.000 0.925 2405 V CB 0.003 31.754 31.823 -0.120 0.000 0.985 2405 V HN 0.636 nan 8.190 nan 0.000 0.466 2406 W N 1.877 123.164 121.300 -0.021 0.000 2.850 2406 W HA 0.647 5.307 4.660 0.001 0.000 0.349 2406 W C 0.243 176.758 176.519 -0.006 0.000 1.133 2406 W CA -0.927 56.403 57.345 -0.025 0.000 1.117 2406 W CB 1.405 30.839 29.460 -0.042 0.000 1.442 2406 W HN 0.394 nan 8.180 nan 0.000 0.575 2407 S N 0.814 116.672 115.700 0.263 0.000 2.422 2407 S HA 0.520 4.990 4.470 0.001 0.000 0.308 2407 S C 0.771 175.445 174.600 0.123 0.000 1.097 2407 S CA -0.025 58.271 58.200 0.159 0.000 1.099 2407 S CB 0.853 64.117 63.200 0.108 0.000 0.976 2407 S HN 0.625 nan 8.310 nan 0.000 0.471 2408 A N 4.920 127.803 122.820 0.104 0.000 2.019 2408 A HA 0.028 4.348 4.320 0.001 0.000 0.219 2408 A C 1.861 179.466 177.584 0.034 0.000 1.164 2408 A CA 1.546 53.596 52.037 0.022 0.000 0.644 2408 A CB -0.598 18.464 19.000 0.104 0.000 0.805 2408 A HN 0.761 nan 8.150 nan 0.000 0.449 2409 V N -0.076 119.878 119.914 0.067 0.000 2.346 2409 V HA -0.153 3.967 4.120 0.001 0.000 0.244 2409 V C 2.864 178.973 176.094 0.024 0.000 1.037 2409 V CA 2.344 64.671 62.300 0.045 0.000 1.029 2409 V CB -0.856 31.000 31.823 0.054 0.000 0.663 2409 V HN 0.812 nan 8.190 nan 0.000 0.454 2410 T N -3.423 111.153 114.554 0.037 0.000 3.037 2410 T HA 0.306 4.656 4.350 0.001 0.000 0.252 2410 T C 1.584 176.305 174.700 0.034 0.000 1.073 2410 T CA 1.021 63.138 62.100 0.029 0.000 1.091 2410 T CB 0.765 69.655 68.868 0.036 0.000 0.935 2410 T HN 0.981 nan 8.240 nan 0.000 0.488 2411 G N 1.643 110.477 108.800 0.056 0.000 2.159 2411 G HA2 -0.225 3.736 3.960 0.001 0.000 0.256 2411 G HA3 -0.225 3.736 3.960 0.001 0.000 0.256 2411 G C -0.050 174.961 174.900 0.185 0.000 0.977 2411 G CA 0.158 45.298 45.100 0.066 0.000 0.652 2411 G HN 0.666 nan 8.290 nan 0.000 0.531 2412 K N -0.344 120.162 120.400 0.177 0.000 2.098 2412 K HA 0.495 4.816 4.320 0.001 0.000 0.261 2412 K C 0.384 177.094 176.600 0.183 0.000 0.987 2412 K CA -0.306 56.081 56.287 0.166 0.000 0.916 2412 K CB 1.743 34.282 32.500 0.064 0.000 1.039 2412 K HN 0.268 nan 8.250 nan 0.000 0.455 2413 C N 4.691 123.981 119.300 -0.017 0.000 2.373 2413 C HA 0.234 4.694 4.460 0.001 0.000 0.354 2413 C C 1.690 176.505 174.990 -0.292 0.000 1.249 2413 C CA -0.551 58.185 59.018 -0.471 0.000 1.784 2413 C CB -1.495 25.750 27.740 -0.826 0.000 2.408 2413 C HN 0.815 nan 8.230 nan 0.000 0.542 2414 L N 4.451 125.517 121.223 -0.261 0.000 2.127 2414 L HA 0.262 4.602 4.340 0.001 0.000 0.203 2414 L C 1.547 178.307 176.870 -0.183 0.000 1.080 2414 L CA 0.869 55.615 54.840 -0.156 0.000 0.768 2414 L CB -0.381 41.627 42.059 -0.085 0.000 0.924 2414 L HN 0.656 nan 8.230 nan 0.000 0.444 2415 R N -1.261 119.081 120.500 -0.263 0.000 2.734 2415 R HA 0.432 4.772 4.340 0.001 0.000 0.271 2415 R C -1.285 174.826 176.300 -0.314 0.000 1.021 2415 R CA -0.484 55.478 56.100 -0.229 0.000 0.893 2415 R CB 2.190 32.402 30.300 -0.146 0.000 1.244 2415 R HN -0.232 nan 8.270 nan 0.000 0.464 2416 T N 2.357 116.759 114.554 -0.253 0.000 2.906 2416 T HA 0.341 4.691 4.350 0.001 0.000 0.302 2416 T C -0.099 174.459 174.700 -0.237 0.000 1.002 2416 T CA -0.650 61.289 62.100 -0.269 0.000 0.988 2416 T CB 0.689 69.419 68.868 -0.231 0.000 0.972 2416 T HN 0.245 nan 8.240 nan 0.000 0.447 2417 L N 4.184 125.181 121.223 -0.377 0.000 2.462 2417 L HA 0.353 4.693 4.340 0.001 0.000 0.283 2417 L C 0.706 177.362 176.870 -0.357 0.000 1.166 2417 L CA -0.752 53.726 54.840 -0.603 0.000 0.964 2417 L CB -0.502 40.652 42.059 -1.507 0.000 1.294 2417 L HN 0.444 nan 8.230 nan 0.000 0.449 2418 V N -0.048 119.851 119.914 -0.025 0.000 2.465 2418 V HA 0.947 5.067 4.120 0.001 0.000 0.279 2418 V C 0.610 176.876 176.094 0.286 0.000 1.045 2418 V CA 0.505 62.859 62.300 0.090 0.000 0.938 2418 V CB 1.318 33.166 31.823 0.043 0.000 0.986 2418 V HN 0.818 nan 8.190 nan 0.000 0.467 2419 G N 2.830 111.797 108.800 0.280 0.000 3.989 2419 G HA2 0.029 3.989 3.960 0.001 0.000 0.183 2419 G HA3 0.029 3.989 3.960 0.001 0.000 0.183 2419 G C 0.256 175.216 174.900 0.100 0.000 0.892 2419 G CA -0.310 44.912 45.100 0.204 0.000 0.914 2419 G HN 0.805 nan 8.290 nan 0.000 0.347 2420 H N 1.537 120.727 119.070 0.200 0.000 2.771 2420 H HA 0.322 4.878 4.556 0.001 0.000 0.364 2420 H C 0.971 176.344 175.328 0.074 0.000 1.133 2420 H CA 1.541 57.660 56.048 0.118 0.000 1.423 2420 H CB 1.503 31.339 29.762 0.122 0.000 1.425 2420 H HN 0.286 nan 8.280 nan 0.000 0.606 2421 T N 0.031 114.705 114.554 0.199 0.000 3.248 2421 T HA 0.432 4.782 4.350 0.001 0.000 0.271 2421 T C 0.651 175.428 174.700 0.127 0.000 1.005 2421 T CA -0.157 62.020 62.100 0.129 0.000 0.902 2421 T CB 0.002 68.929 68.868 0.098 0.000 1.102 2421 T HN 0.661 nan 8.240 nan 0.000 0.548 2422 G N -0.566 108.322 108.800 0.147 0.000 2.721 2422 G HA2 0.645 4.606 3.960 0.001 0.000 0.296 2422 G HA3 0.645 4.606 3.960 0.001 0.000 0.296 2422 G C -0.444 174.506 174.900 0.083 0.000 1.383 2422 G CA -0.467 44.706 45.100 0.121 0.000 0.788 2422 G HN 0.420 nan 8.290 nan 0.000 0.500 2423 G N -1.158 107.716 108.800 0.123 0.000 2.444 2423 G HA2 0.498 4.458 3.960 0.001 0.000 0.268 2423 G HA3 0.498 4.458 3.960 0.001 0.000 0.268 2423 G C -0.305 174.532 174.900 -0.106 0.000 1.203 2423 G CA -0.210 44.903 45.100 0.022 0.000 0.835 2423 G HN 0.748 nan 8.290 nan 0.000 0.543 2424 V N 1.701 121.384 119.914 -0.384 0.000 2.461 2424 V HA 0.209 4.330 4.120 0.001 0.000 0.275 2424 V C -0.167 175.536 176.094 -0.652 0.000 1.047 2424 V CA 0.023 62.069 62.300 -0.425 0.000 0.955 2424 V CB 1.110 32.695 31.823 -0.397 0.000 0.988 2424 V HN 0.910 nan 8.190 nan 0.000 0.471 2425 W N 2.570 123.777 121.300 -0.154 0.000 2.870 2425 W HA 0.354 5.014 4.660 0.001 0.000 0.358 2425 W C 0.754 177.222 176.519 -0.083 0.000 1.043 2425 W CA 0.122 57.398 57.345 -0.115 0.000 1.692 2425 W CB 0.648 30.051 29.460 -0.095 0.000 1.100 2425 W HN 0.685 nan 8.180 nan 0.000 0.557 2426 S N -0.222 115.492 115.700 0.024 0.000 2.567 2426 S HA 0.806 5.276 4.470 0.001 0.000 0.270 2426 S C -0.451 174.160 174.600 0.018 0.000 1.152 2426 S CA -0.420 57.804 58.200 0.040 0.000 0.835 2426 S CB 1.870 65.117 63.200 0.078 0.000 1.115 2426 S HN 0.076 nan 8.310 nan 0.000 0.459 2427 S N 0.402 116.132 115.700 0.050 0.000 2.636 2427 S HA 0.854 5.324 4.470 0.001 0.000 0.268 2427 S C -2.146 172.515 174.600 0.103 0.000 1.159 2427 S CA -0.779 57.460 58.200 0.065 0.000 0.815 2427 S CB 1.787 65.005 63.200 0.030 0.000 1.130 2427 S HN 0.881 nan 8.310 nan 0.000 0.471 2428 Q N 0.047 119.914 119.800 0.113 0.000 2.522 2428 Q HA 0.542 4.883 4.340 0.001 0.000 0.285 2428 Q C -1.608 174.461 176.000 0.115 0.000 0.982 2428 Q CA -0.375 55.504 55.803 0.128 0.000 0.805 2428 Q CB 2.500 31.323 28.738 0.141 0.000 1.457 2428 Q HN 0.940 nan 8.270 nan 0.000 0.394 2429 M N 1.096 120.762 119.600 0.109 0.000 2.465 2429 M HA 0.571 5.052 4.480 0.001 0.000 0.284 2429 M C -1.961 174.387 176.300 0.080 0.000 1.212 2429 M CA -0.372 54.987 55.300 0.098 0.000 0.910 2429 M CB 2.687 35.349 32.600 0.103 0.000 1.725 2429 M HN 0.609 nan 8.290 nan 0.000 0.477 2430 R N 3.718 124.259 120.500 0.068 0.000 2.810 2430 R HA 0.243 4.584 4.340 0.001 0.000 0.280 2430 R C -1.527 174.801 176.300 0.046 0.000 1.517 2430 R CA -0.355 55.772 56.100 0.046 0.000 1.063 2430 R CB 0.600 30.917 30.300 0.028 0.000 1.275 2430 R HN 0.941 nan 8.270 nan 0.000 0.464 2431 D N 3.592 124.020 120.400 0.047 0.000 7.839 2431 D HA -0.300 4.341 4.640 0.001 0.000 0.127 2431 D C 0.232 176.563 176.300 0.052 0.000 1.013 2431 D CA 1.573 55.602 54.000 0.047 0.000 0.897 2431 D CB -0.284 40.536 40.800 0.034 0.000 1.630 2431 D HN 0.916 nan 8.370 nan 0.000 0.925 2432 N N -0.081 118.655 118.700 0.061 0.000 2.929 2432 N HA -0.211 4.529 4.740 0.001 0.000 0.234 2432 N C -0.794 174.765 175.510 0.082 0.000 0.908 2432 N CA 1.196 54.285 53.050 0.066 0.000 0.993 2432 N CB -0.332 38.187 38.487 0.054 0.000 1.075 2432 N HN 0.530 nan 8.380 nan 0.000 0.603 2433 I N 2.185 122.806 120.570 0.085 0.000 2.389 2433 I HA 0.463 4.633 4.170 0.001 0.000 0.288 2433 I C 0.352 176.543 176.117 0.124 0.000 0.999 2433 I CA -0.479 60.884 61.300 0.104 0.000 1.129 2433 I CB 1.393 39.441 38.000 0.080 0.000 1.288 2433 I HN 0.019 nan 8.210 nan 0.000 0.444 2434 I N 6.778 127.456 120.570 0.180 0.000 2.530 2434 I HA 0.522 4.693 4.170 0.001 0.000 0.297 2434 I C -0.300 175.994 176.117 0.296 0.000 1.011 2434 I CA -0.681 60.734 61.300 0.193 0.000 1.107 2434 I CB 2.477 40.559 38.000 0.137 0.000 1.285 2434 I HN 0.310 nan 8.210 nan 0.000 0.436 2435 I N 4.017 124.726 120.570 0.232 0.000 2.608 2435 I HA 0.436 4.607 4.170 0.001 0.000 0.295 2435 I C -0.489 175.766 176.117 0.230 0.000 1.049 2435 I CA -0.396 61.045 61.300 0.235 0.000 1.063 2435 I CB 2.289 40.366 38.000 0.127 0.000 1.248 2435 I HN 0.577 nan 8.210 nan 0.000 0.424 2436 S N 2.683 118.560 115.700 0.294 0.000 2.570 2436 S HA 0.878 5.349 4.470 0.001 0.000 0.286 2436 S C -0.562 174.117 174.600 0.131 0.000 1.099 2436 S CA -0.833 57.502 58.200 0.224 0.000 0.913 2436 S CB 2.146 65.567 63.200 0.368 0.000 1.085 2436 S HN 0.874 nan 8.310 nan 0.000 0.480 2437 G N 0.120 108.919 108.800 -0.002 0.000 2.609 2437 G HA2 0.604 4.565 3.960 0.001 0.000 0.308 2437 G HA3 0.604 4.565 3.960 0.001 0.000 0.308 2437 G C -0.856 173.976 174.900 -0.113 0.000 1.369 2437 G CA -0.573 44.516 45.100 -0.018 0.000 0.958 2437 G HN 0.872 nan 8.290 nan 0.000 0.499 2438 S N 0.223 115.855 115.700 -0.114 0.000 2.671 2438 S HA 0.611 5.081 4.470 0.001 0.000 0.299 2438 S C 1.629 176.271 174.600 0.070 0.000 1.116 2438 S CA 0.228 58.362 58.200 -0.110 0.000 0.912 2438 S CB 1.407 64.415 63.200 -0.320 0.000 1.130 2438 S HN 0.819 nan 8.310 nan 0.000 0.501 2439 T N -0.055 114.583 114.554 0.140 0.000 3.007 2439 T HA -0.069 4.282 4.350 0.001 0.000 0.270 2439 T C 0.956 175.714 174.700 0.097 0.000 1.107 2439 T CA 1.328 63.493 62.100 0.109 0.000 1.118 2439 T CB -0.802 68.143 68.868 0.127 0.000 0.889 2439 T HN 0.763 nan 8.240 nan 0.000 0.506 2440 D N 1.471 121.947 120.400 0.127 0.000 2.378 2440 D HA -0.068 4.572 4.640 0.001 0.000 0.227 2440 D C 1.015 177.394 176.300 0.131 0.000 1.012 2440 D CA -0.023 54.060 54.000 0.138 0.000 0.905 2440 D CB -0.507 40.402 40.800 0.182 0.000 0.895 2440 D HN 0.500 nan 8.370 nan 0.000 0.532 2441 R N -2.147 118.421 120.500 0.115 0.000 3.840 2441 R HA -0.147 4.193 4.340 0.001 0.000 0.464 2441 R C 0.037 176.409 176.300 0.120 0.000 0.986 2441 R CA 1.378 57.553 56.100 0.124 0.000 1.305 2441 R CB -3.053 27.333 30.300 0.144 0.000 1.950 2441 R HN 0.545 nan 8.270 nan 0.000 0.526 2442 T N -1.929 112.668 114.554 0.072 0.000 2.924 2442 T HA 0.756 5.106 4.350 0.001 0.000 0.291 2442 T C -0.215 174.475 174.700 -0.016 0.000 1.045 2442 T CA -1.055 61.001 62.100 -0.073 0.000 1.015 2442 T CB 1.977 70.675 68.868 -0.284 0.000 1.103 2442 T HN 0.017 nan 8.240 nan 0.000 0.496 2443 L N 1.408 122.489 121.223 -0.235 0.000 2.352 2443 L HA 0.690 5.030 4.340 0.001 0.000 0.269 2443 L C 0.353 177.080 176.870 -0.240 0.000 1.034 2443 L CA -0.441 54.289 54.840 -0.183 0.000 0.806 2443 L CB 1.474 43.270 42.059 -0.438 0.000 1.244 2443 L HN 0.728 nan 8.230 nan 0.000 0.447 2444 K N 0.457 120.802 120.400 -0.091 0.000 2.469 2444 K HA 0.716 5.036 4.320 0.001 0.000 0.254 2444 K C -1.678 174.767 176.600 -0.259 0.000 0.939 2444 K CA -0.799 55.284 56.287 -0.341 0.000 0.812 2444 K CB 2.696 34.863 32.500 -0.555 0.000 1.301 2444 K HN 0.193 nan 8.250 nan 0.000 0.433 2445 V N 2.437 122.124 119.914 -0.379 0.000 2.417 2445 V HA 0.459 4.579 4.120 0.001 0.000 0.291 2445 V C -1.147 174.798 176.094 -0.248 0.000 1.024 2445 V CA -0.706 61.513 62.300 -0.136 0.000 0.861 2445 V CB 0.619 32.415 31.823 -0.045 0.000 0.985 2445 V HN 0.661 nan 8.190 nan 0.000 0.436 2446 W N 2.095 123.407 121.300 0.021 0.000 2.820 2446 W HA 0.515 5.175 4.660 0.001 0.000 0.350 2446 W C 0.099 176.630 176.519 0.021 0.000 1.116 2446 W CA -0.793 56.560 57.345 0.013 0.000 1.146 2446 W CB 0.831 30.296 29.460 0.007 0.000 1.433 2446 W HN 0.404 nan 8.180 nan 0.000 0.561 2447 N N 1.007 119.868 118.700 0.269 0.000 2.469 2447 N HA 0.287 5.027 4.740 0.001 0.000 0.253 2447 N C 0.527 176.127 175.510 0.150 0.000 0.970 2447 N CA 0.119 53.263 53.050 0.158 0.000 0.940 2447 N CB 1.753 40.302 38.487 0.103 0.000 1.128 2447 N HN 0.610 nan 8.380 nan 0.000 0.503 2448 A N 3.346 126.236 122.820 0.117 0.000 2.019 2448 A HA -0.168 4.152 4.320 0.001 0.000 0.219 2448 A C 1.856 179.466 177.584 0.042 0.000 1.164 2448 A CA 1.476 53.556 52.037 0.070 0.000 0.644 2448 A CB -0.250 18.788 19.000 0.064 0.000 0.805 2448 A HN 0.745 nan 8.150 nan 0.000 0.449 2449 E N -0.123 120.106 120.200 0.048 0.000 2.033 2449 E HA -0.110 4.241 4.350 0.001 0.000 0.189 2449 E C 2.150 178.765 176.600 0.024 0.000 0.979 2449 E CA 2.103 58.521 56.400 0.031 0.000 0.802 2449 E CB -0.384 29.335 29.700 0.032 0.000 0.763 2449 E HN 0.608 nan 8.360 nan 0.000 0.449 2450 T N -3.302 111.275 114.554 0.038 0.000 3.067 2450 T HA 0.194 4.545 4.350 0.001 0.000 0.257 2450 T C 1.441 176.170 174.700 0.048 0.000 1.105 2450 T CA 0.590 62.710 62.100 0.034 0.000 1.104 2450 T CB -0.153 68.736 68.868 0.035 0.000 0.925 2450 T HN 0.376 nan 8.240 nan 0.000 0.498 2451 G N 2.413 111.259 108.800 0.077 0.000 2.246 2451 G HA2 -0.250 3.710 3.960 0.001 0.000 0.273 2451 G HA3 -0.250 3.710 3.960 0.001 0.000 0.273 2451 G C -0.273 174.758 174.900 0.218 0.000 1.055 2451 G CA 0.341 45.510 45.100 0.115 0.000 0.851 2451 G HN 1.072 nan 8.290 nan 0.000 0.500 2452 E N -0.901 119.419 120.200 0.200 0.000 2.195 2452 E HA 0.524 4.875 4.350 0.001 0.000 0.271 2452 E C 0.272 176.921 176.600 0.082 0.000 0.923 2452 E CA -0.958 55.527 56.400 0.142 0.000 0.790 2452 E CB 1.585 31.311 29.700 0.043 0.000 1.155 2452 E HN 0.397 nan 8.360 nan 0.000 0.402 2453 C N 5.168 124.384 119.300 -0.139 0.000 2.629 2453 C HA 0.267 4.727 4.460 0.001 0.000 0.410 2453 C C 1.279 176.064 174.990 -0.342 0.000 1.339 2453 C CA -0.348 58.328 59.018 -0.570 0.000 1.810 2453 C CB -1.462 25.773 27.740 -0.842 0.000 2.549 2453 C HN 0.888 nan 8.230 nan 0.000 0.589 2454 I N 4.244 124.637 120.570 -0.296 0.000 3.265 2454 I HA 0.184 4.355 4.170 0.001 0.000 0.282 2454 I C 0.932 176.770 176.117 -0.466 0.000 1.207 2454 I CA 0.517 61.672 61.300 -0.242 0.000 1.449 2454 I CB -0.235 37.755 38.000 -0.017 0.000 1.121 2454 I HN 0.678 nan 8.210 nan 0.000 0.442 2455 H N -0.269 118.632 119.070 -0.281 0.000 3.016 2455 H HA 0.417 4.973 4.556 0.001 0.000 0.362 2455 H C -1.075 174.026 175.328 -0.379 0.000 1.233 2455 H CA -0.469 55.430 56.048 -0.249 0.000 1.124 2455 H CB 2.462 32.117 29.762 -0.179 0.000 1.850 2455 H HN -0.212 nan 8.280 nan 0.000 0.549 2456 T N 2.974 117.385 114.554 -0.238 0.000 2.937 2456 T HA 0.333 4.684 4.350 0.001 0.000 0.297 2456 T C -0.158 174.216 174.700 -0.543 0.000 0.991 2456 T CA -0.726 61.087 62.100 -0.478 0.000 0.990 2456 T CB 0.745 69.314 68.868 -0.499 0.000 0.991 2456 T HN 0.217 nan 8.240 nan 0.000 0.440 2457 L N 4.161 124.992 121.223 -0.653 0.000 2.262 2457 L HA 0.544 4.884 4.340 0.001 0.000 0.288 2457 L C -0.839 175.669 176.870 -0.604 0.000 1.035 2457 L CA -0.974 53.459 54.840 -0.679 0.000 0.820 2457 L CB 0.197 41.493 42.059 -1.272 0.000 1.204 2457 L HN 0.609 nan 8.230 nan 0.000 0.424 2458 Y N 1.124 121.406 120.300 -0.030 0.000 2.419 2458 Y HA 0.681 5.232 4.550 0.001 0.000 0.328 2458 Y C 1.144 177.191 175.900 0.245 0.000 1.162 2458 Y CA 0.051 58.195 58.100 0.073 0.000 1.174 2458 Y CB 1.979 40.470 38.460 0.052 0.000 1.228 2458 Y HN 0.726 nan 8.280 nan 0.000 0.473 2459 G N -0.494 108.509 108.800 0.339 0.000 3.611 2459 G HA2 -0.137 3.824 3.960 0.001 0.000 0.217 2459 G HA3 -0.137 3.824 3.960 0.001 0.000 0.217 2459 G C -0.412 174.539 174.900 0.085 0.000 1.023 2459 G CA -0.597 44.624 45.100 0.202 0.000 0.887 2459 G HN 0.536 nan 8.290 nan 0.000 0.420 2460 H N 1.636 120.855 119.070 0.249 0.000 2.582 2460 H HA 0.465 5.021 4.556 0.001 0.000 0.345 2460 H C 1.641 177.039 175.328 0.117 0.000 1.104 2460 H CA 1.137 57.280 56.048 0.158 0.000 1.390 2460 H CB 1.804 31.653 29.762 0.146 0.000 1.461 2460 H HN 0.333 nan 8.280 nan 0.000 0.551 2461 T N -1.030 113.659 114.554 0.225 0.000 3.039 2461 T HA 0.059 4.410 4.350 0.001 0.000 0.250 2461 T C 1.118 175.884 174.700 0.109 0.000 1.052 2461 T CA -0.043 62.142 62.100 0.141 0.000 1.125 2461 T CB 0.454 69.382 68.868 0.099 0.000 0.908 2461 T HN 0.318 nan 8.240 nan 0.000 0.473 2462 S N 0.480 116.236 115.700 0.094 0.000 2.739 2462 S HA 0.496 4.966 4.470 0.001 0.000 0.306 2462 S C -0.207 174.392 174.600 -0.003 0.000 1.115 2462 S CA -0.537 57.683 58.200 0.033 0.000 0.985 2462 S CB 1.057 64.258 63.200 0.002 0.000 1.133 2462 S HN 0.348 nan 8.310 nan 0.000 0.541 2463 T N 2.038 116.568 114.554 -0.040 0.000 2.867 2463 T HA 0.043 4.394 4.350 0.001 0.000 0.290 2463 T C -0.201 174.429 174.700 -0.116 0.000 1.025 2463 T CA 0.298 62.359 62.100 -0.065 0.000 1.146 2463 T CB -0.121 68.675 68.868 -0.120 0.000 1.024 2463 T HN 0.424 nan 8.240 nan 0.000 0.519 2464 V N 6.275 126.143 119.914 -0.077 0.000 2.313 2464 V HA 0.150 4.271 4.120 0.001 0.000 0.252 2464 V C 1.407 177.472 176.094 -0.049 0.000 1.112 2464 V CA -0.172 62.056 62.300 -0.120 0.000 0.984 2464 V CB 0.465 32.260 31.823 -0.046 0.000 1.157 2464 V HN 0.653 nan 8.190 nan 0.000 0.493 2465 R N 3.321 123.763 120.500 -0.097 0.000 2.093 2465 R HA 0.053 4.394 4.340 0.001 0.000 0.224 2465 R C 0.699 177.001 176.300 0.002 0.000 1.101 2465 R CA 1.300 57.368 56.100 -0.054 0.000 0.979 2465 R CB -0.011 30.199 30.300 -0.150 0.000 0.877 2465 R HN 0.821 nan 8.270 nan 0.000 0.441 2466 C N -1.334 117.957 119.300 -0.017 0.000 3.090 2466 C HA 0.850 5.310 4.460 0.001 0.000 0.305 2466 C C -0.689 174.339 174.990 0.064 0.000 1.292 2466 C CA -1.387 57.650 59.018 0.032 0.000 1.482 2466 C CB 1.402 29.150 27.740 0.014 0.000 1.897 2466 C HN 0.470 nan 8.230 nan 0.000 0.469 2467 M N 1.109 120.779 119.600 0.117 0.000 2.471 2467 M HA 0.646 5.126 4.480 0.001 0.000 0.284 2467 M C -1.827 174.637 176.300 0.273 0.000 1.203 2467 M CA -0.257 55.148 55.300 0.174 0.000 0.915 2467 M CB 1.967 34.658 32.600 0.152 0.000 1.734 2467 M HN 0.910 nan 8.290 nan 0.000 0.485 2468 H N 1.881 121.054 119.070 0.173 0.000 2.744 2468 H HA 0.727 5.283 4.556 0.001 0.000 0.339 2468 H C -2.265 173.233 175.328 0.283 0.000 1.004 2468 H CA -0.703 55.477 56.048 0.219 0.000 1.257 2468 H CB 1.746 31.659 29.762 0.251 0.000 1.552 2468 H HN 0.813 nan 8.280 nan 0.000 0.522 2469 L N 5.192 126.437 121.223 0.037 0.000 2.289 2469 L HA 0.388 4.729 4.340 0.001 0.000 0.285 2469 L C -1.119 175.734 176.870 -0.028 0.000 1.049 2469 L CA -0.331 54.547 54.840 0.063 0.000 0.804 2469 L CB 0.573 42.678 42.059 0.077 0.000 1.195 2469 L HN 0.838 nan 8.230 nan 0.000 0.428 2470 H N 3.636 122.715 119.070 0.015 0.000 2.991 2470 H HA 0.440 4.996 4.556 0.000 0.000 0.304 2470 H C 0.191 175.513 175.328 -0.010 0.000 1.040 2470 H CA 0.381 56.374 56.048 -0.093 0.000 1.410 2470 H CB 0.591 30.168 29.762 -0.309 0.000 1.529 2470 H HN 0.904 nan 8.280 nan 0.000 0.509 2471 E N 2.108 122.078 120.200 -0.383 0.000 3.130 2471 E HA -0.346 4.004 4.350 0.001 0.000 0.381 2471 E C 0.281 176.834 176.600 -0.077 0.000 1.488 2471 E CA 1.975 58.205 56.400 -0.283 0.000 1.362 2471 E CB -0.544 28.900 29.700 -0.426 0.000 1.656 2471 E HN 0.693 nan 8.360 nan 0.000 0.504 2472 K N 1.134 121.522 120.400 -0.021 0.000 2.393 2472 K HA 0.188 4.508 4.320 0.001 0.000 0.193 2472 K C 0.459 177.113 176.600 0.091 0.000 1.026 2472 K CA 0.242 56.549 56.287 0.032 0.000 1.064 2472 K CB 0.309 32.827 32.500 0.031 0.000 0.833 2472 K HN 0.090 nan 8.250 nan 0.000 0.521 2473 R N 0.616 121.217 120.500 0.169 0.000 2.732 2473 R HA 0.490 4.830 4.340 0.001 0.000 0.278 2473 R C -1.304 175.168 176.300 0.287 0.000 0.976 2473 R CA -0.667 55.582 56.100 0.248 0.000 0.963 2473 R CB 2.500 33.016 30.300 0.361 0.000 1.150 2473 R HN -0.154 nan 8.270 nan 0.000 0.478 2474 V N 2.719 122.778 119.914 0.241 0.000 2.760 2474 V HA 0.503 4.624 4.120 0.001 0.000 0.309 2474 V C -1.136 175.091 176.094 0.222 0.000 1.077 2474 V CA -0.653 61.791 62.300 0.241 0.000 0.910 2474 V CB 2.307 34.256 31.823 0.209 0.000 1.008 2474 V HN 0.466 nan 8.190 nan 0.000 0.424 2475 V N 5.655 125.659 119.914 0.149 0.000 2.513 2475 V HA 0.755 4.876 4.120 0.001 0.000 0.299 2475 V C 0.089 176.308 176.094 0.209 0.000 1.035 2475 V CA -0.212 62.132 62.300 0.073 0.000 0.889 2475 V CB 1.905 33.656 31.823 -0.120 0.000 0.988 2475 V HN 1.060 nan 8.190 nan 0.000 0.440 2476 S N 2.416 118.288 115.700 0.287 0.000 2.513 2476 S HA 0.886 5.357 4.470 0.001 0.000 0.299 2476 S C -0.184 174.511 174.600 0.158 0.000 1.087 2476 S CA -0.440 57.925 58.200 0.276 0.000 1.012 2476 S CB 1.936 65.416 63.200 0.467 0.000 1.044 2476 S HN 1.157 nan 8.310 nan 0.000 0.485 2477 G N 0.224 109.027 108.800 0.006 0.000 2.452 2477 G HA2 0.638 4.598 3.960 0.001 0.000 0.324 2477 G HA3 0.638 4.598 3.960 0.001 0.000 0.324 2477 G C -0.790 173.960 174.900 -0.249 0.000 1.214 2477 G CA -0.674 44.373 45.100 -0.088 0.000 0.947 2477 G HN 0.990 nan 8.290 nan 0.000 0.478 2478 S N 0.548 116.068 115.700 -0.301 0.000 2.661 2478 S HA 0.426 4.896 4.470 0.001 0.000 0.285 2478 S C 1.026 175.495 174.600 -0.218 0.000 1.138 2478 S CA -0.761 57.230 58.200 -0.348 0.000 0.855 2478 S CB 1.762 64.593 63.200 -0.616 0.000 1.136 2478 S HN 0.514 nan 8.310 nan 0.000 0.484 2479 R N 0.203 120.593 120.500 -0.184 0.000 2.235 2479 R HA -0.005 4.335 4.340 0.001 0.000 0.213 2479 R C 0.503 176.758 176.300 -0.076 0.000 1.059 2479 R CA 1.440 57.452 56.100 -0.147 0.000 0.997 2479 R CB -0.349 29.878 30.300 -0.123 0.000 0.884 2479 R HN 0.763 nan 8.270 nan 0.000 0.462 2480 D N -0.381 119.996 120.400 -0.038 0.000 2.358 2480 D HA 0.029 4.670 4.640 0.001 0.000 0.241 2480 D C 0.703 177.023 176.300 0.034 0.000 1.094 2480 D CA 0.666 54.681 54.000 0.025 0.000 0.907 2480 D CB 0.163 41.018 40.800 0.091 0.000 0.893 2480 D HN 0.100 nan 8.370 nan 0.000 0.528 2481 A N -1.295 121.525 122.820 0.000 0.000 3.172 2481 A HA -0.175 4.145 4.320 0.001 0.000 0.263 2481 A C 0.912 178.552 177.584 0.092 0.000 1.215 2481 A CA 1.531 53.591 52.037 0.038 0.000 1.065 2481 A CB -2.677 16.364 19.000 0.067 0.000 1.148 2481 A HN 0.833 nan 8.150 nan 0.000 0.904 2482 T N -2.916 111.687 114.554 0.082 0.000 2.926 2482 T HA 0.838 5.188 4.350 0.001 0.000 0.289 2482 T C -0.462 174.304 174.700 0.110 0.000 1.054 2482 T CA -0.504 61.648 62.100 0.086 0.000 1.015 2482 T CB 1.767 70.684 68.868 0.083 0.000 1.167 2482 T HN 0.855 nan 8.240 nan 0.000 0.526 2483 L N 0.084 121.299 121.223 -0.012 0.000 2.354 2483 L HA 0.759 5.100 4.340 0.001 0.000 0.264 2483 L C 0.092 176.902 176.870 -0.101 0.000 1.008 2483 L CA -0.884 53.953 54.840 -0.005 0.000 0.819 2483 L CB 2.243 44.183 42.059 -0.199 0.000 1.339 2483 L HN 0.680 nan 8.230 nan 0.000 0.420 2484 R N 0.387 120.860 120.500 -0.046 0.000 2.673 2484 R HA 0.781 5.122 4.340 0.001 0.000 0.281 2484 R C -1.655 174.363 176.300 -0.470 0.000 0.991 2484 R CA -0.883 54.975 56.100 -0.403 0.000 0.896 2484 R CB 2.591 32.491 30.300 -0.666 0.000 1.201 2484 R HN 0.285 nan 8.270 nan 0.000 0.457 2485 V N 2.458 122.002 119.914 -0.616 0.000 2.398 2485 V HA 0.461 4.582 4.120 0.001 0.000 0.286 2485 V C -1.005 174.767 176.094 -0.536 0.000 1.026 2485 V CA -0.692 61.367 62.300 -0.402 0.000 0.868 2485 V CB 0.891 32.594 31.823 -0.199 0.000 0.982 2485 V HN 0.631 nan 8.190 nan 0.000 0.443 2486 W N 1.668 122.932 121.300 -0.060 0.000 2.761 2486 W HA 0.523 5.183 4.660 0.000 0.000 0.340 2486 W C -0.188 176.302 176.519 -0.047 0.000 1.072 2486 W CA -0.760 56.547 57.345 -0.063 0.000 1.215 2486 W CB 0.867 30.290 29.460 -0.061 0.000 1.420 2486 W HN 0.418 nan 8.180 nan 0.000 0.519 2487 D N 2.391 122.881 120.400 0.150 0.000 2.317 2487 D HA 0.110 4.751 4.640 0.001 0.000 0.234 2487 D C 0.935 177.227 176.300 -0.013 0.000 1.112 2487 D CA -0.182 53.853 54.000 0.058 0.000 0.840 2487 D CB 1.210 42.019 40.800 0.014 0.000 1.078 2487 D HN 0.201 nan 8.370 nan 0.000 0.486 2488 I N 3.492 124.053 120.570 -0.014 0.000 2.454 2488 I HA -0.182 3.988 4.170 0.001 0.000 0.254 2488 I C 1.851 177.852 176.117 -0.193 0.000 1.156 2488 I CA 1.054 62.300 61.300 -0.090 0.000 1.433 2488 I CB -0.642 37.353 38.000 -0.009 0.000 1.082 2488 I HN 0.543 nan 8.210 nan 0.000 0.432 2489 E N 0.286 120.415 120.200 -0.117 0.000 2.060 2489 E HA -0.077 4.273 4.350 0.001 0.000 0.189 2489 E C 1.425 177.969 176.600 -0.093 0.000 0.974 2489 E CA 1.416 57.777 56.400 -0.066 0.000 0.808 2489 E CB -0.038 29.662 29.700 -0.001 0.000 0.768 2489 E HN 0.476 nan 8.360 nan 0.000 0.453 2490 T N -2.005 112.485 114.554 -0.105 0.000 3.251 2490 T HA 0.301 4.651 4.350 0.001 0.000 0.259 2490 T C 1.279 175.942 174.700 -0.062 0.000 0.998 2490 T CA 0.088 62.187 62.100 -0.001 0.000 0.905 2490 T CB 0.297 69.182 68.868 0.029 0.000 1.067 2490 T HN 0.221 nan 8.240 nan 0.000 0.569 2491 G N 1.320 109.786 108.800 -0.557 0.000 2.485 2491 G HA2 -0.270 3.690 3.960 0.001 0.000 0.315 2491 G HA3 -0.270 3.690 3.960 0.001 0.000 0.315 2491 G C -0.011 174.954 174.900 0.108 0.000 0.914 2491 G CA 0.484 45.417 45.100 -0.279 0.000 0.889 2491 G HN 0.628 nan 8.290 nan 0.000 0.512 2492 Q N -1.603 118.256 119.800 0.100 0.000 2.204 2492 Q HA 0.606 4.946 4.340 0.001 0.000 0.254 2492 Q C 0.258 176.330 176.000 0.120 0.000 0.981 2492 Q CA -0.881 54.994 55.803 0.121 0.000 0.897 2492 Q CB 1.661 30.415 28.738 0.026 0.000 1.273 2492 Q HN 0.384 nan 8.270 nan 0.000 0.464 2493 C N 3.560 122.826 119.300 -0.056 0.000 2.203 2493 C HA 0.397 4.857 4.460 0.001 0.000 0.325 2493 C C 0.847 175.562 174.990 -0.457 0.000 1.156 2493 C CA -0.535 58.188 59.018 -0.492 0.000 1.597 2493 C CB -1.545 25.708 27.740 -0.812 0.000 2.148 2493 C HN 0.843 nan 8.230 nan 0.000 0.472 2494 L N 4.088 125.020 121.223 -0.485 0.000 2.072 2494 L HA 0.175 4.515 4.340 0.001 0.000 0.205 2494 L C 0.869 177.136 176.870 -1.006 0.000 1.079 2494 L CA 1.626 56.056 54.840 -0.684 0.000 0.752 2494 L CB -0.806 40.871 42.059 -0.636 0.000 0.906 2494 L HN 0.738 nan 8.230 nan 0.000 0.436 2495 H N -3.568 115.299 119.070 -0.339 0.000 3.016 2495 H HA 0.662 5.218 4.556 0.001 0.000 0.362 2495 H C -1.272 173.827 175.328 -0.383 0.000 1.233 2495 H CA -0.955 54.913 56.048 -0.299 0.000 1.124 2495 H CB 1.693 31.314 29.762 -0.234 0.000 1.850 2495 H HN -0.363 nan 8.280 nan 0.000 0.549 2496 V N 2.723 122.527 119.914 -0.183 0.000 2.483 2496 V HA 0.220 4.340 4.120 0.001 0.000 0.297 2496 V C -1.077 174.864 176.094 -0.254 0.000 1.027 2496 V CA -0.767 61.382 62.300 -0.252 0.000 0.855 2496 V CB 1.603 33.297 31.823 -0.214 0.000 0.995 2496 V HN 0.429 nan 8.190 nan 0.000 0.424 2497 L N 6.217 127.196 121.223 -0.406 0.000 2.272 2497 L HA 0.572 4.912 4.340 0.001 0.000 0.284 2497 L C -0.114 176.475 176.870 -0.469 0.000 1.045 2497 L CA 0.039 54.457 54.840 -0.704 0.000 0.842 2497 L CB 0.561 41.709 42.059 -1.519 0.000 1.224 2497 L HN 0.583 nan 8.230 nan 0.000 0.430 2498 M N 1.989 121.507 119.600 -0.136 0.000 2.294 2498 M HA 0.651 5.132 4.480 0.001 0.000 0.335 2498 M C 0.769 177.208 176.300 0.231 0.000 1.079 2498 M CA -0.185 55.141 55.300 0.044 0.000 0.982 2498 M CB 2.240 34.853 32.600 0.022 0.000 1.651 2498 M HN 0.681 nan 8.290 nan 0.000 0.437 2499 G N -0.006 108.933 108.800 0.232 0.000 4.248 2499 G HA2 -0.039 3.921 3.960 0.001 0.000 0.218 2499 G HA3 -0.039 3.921 3.960 0.001 0.000 0.218 2499 G C -0.311 174.619 174.900 0.051 0.000 0.790 2499 G CA -0.552 44.638 45.100 0.150 0.000 0.844 2499 G HN 0.621 nan 8.290 nan 0.000 0.588 2500 H N 1.702 120.882 119.070 0.183 0.000 2.580 2500 H HA 0.374 4.930 4.556 0.001 0.000 0.322 2500 H C 1.771 177.132 175.328 0.054 0.000 1.082 2500 H CA 0.675 56.789 56.048 0.110 0.000 1.383 2500 H CB 2.157 31.990 29.762 0.118 0.000 1.450 2500 H HN 0.195 nan 8.280 nan 0.000 0.505 2501 V N 1.303 121.320 119.914 0.171 0.000 2.951 2501 V HA 0.300 4.420 4.120 0.001 0.000 0.255 2501 V C 1.019 177.153 176.094 0.067 0.000 1.088 2501 V CA 0.889 63.238 62.300 0.083 0.000 1.109 2501 V CB -0.331 31.511 31.823 0.032 0.000 0.724 2501 V HN 0.617 nan 8.190 nan 0.000 0.471 2502 A N 0.016 122.883 122.820 0.078 0.000 2.387 2502 A HA 0.909 5.229 4.320 0.001 0.000 0.298 2502 A C 0.370 177.937 177.584 -0.029 0.000 1.165 2502 A CA -0.343 51.722 52.037 0.048 0.000 0.814 2502 A CB 0.935 19.992 19.000 0.094 0.000 1.357 2502 A HN 1.191 nan 8.150 nan 0.000 0.443 2503 A N -0.338 122.433 122.820 -0.082 0.000 2.561 2503 A HA 0.446 4.766 4.320 0.001 0.000 0.234 2503 A C 0.028 177.346 177.584 -0.444 0.000 1.055 2503 A CA 0.103 51.980 52.037 -0.266 0.000 0.756 2503 A CB -0.423 18.362 19.000 -0.359 0.000 0.986 2503 A HN 1.197 nan 8.150 nan 0.000 0.505 2504 V N 3.947 123.636 119.914 -0.375 0.000 2.385 2504 V HA 0.256 4.376 4.120 0.001 0.000 0.269 2504 V C 1.286 177.142 176.094 -0.397 0.000 1.043 2504 V CA -0.018 62.054 62.300 -0.379 0.000 0.906 2504 V CB 0.774 32.463 31.823 -0.224 0.000 0.995 2504 V HN 1.064 nan 8.190 nan 0.000 0.467 2505 R N 3.706 123.941 120.500 -0.443 0.000 2.175 2505 R HA 0.182 4.522 4.340 0.001 0.000 0.202 2505 R C 0.523 176.728 176.300 -0.158 0.000 1.018 2505 R CA 0.893 56.759 56.100 -0.391 0.000 1.029 2505 R CB 0.153 30.119 30.300 -0.557 0.000 0.959 2505 R HN 0.842 nan 8.270 nan 0.000 0.480 2506 C N -1.936 117.304 119.300 -0.101 0.000 2.994 2506 C HA 0.867 5.328 4.460 0.001 0.000 0.305 2506 C C -0.602 174.396 174.990 0.013 0.000 1.251 2506 C CA -1.428 57.583 59.018 -0.011 0.000 1.478 2506 C CB 1.399 29.160 27.740 0.037 0.000 1.922 2506 C HN 0.054 nan 8.230 nan 0.000 0.472 2507 V N 1.803 121.742 119.914 0.042 0.000 3.120 2507 V HA 0.726 4.846 4.120 0.001 0.000 0.303 2507 V C -1.969 174.174 176.094 0.082 0.000 1.238 2507 V CA 0.063 62.412 62.300 0.080 0.000 1.008 2507 V CB 2.260 34.141 31.823 0.096 0.000 1.064 2507 V HN 1.053 nan 8.190 nan 0.000 0.434 2508 Q N 3.505 123.403 119.800 0.164 0.000 2.389 2508 Q HA 0.512 4.853 4.340 0.001 0.000 0.277 2508 Q C -2.146 174.200 176.000 0.577 0.000 1.082 2508 Q CA -0.461 55.497 55.803 0.258 0.000 0.810 2508 Q CB 2.972 31.868 28.738 0.263 0.000 1.374 2508 Q HN 0.829 nan 8.270 nan 0.000 0.422 2509 Y N 2.175 122.896 120.300 0.702 0.000 2.362 2509 Y HA 0.201 4.752 4.550 0.001 0.000 0.326 2509 Y C -0.754 175.276 175.900 0.216 0.000 1.083 2509 Y CA -1.271 57.061 58.100 0.387 0.000 1.073 2509 Y CB 1.062 39.675 38.460 0.254 0.000 1.211 2509 Y HN 0.648 nan 8.280 nan 0.000 0.433 2510 D N 2.360 122.630 120.400 -0.217 0.000 2.395 2510 D HA 0.287 4.928 4.640 0.001 0.000 0.213 2510 D C 1.475 177.025 176.300 -1.250 0.000 1.110 2510 D CA 0.514 54.151 54.000 -0.604 0.000 0.835 2510 D CB 0.376 40.991 40.800 -0.309 0.000 0.965 2510 D HN 1.016 nan 8.370 nan 0.000 0.505 2511 G N 1.108 108.961 108.800 -1.580 0.000 2.234 2511 G HA2 -0.382 3.578 3.960 0.001 0.000 0.235 2511 G HA3 -0.382 3.578 3.960 0.001 0.000 0.235 2511 G C 1.147 175.893 174.900 -0.256 0.000 0.997 2511 G CA 0.409 44.902 45.100 -1.012 0.000 0.623 2511 G HN 0.556 nan 8.290 nan 0.000 0.514 2512 R N -0.357 120.056 120.500 -0.145 0.000 2.125 2512 R HA 0.330 4.670 4.340 0.001 0.000 0.195 2512 R C 0.718 177.120 176.300 0.169 0.000 1.138 2512 R CA 0.119 56.246 56.100 0.045 0.000 1.123 2512 R CB 0.268 30.583 30.300 0.025 0.000 1.049 2512 R HN 0.223 nan 8.270 nan 0.000 0.503 2513 R N 0.807 121.457 120.500 0.250 0.000 2.778 2513 R HA 0.448 4.788 4.340 0.001 0.000 0.277 2513 R C -1.177 175.347 176.300 0.373 0.000 0.977 2513 R CA -0.846 55.417 56.100 0.272 0.000 0.950 2513 R CB 2.317 32.745 30.300 0.215 0.000 1.165 2513 R HN 0.006 nan 8.270 nan 0.000 0.474 2514 V N 2.200 122.288 119.914 0.290 0.000 2.459 2514 V HA 0.399 4.519 4.120 0.001 0.000 0.295 2514 V C -0.350 175.880 176.094 0.226 0.000 1.029 2514 V CA -0.716 61.752 62.300 0.279 0.000 0.874 2514 V CB 2.151 34.025 31.823 0.085 0.000 0.985 2514 V HN 0.393 nan 8.190 nan 0.000 0.438 2515 V N 4.373 124.350 119.914 0.105 0.000 2.495 2515 V HA 0.741 4.861 4.120 0.001 0.000 0.298 2515 V C -0.095 176.082 176.094 0.138 0.000 1.031 2515 V CA -0.392 61.910 62.300 0.003 0.000 0.871 2515 V CB 2.122 33.744 31.823 -0.334 0.000 0.988 2515 V HN 0.986 nan 8.190 nan 0.000 0.432 2516 S N 2.508 118.342 115.700 0.223 0.000 2.548 2516 S HA 0.905 5.375 4.470 0.001 0.000 0.286 2516 S C -0.339 174.366 174.600 0.174 0.000 1.098 2516 S CA -0.481 57.861 58.200 0.236 0.000 0.930 2516 S CB 2.142 65.595 63.200 0.422 0.000 1.070 2516 S HN 1.175 nan 8.310 nan 0.000 0.480 2517 G N 0.197 109.023 108.800 0.043 0.000 2.609 2517 G HA2 0.744 4.705 3.960 0.001 0.000 0.308 2517 G HA3 0.744 4.705 3.960 0.001 0.000 0.308 2517 G C -0.610 174.189 174.900 -0.168 0.000 1.369 2517 G CA -0.614 44.490 45.100 0.007 0.000 0.958 2517 G HN 1.148 nan 8.290 nan 0.000 0.499 2518 A N 1.676 124.368 122.820 -0.213 0.000 2.387 2518 A HA 0.679 4.999 4.320 0.001 0.000 0.303 2518 A C -0.107 177.501 177.584 0.040 0.000 1.145 2518 A CA -0.719 51.128 52.037 -0.316 0.000 0.801 2518 A CB 0.887 19.445 19.000 -0.737 0.000 1.342 2518 A HN 0.622 nan 8.150 nan 0.000 0.440 2519 Y N 0.658 120.894 120.300 -0.107 0.000 2.619 2519 Y HA -0.010 4.540 4.550 0.000 0.000 0.308 2519 Y C 0.889 176.895 175.900 0.175 0.000 1.192 2519 Y CA 0.884 58.993 58.100 0.015 0.000 1.319 2519 Y CB -0.627 37.808 38.460 -0.043 0.000 1.030 2519 Y HN 0.749 nan 8.280 nan 0.000 0.517 2520 D N -2.815 117.738 120.400 0.256 0.000 2.427 2520 D HA 0.008 4.648 4.640 0.001 0.000 0.224 2520 D C 0.580 176.963 176.300 0.138 0.000 1.157 2520 D CA -0.261 53.770 54.000 0.051 0.000 0.828 2520 D CB -1.214 39.607 40.800 0.036 0.000 0.974 2520 D HN 0.282 nan 8.370 nan 0.000 0.498 2521 F N -1.509 118.520 119.950 0.131 0.000 2.914 2521 F HA -0.272 4.256 4.527 0.001 0.000 0.304 2521 F C 0.079 175.987 175.800 0.179 0.000 0.712 2521 F CA -0.104 57.995 58.000 0.164 0.000 1.211 2521 F CB -1.289 37.798 39.000 0.145 0.000 1.515 2521 F HN 0.156 nan 8.300 nan 0.000 0.350 2522 M N 0.721 120.518 119.600 0.329 0.000 2.578 2522 M HA 0.630 5.110 4.480 0.001 0.000 0.321 2522 M C -0.140 176.287 176.300 0.212 0.000 1.182 2522 M CA -0.821 54.614 55.300 0.225 0.000 0.965 2522 M CB 1.828 34.542 32.600 0.190 0.000 1.694 2522 M HN -0.171 nan 8.290 nan 0.000 0.461 2523 V N 2.576 122.506 119.914 0.027 0.000 2.444 2523 V HA 0.445 4.565 4.120 0.001 0.000 0.294 2523 V C -0.231 175.754 176.094 -0.181 0.000 1.022 2523 V CA -0.864 61.404 62.300 -0.053 0.000 0.850 2523 V CB 1.880 33.545 31.823 -0.263 0.000 0.992 2523 V HN 0.709 nan 8.190 nan 0.000 0.426 2524 K N 3.494 123.850 120.400 -0.072 0.000 2.244 2524 K HA 0.730 5.050 4.320 0.001 0.000 0.260 2524 K C -1.145 175.209 176.600 -0.411 0.000 0.951 2524 K CA -0.703 55.352 56.287 -0.387 0.000 0.826 2524 K CB 2.541 34.643 32.500 -0.664 0.000 1.108 2524 K HN 0.442 nan 8.250 nan 0.000 0.433 2525 V N 3.070 122.677 119.914 -0.511 0.000 2.427 2525 V HA 0.419 4.540 4.120 0.001 0.000 0.286 2525 V C -0.963 174.903 176.094 -0.381 0.000 1.034 2525 V CA -0.691 61.426 62.300 -0.305 0.000 0.893 2525 V CB 0.377 32.092 31.823 -0.180 0.000 0.982 2525 V HN 0.675 nan 8.190 nan 0.000 0.452 2526 W N 1.556 122.804 121.300 -0.087 0.000 2.882 2526 W HA 0.586 5.246 4.660 0.000 0.000 0.345 2526 W C -0.636 175.850 176.519 -0.056 0.000 1.125 2526 W CA -0.965 56.333 57.345 -0.079 0.000 1.167 2526 W CB 0.966 30.374 29.460 -0.086 0.000 1.431 2526 W HN 0.489 nan 8.180 nan 0.000 0.543 2527 D N 2.213 122.729 120.400 0.194 0.000 2.460 2527 D HA 0.301 4.942 4.640 0.001 0.000 0.232 2527 D C -1.218 175.086 176.300 0.007 0.000 1.079 2527 D CA -2.486 51.562 54.000 0.079 0.000 0.864 2527 D CB 1.783 42.599 40.800 0.028 0.000 1.048 2527 D HN -0.089 nan 8.370 nan 0.000 0.523 2528 P HA -0.190 nan 4.420 nan 0.000 0.215 2528 P C 1.054 177.922 177.300 -0.720 0.000 1.157 2528 P CA 0.957 63.850 63.100 -0.346 0.000 0.868 2528 P CB 0.456 31.948 31.700 -0.346 0.000 0.788 2529 E N -0.130 119.727 120.200 -0.572 0.000 2.169 2529 E HA -0.166 4.184 4.350 0.001 0.000 0.202 2529 E C 1.663 178.166 176.600 -0.163 0.000 1.016 2529 E CA 2.179 58.331 56.400 -0.414 0.000 0.817 2529 E CB -1.051 28.591 29.700 -0.096 0.000 0.736 2529 E HN 0.461 nan 8.360 nan 0.000 0.462 2530 T N -2.548 111.939 114.554 -0.111 0.000 3.176 2530 T HA 0.215 4.565 4.350 0.001 0.000 0.263 2530 T C 0.135 174.832 174.700 -0.005 0.000 1.021 2530 T CA -0.144 61.943 62.100 -0.023 0.000 0.905 2530 T CB -0.034 68.827 68.868 -0.012 0.000 1.057 2530 T HN 0.091 nan 8.240 nan 0.000 0.558 2531 E N 1.263 121.439 120.200 -0.039 0.000 2.294 2531 E HA -0.203 4.148 4.350 0.001 0.000 0.228 2531 E C -0.000 176.665 176.600 0.109 0.000 1.253 2531 E CA 0.844 57.247 56.400 0.005 0.000 0.716 2531 E CB -1.933 27.774 29.700 0.012 0.000 1.184 2531 E HN 0.747 nan 8.360 nan 0.000 0.374 2532 T N -1.697 112.939 114.554 0.137 0.000 2.856 2532 T HA 0.386 4.737 4.350 0.001 0.000 0.283 2532 T C -0.170 174.636 174.700 0.176 0.000 1.008 2532 T CA -0.765 61.421 62.100 0.142 0.000 0.997 2532 T CB 1.710 70.591 68.868 0.021 0.000 0.992 2532 T HN 0.298 nan 8.240 nan 0.000 0.454 2533 C N 7.148 126.426 119.300 -0.036 0.000 2.322 2533 C HA 0.442 4.902 4.460 0.001 0.000 0.343 2533 C C 1.743 176.483 174.990 -0.417 0.000 1.190 2533 C CA -0.707 57.971 59.018 -0.566 0.000 1.704 2533 C CB -2.268 24.884 27.740 -0.980 0.000 2.293 2533 C HN 1.018 nan 8.230 nan 0.000 0.523 2534 L N 4.664 125.665 121.223 -0.369 0.000 2.109 2534 L HA 0.128 4.469 4.340 0.001 0.000 0.207 2534 L C 1.102 177.604 176.870 -0.614 0.000 1.086 2534 L CA 1.083 55.682 54.840 -0.402 0.000 0.760 2534 L CB -0.392 41.497 42.059 -0.283 0.000 0.910 2534 L HN 0.700 nan 8.230 nan 0.000 0.437 2535 H N -1.598 117.250 119.070 -0.370 0.000 3.012 2535 H HA 0.349 4.906 4.556 0.001 0.000 0.367 2535 H C -1.052 174.006 175.328 -0.450 0.000 1.211 2535 H CA -0.492 55.347 56.048 -0.347 0.000 1.139 2535 H CB 2.194 31.778 29.762 -0.296 0.000 1.838 2535 H HN -0.270 nan 8.280 nan 0.000 0.550 2536 T N 3.434 117.855 114.554 -0.221 0.000 2.864 2536 T HA 0.326 4.677 4.350 0.001 0.000 0.299 2536 T C 0.284 174.809 174.700 -0.291 0.000 1.011 2536 T CA -0.660 61.264 62.100 -0.295 0.000 0.975 2536 T CB 0.381 69.099 68.868 -0.250 0.000 0.962 2536 T HN 0.203 nan 8.240 nan 0.000 0.448 2537 L N 4.039 124.980 121.223 -0.471 0.000 2.278 2537 L HA 0.417 4.757 4.340 0.001 0.000 0.287 2537 L C 0.506 177.104 176.870 -0.454 0.000 1.072 2537 L CA -0.430 53.934 54.840 -0.794 0.000 0.819 2537 L CB 0.545 41.542 42.059 -1.769 0.000 1.176 2537 L HN 0.460 nan 8.230 nan 0.000 0.435 2538 Q N 1.869 121.603 119.800 -0.110 0.000 2.312 2538 Q HA 0.586 4.926 4.340 0.001 0.000 0.263 2538 Q C 0.496 176.678 176.000 0.303 0.000 0.995 2538 Q CA -0.019 55.846 55.803 0.103 0.000 0.853 2538 Q CB 2.385 31.163 28.738 0.067 0.000 1.300 2538 Q HN 0.891 nan 8.270 nan 0.000 0.448 2539 G N 1.234 110.189 108.800 0.259 0.000 3.989 2539 G HA2 -0.098 3.863 3.960 0.001 0.000 0.183 2539 G HA3 -0.098 3.863 3.960 0.001 0.000 0.183 2539 G C -0.456 174.541 174.900 0.162 0.000 0.892 2539 G CA -0.541 44.664 45.100 0.174 0.000 0.914 2539 G HN 0.678 nan 8.290 nan 0.000 0.347 2540 H N 2.288 121.515 119.070 0.260 0.000 2.975 2540 H HA 0.321 4.877 4.556 0.001 0.000 0.303 2540 H C 1.479 176.883 175.328 0.126 0.000 1.023 2540 H CA 0.649 56.792 56.048 0.159 0.000 1.473 2540 H CB 1.238 31.102 29.762 0.169 0.000 1.498 2540 H HN 0.227 nan 8.280 nan 0.000 0.549 2541 T N 0.779 115.424 114.554 0.151 0.000 3.380 2541 T HA 0.053 4.403 4.350 0.001 0.000 0.250 2541 T C 0.529 174.977 174.700 -0.421 0.000 1.082 2541 T CA -0.312 61.816 62.100 0.047 0.000 0.968 2541 T CB -0.269 68.630 68.868 0.051 0.000 1.027 2541 T HN 0.493 nan 8.240 nan 0.000 0.575 2542 N N 0.370 118.529 118.700 -0.901 0.000 3.355 2542 N HA 0.179 4.919 4.740 0.001 0.000 0.238 2542 N C -1.392 173.507 175.510 -1.018 0.000 1.466 2542 N CA -0.799 51.276 53.050 -1.626 0.000 0.882 2542 N CB 1.302 39.396 38.487 -0.655 0.000 1.406 2542 N HN 0.175 nan 8.380 nan 0.000 0.500 2543 R N 0.487 120.640 120.500 -0.579 0.000 2.500 2543 R HA 0.073 4.413 4.340 0.001 0.000 0.281 2543 R C -0.237 176.106 176.300 0.072 0.000 0.953 2543 R CA 0.165 56.249 56.100 -0.027 0.000 1.108 2543 R CB -0.003 30.178 30.300 -0.199 0.000 0.901 2543 R HN 0.175 nan 8.270 nan 0.000 0.410 2544 V N 4.748 124.762 119.914 0.167 0.000 2.406 2544 V HA 0.046 4.166 4.120 0.001 0.000 0.272 2544 V C 0.122 176.287 176.094 0.119 0.000 1.043 2544 V CA 0.118 62.511 62.300 0.154 0.000 0.915 2544 V CB 0.788 32.743 31.823 0.220 0.000 0.988 2544 V HN 0.737 nan 8.190 nan 0.000 0.466 2545 Y N 2.175 122.526 120.300 0.086 0.000 2.558 2545 Y HA 0.157 4.707 4.550 0.001 0.000 0.273 2545 Y C 1.419 177.360 175.900 0.069 0.000 1.100 2545 Y CA 0.402 58.564 58.100 0.104 0.000 1.276 2545 Y CB 0.881 39.385 38.460 0.074 0.000 1.196 2545 Y HN 0.693 nan 8.280 nan 0.000 0.527 2546 S N -0.077 115.751 115.700 0.214 0.000 2.568 2546 S HA 0.753 5.223 4.470 0.001 0.000 0.293 2546 S C -1.235 173.450 174.600 0.142 0.000 1.089 2546 S CA -0.725 57.567 58.200 0.154 0.000 0.945 2546 S CB 2.267 65.546 63.200 0.130 0.000 1.077 2546 S HN 0.105 nan 8.310 nan 0.000 0.485 2547 L N 1.192 122.491 121.223 0.126 0.000 2.434 2547 L HA 0.621 4.961 4.340 0.001 0.000 0.260 2547 L C -1.364 175.587 176.870 0.136 0.000 0.983 2547 L CA -0.521 54.402 54.840 0.138 0.000 0.820 2547 L CB 2.282 44.411 42.059 0.116 0.000 1.361 2547 L HN 0.707 nan 8.230 nan 0.000 0.410 2548 Q N 2.232 122.140 119.800 0.181 0.000 2.416 2548 Q HA 0.551 4.892 4.340 0.001 0.000 0.281 2548 Q C -1.788 174.406 176.000 0.322 0.000 1.067 2548 Q CA -0.511 55.414 55.803 0.202 0.000 0.809 2548 Q CB 3.578 32.425 28.738 0.182 0.000 1.418 2548 Q HN 0.425 nan 8.270 nan 0.000 0.411 2549 F N 2.318 122.335 119.950 0.113 0.000 2.604 2549 F HA 0.299 4.826 4.527 0.001 0.000 0.316 2549 F C -1.135 174.736 175.800 0.120 0.000 1.136 2549 F CA -1.287 56.788 58.000 0.125 0.000 0.989 2549 F CB 1.317 40.387 39.000 0.117 0.000 1.258 2549 F HN 0.519 nan 8.300 nan 0.000 0.451 2550 D N 2.268 122.530 120.400 -0.230 0.000 2.538 2550 D HA 0.357 4.997 4.640 0.001 0.000 0.231 2550 D C 1.359 177.339 176.300 -0.533 0.000 1.229 2550 D CA 0.288 54.107 54.000 -0.302 0.000 0.828 2550 D CB 0.320 41.109 40.800 -0.020 0.000 1.035 2550 D HN 1.079 nan 8.370 nan 0.000 0.495 2551 G N 0.328 108.372 108.800 -1.259 0.000 2.234 2551 G HA2 -0.335 3.626 3.960 0.001 0.000 0.260 2551 G HA3 -0.335 3.626 3.960 0.001 0.000 0.260 2551 G C 0.819 175.601 174.900 -0.197 0.000 0.987 2551 G CA 0.591 45.245 45.100 -0.744 0.000 0.625 2551 G HN 0.454 nan 8.290 nan 0.000 0.532 2552 I N -1.104 119.382 120.570 -0.140 0.000 4.046 2552 I HA 0.270 4.440 4.170 0.001 0.000 0.285 2552 I C 0.734 176.745 176.117 -0.177 0.000 1.183 2552 I CA -0.116 61.092 61.300 -0.154 0.000 1.337 2552 I CB 0.451 38.271 38.000 -0.300 0.000 1.478 2552 I HN 0.144 nan 8.210 nan 0.000 0.452 2553 H N 0.526 119.720 119.070 0.205 0.000 2.469 2553 H HA 0.538 5.094 4.556 0.001 0.000 0.342 2553 H C -0.701 174.863 175.328 0.393 0.000 1.115 2553 H CA -0.591 55.608 56.048 0.252 0.000 1.204 2553 H CB 2.107 31.976 29.762 0.179 0.000 1.492 2553 H HN -0.240 nan 8.280 nan 0.000 0.499 2554 V N 3.741 123.938 119.914 0.472 0.000 2.532 2554 V HA 0.362 4.482 4.120 0.001 0.000 0.295 2554 V C -0.400 175.960 176.094 0.444 0.000 1.041 2554 V CA -0.626 61.912 62.300 0.396 0.000 0.926 2554 V CB 1.713 33.625 31.823 0.148 0.000 0.992 2554 V HN 0.506 nan 8.190 nan 0.000 0.457 2555 V N 3.610 123.737 119.914 0.355 0.000 2.577 2555 V HA 0.619 4.740 4.120 0.001 0.000 0.303 2555 V C -0.284 175.980 176.094 0.284 0.000 1.042 2555 V CA -0.459 62.012 62.300 0.285 0.000 0.872 2555 V CB 2.116 34.042 31.823 0.170 0.000 0.998 2555 V HN 0.977 nan 8.190 nan 0.000 0.423 2556 S N 2.526 118.437 115.700 0.353 0.000 2.521 2556 S HA 0.884 5.354 4.470 0.001 0.000 0.295 2556 S C -0.167 174.606 174.600 0.289 0.000 1.098 2556 S CA -0.512 57.917 58.200 0.381 0.000 0.999 2556 S CB 2.039 65.601 63.200 0.603 0.000 1.034 2556 S HN 1.153 nan 8.310 nan 0.000 0.483 2557 G N 0.573 109.457 108.800 0.141 0.000 2.417 2557 G HA2 0.575 4.536 3.960 0.001 0.000 0.320 2557 G HA3 0.575 4.536 3.960 0.001 0.000 0.320 2557 G C -0.704 174.144 174.900 -0.086 0.000 1.204 2557 G CA -0.576 44.525 45.100 0.002 0.000 0.923 2557 G HN 0.779 nan 8.290 nan 0.000 0.466 2558 S N 1.406 116.926 115.700 -0.300 0.000 2.704 2558 S HA 0.384 4.854 4.470 0.001 0.000 0.305 2558 S C 1.164 175.681 174.600 -0.140 0.000 1.107 2558 S CA -0.825 57.208 58.200 -0.279 0.000 0.993 2558 S CB 1.524 64.316 63.200 -0.679 0.000 1.110 2558 S HN 0.531 nan 8.310 nan 0.000 0.534 2559 L N 1.709 122.898 121.223 -0.057 0.000 2.551 2559 L HA 0.047 4.388 4.340 0.001 0.000 0.228 2559 L C 1.282 178.066 176.870 -0.143 0.000 1.153 2559 L CA 1.103 55.883 54.840 -0.099 0.000 0.851 2559 L CB -0.251 41.794 42.059 -0.022 0.000 0.959 2559 L HN 0.810 nan 8.230 nan 0.000 0.451 2560 D N -2.031 118.264 120.400 -0.174 0.000 2.349 2560 D HA -0.113 4.527 4.640 0.001 0.000 0.224 2560 D C 1.009 177.258 176.300 -0.085 0.000 1.029 2560 D CA 0.912 54.828 54.000 -0.141 0.000 0.879 2560 D CB 0.243 40.960 40.800 -0.139 0.000 0.906 2560 D HN 0.209 nan 8.370 nan 0.000 0.528 2561 T N -1.754 112.748 114.554 -0.087 0.000 7.113 2561 T HA -0.185 4.165 4.350 0.001 0.000 0.290 2561 T C 0.372 175.082 174.700 0.016 0.000 2.138 2561 T CA 1.203 63.289 62.100 -0.024 0.000 3.555 2561 T CB -1.780 67.088 68.868 0.000 0.000 1.347 2561 T HN 0.648 nan 8.240 nan 0.000 0.958 2562 S N 0.246 115.931 115.700 -0.026 0.000 2.713 2562 S HA 0.833 5.304 4.470 0.001 0.000 0.283 2562 S C -0.373 174.209 174.600 -0.031 0.000 1.161 2562 S CA -0.890 57.308 58.200 -0.003 0.000 0.999 2562 S CB 1.851 65.077 63.200 0.043 0.000 1.039 2562 S HN 0.442 nan 8.310 nan 0.000 0.548 2563 I N 0.724 121.264 120.570 -0.049 0.000 2.512 2563 I HA 0.429 4.599 4.170 0.001 0.000 0.287 2563 I C -0.164 175.901 176.117 -0.088 0.000 1.069 2563 I CA -0.519 60.743 61.300 -0.064 0.000 1.056 2563 I CB 1.991 39.829 38.000 -0.271 0.000 1.229 2563 I HN 0.560 nan 8.210 nan 0.000 0.429 2564 R N 4.617 125.131 120.500 0.024 0.000 2.532 2564 R HA 0.735 5.076 4.340 0.001 0.000 0.295 2564 R C -1.218 174.858 176.300 -0.373 0.000 0.968 2564 R CA -0.893 54.994 56.100 -0.356 0.000 0.916 2564 R CB 2.671 32.496 30.300 -0.792 0.000 1.124 2564 R HN 0.277 nan 8.270 nan 0.000 0.463 2565 V N 3.461 123.100 119.914 -0.459 0.000 2.378 2565 V HA 0.364 4.484 4.120 0.001 0.000 0.288 2565 V C -1.074 174.896 176.094 -0.207 0.000 1.016 2565 V CA -0.688 61.508 62.300 -0.173 0.000 0.840 2565 V CB 0.863 32.668 31.823 -0.030 0.000 0.994 2565 V HN 0.657 nan 8.190 nan 0.000 0.431 2566 W N 1.828 123.158 121.300 0.051 0.000 2.706 2566 W HA 0.555 5.215 4.660 0.001 0.000 0.346 2566 W C -0.159 176.391 176.519 0.051 0.000 1.071 2566 W CA -1.048 56.301 57.345 0.008 0.000 1.206 2566 W CB 0.599 30.026 29.460 -0.057 0.000 1.413 2566 W HN 0.434 nan 8.180 nan 0.000 0.542 2567 D N 1.230 121.773 120.400 0.238 0.000 2.325 2567 D HA 0.034 4.674 4.640 0.001 0.000 0.251 2567 D C 0.727 177.036 176.300 0.014 0.000 1.196 2567 D CA 0.003 54.060 54.000 0.095 0.000 0.866 2567 D CB 1.994 42.818 40.800 0.040 0.000 1.101 2567 D HN 0.292 nan 8.370 nan 0.000 0.476 2568 V N 4.687 124.618 119.914 0.029 0.000 2.626 2568 V HA -0.154 3.967 4.120 0.001 0.000 0.252 2568 V C 1.728 177.793 176.094 -0.049 0.000 1.067 2568 V CA 1.619 63.910 62.300 -0.014 0.000 1.081 2568 V CB -0.143 31.774 31.823 0.156 0.000 0.686 2568 V HN 0.488 nan 8.190 nan 0.000 0.468 2569 E N 0.306 120.500 120.200 -0.010 0.000 2.107 2569 E HA -0.104 4.246 4.350 0.001 0.000 0.191 2569 E C 2.259 178.884 176.600 0.043 0.000 0.982 2569 E CA 1.805 58.227 56.400 0.037 0.000 0.809 2569 E CB -0.459 29.258 29.700 0.029 0.000 0.756 2569 E HN 0.847 nan 8.360 nan 0.000 0.459 2570 T N -4.003 110.507 114.554 -0.074 0.000 2.990 2570 T HA 0.327 4.678 4.350 0.001 0.000 0.250 2570 T C 1.548 176.073 174.700 -0.291 0.000 1.041 2570 T CA 0.795 62.856 62.100 -0.065 0.000 1.010 2570 T CB 0.633 69.490 68.868 -0.018 0.000 1.003 2570 T HN 0.218 nan 8.240 nan 0.000 0.499 2571 G N 1.705 110.160 108.800 -0.575 0.000 2.179 2571 G HA2 -0.260 3.700 3.960 0.001 0.000 0.260 2571 G HA3 -0.260 3.700 3.960 0.001 0.000 0.260 2571 G C -0.125 174.714 174.900 -0.101 0.000 0.977 2571 G CA -0.011 44.712 45.100 -0.628 0.000 0.641 2571 G HN 0.697 nan 8.290 nan 0.000 0.533 2572 N N -0.249 118.451 118.700 -0.000 0.000 2.520 2572 N HA 0.383 5.123 4.740 0.001 0.000 0.273 2572 N C 0.291 175.918 175.510 0.195 0.000 1.155 2572 N CA 0.012 53.121 53.050 0.099 0.000 0.967 2572 N CB 1.190 39.691 38.487 0.024 0.000 1.092 2572 N HN 0.281 nan 8.380 nan 0.000 0.457 2573 C N 3.458 122.831 119.300 0.121 0.000 2.576 2573 C HA 0.236 4.697 4.460 0.001 0.000 0.401 2573 C C 1.663 176.512 174.990 -0.235 0.000 1.314 2573 C CA -0.436 58.439 59.018 -0.239 0.000 1.855 2573 C CB -1.433 25.997 27.740 -0.516 0.000 2.537 2573 C HN 0.746 nan 8.230 nan 0.000 0.578 2574 I N 4.166 124.565 120.570 -0.286 0.000 3.081 2574 I HA 0.155 4.326 4.170 0.001 0.000 0.274 2574 I C 0.590 176.307 176.117 -0.668 0.000 1.178 2574 I CA 0.687 61.751 61.300 -0.393 0.000 1.460 2574 I CB -0.178 37.623 38.000 -0.331 0.000 1.137 2574 I HN 0.650 nan 8.210 nan 0.000 0.443 2575 H N -0.254 118.677 119.070 -0.233 0.000 3.046 2575 H HA 0.345 4.901 4.556 0.001 0.000 0.363 2575 H C -1.067 174.077 175.328 -0.305 0.000 1.203 2575 H CA -0.561 55.355 56.048 -0.219 0.000 1.169 2575 H CB 2.043 31.691 29.762 -0.190 0.000 1.851 2575 H HN -0.237 nan 8.280 nan 0.000 0.546 2576 T N 3.508 117.998 114.554 -0.107 0.000 2.864 2576 T HA 0.350 4.700 4.350 0.001 0.000 0.310 2576 T C 0.429 175.047 174.700 -0.138 0.000 1.040 2576 T CA -0.642 61.357 62.100 -0.168 0.000 0.977 2576 T CB 0.257 69.041 68.868 -0.140 0.000 0.976 2576 T HN 0.195 nan 8.240 nan 0.000 0.459 2577 L N 4.684 125.762 121.223 -0.243 0.000 2.278 2577 L HA 0.460 4.800 4.340 0.001 0.000 0.287 2577 L C 0.966 177.712 176.870 -0.207 0.000 1.072 2577 L CA -0.595 54.022 54.840 -0.371 0.000 0.819 2577 L CB 0.394 41.849 42.059 -1.006 0.000 1.176 2577 L HN 0.643 nan 8.230 nan 0.000 0.435 2578 T N -1.138 113.413 114.554 -0.005 0.000 2.918 2578 T HA 0.811 5.162 4.350 0.001 0.000 0.286 2578 T C 0.646 175.448 174.700 0.171 0.000 1.026 2578 T CA 0.058 62.202 62.100 0.072 0.000 1.031 2578 T CB 2.376 71.268 68.868 0.040 0.000 1.046 2578 T HN 0.765 nan 8.240 nan 0.000 0.479 2579 G N 0.237 109.106 108.800 0.115 0.000 3.345 2579 G HA2 -0.067 3.893 3.960 0.001 0.000 0.199 2579 G HA3 -0.067 3.893 3.960 0.001 0.000 0.199 2579 G C 0.062 174.975 174.900 0.023 0.000 1.057 2579 G CA -0.551 44.576 45.100 0.046 0.000 0.865 2579 G HN 0.869 nan 8.290 nan 0.000 0.449 2580 H N 0.829 119.975 119.070 0.125 0.000 2.671 2580 H HA 0.436 4.992 4.556 0.001 0.000 0.372 2580 H C 0.876 176.220 175.328 0.027 0.000 1.227 2580 H CA 0.702 56.792 56.048 0.070 0.000 1.426 2580 H CB 0.968 30.781 29.762 0.085 0.000 1.480 2580 H HN 0.380 nan 8.280 nan 0.000 0.611 2581 Q N -0.001 119.892 119.800 0.156 0.000 2.164 2581 Q HA 0.204 4.544 4.340 0.001 0.000 0.226 2581 Q C 0.164 176.177 176.000 0.022 0.000 0.813 2581 Q CA -0.072 55.770 55.803 0.065 0.000 0.978 2581 Q CB 1.291 30.055 28.738 0.044 0.000 1.149 2581 Q HN 0.400 nan 8.270 nan 0.000 0.489 2582 S N -0.639 115.064 115.700 0.005 0.000 3.121 2582 S HA 0.411 4.881 4.470 0.001 0.000 0.324 2582 S C -1.617 172.919 174.600 -0.106 0.000 1.192 2582 S CA -0.647 57.521 58.200 -0.054 0.000 0.937 2582 S CB 0.437 63.602 63.200 -0.059 0.000 1.336 2582 S HN 0.221 nan 8.310 nan 0.000 0.664 2583 L N 3.058 124.185 121.223 -0.159 0.000 2.418 2583 L HA 0.328 4.668 4.340 0.001 0.000 0.274 2583 L C -0.516 176.215 176.870 -0.231 0.000 1.135 2583 L CA 0.330 55.034 54.840 -0.227 0.000 0.870 2583 L CB 0.779 42.633 42.059 -0.342 0.000 1.154 2583 L HN 0.718 nan 8.230 nan 0.000 0.462 2584 T N 3.894 118.323 114.554 -0.209 0.000 2.743 2584 T HA 0.070 4.420 4.350 0.001 0.000 0.290 2584 T C 1.378 176.005 174.700 -0.122 0.000 0.908 2584 T CA 0.078 62.055 62.100 -0.205 0.000 1.092 2584 T CB 0.710 69.495 68.868 -0.137 0.000 0.882 2584 T HN 0.869 nan 8.240 nan 0.000 0.531 2585 S N 3.199 118.832 115.700 -0.112 0.000 2.336 2585 S HA 0.177 4.647 4.470 0.001 0.000 0.216 2585 S C 1.185 175.804 174.600 0.031 0.000 1.032 2585 S CA 0.098 58.270 58.200 -0.046 0.000 0.973 2585 S CB -0.125 63.051 63.200 -0.040 0.000 0.888 2585 S HN 0.726 nan 8.310 nan 0.000 0.455 2586 G N 0.435 109.255 108.800 0.033 0.000 2.533 2586 G HA2 0.735 4.696 3.960 0.001 0.000 0.304 2586 G HA3 0.735 4.696 3.960 0.001 0.000 0.304 2586 G C -1.218 173.734 174.900 0.086 0.000 1.263 2586 G CA -1.028 44.118 45.100 0.076 0.000 0.964 2586 G HN 0.291 nan 8.290 nan 0.000 0.479 2587 M N 0.536 120.205 119.600 0.115 0.000 2.531 2587 M HA 0.476 4.957 4.480 0.001 0.000 0.286 2587 M C -1.483 174.923 176.300 0.177 0.000 1.232 2587 M CA -0.886 54.497 55.300 0.139 0.000 0.877 2587 M CB 3.110 35.784 32.600 0.124 0.000 1.726 2587 M HN 0.285 nan 8.290 nan 0.000 0.463 2588 E N 2.345 122.687 120.200 0.236 0.000 2.275 2588 E HA 0.570 4.920 4.350 0.001 0.000 0.270 2588 E C -1.896 174.937 176.600 0.387 0.000 0.882 2588 E CA -0.720 55.876 56.400 0.328 0.000 0.758 2588 E CB 3.198 33.191 29.700 0.489 0.000 1.195 2588 E HN 0.518 nan 8.360 nan 0.000 0.419 2589 L N 2.631 124.031 121.223 0.296 0.000 2.333 2589 L HA 0.494 4.834 4.340 0.001 0.000 0.280 2589 L C -1.203 175.807 176.870 0.233 0.000 1.004 2589 L CA -0.181 54.821 54.840 0.270 0.000 0.820 2589 L CB 0.887 43.061 42.059 0.191 0.000 1.247 2589 L HN 0.340 nan 8.230 nan 0.000 0.416 2590 K N 4.594 125.164 120.400 0.284 0.000 2.581 2590 K HA 0.315 4.636 4.320 0.001 0.000 0.249 2590 K C -1.021 175.671 176.600 0.154 0.000 0.966 2590 K CA -0.736 55.638 56.287 0.145 0.000 0.811 2590 K CB 1.516 34.010 32.500 -0.009 0.000 1.223 2590 K HN 0.606 nan 8.250 nan 0.000 0.438 2591 D N 2.835 123.293 120.400 0.097 0.000 2.772 2591 D HA -0.184 4.456 4.640 0.001 0.000 0.233 2591 D C -0.450 175.907 176.300 0.095 0.000 1.143 2591 D CA 0.898 54.949 54.000 0.086 0.000 0.700 2591 D CB -0.704 40.139 40.800 0.073 0.000 1.076 2591 D HN 0.905 nan 8.370 nan 0.000 0.430 2592 N N -1.518 117.243 118.700 0.101 0.000 2.800 2592 N HA -0.237 4.503 4.740 0.001 0.000 0.250 2592 N C 0.069 175.617 175.510 0.063 0.000 1.078 2592 N CA 1.131 54.217 53.050 0.060 0.000 0.804 2592 N CB -1.204 37.305 38.487 0.037 0.000 1.135 2592 N HN 0.542 nan 8.380 nan 0.000 0.565 2593 I N 1.083 121.726 120.570 0.121 0.000 2.378 2593 I HA 0.362 4.533 4.170 0.001 0.000 0.291 2593 I C -0.085 176.115 176.117 0.138 0.000 0.992 2593 I CA -0.783 60.583 61.300 0.111 0.000 1.154 2593 I CB 1.688 39.770 38.000 0.136 0.000 1.315 2593 I HN -0.041 nan 8.210 nan 0.000 0.448 2594 L N 8.163 129.444 121.223 0.097 0.000 2.346 2594 L HA 0.716 5.057 4.340 0.001 0.000 0.274 2594 L C -1.191 175.732 176.870 0.089 0.000 1.007 2594 L CA -0.413 54.504 54.840 0.128 0.000 0.818 2594 L CB 1.893 44.029 42.059 0.128 0.000 1.284 2594 L HN 0.289 nan 8.230 nan 0.000 0.424 2595 V N 3.290 123.201 119.914 -0.005 0.000 2.531 2595 V HA 0.648 4.769 4.120 0.001 0.000 0.301 2595 V C -0.572 175.592 176.094 0.118 0.000 1.034 2595 V CA -0.417 61.834 62.300 -0.081 0.000 0.865 2595 V CB 1.792 33.347 31.823 -0.446 0.000 0.995 2595 V HN 0.878 nan 8.190 nan 0.000 0.424 2596 S N 2.715 118.555 115.700 0.233 0.000 2.473 2596 S HA 0.833 5.304 4.470 0.001 0.000 0.307 2596 S C -0.023 174.661 174.600 0.140 0.000 1.094 2596 S CA -0.519 57.831 58.200 0.249 0.000 1.070 2596 S CB 1.853 65.337 63.200 0.473 0.000 1.019 2596 S HN 1.082 nan 8.310 nan 0.000 0.480 2597 G N 1.833 110.651 108.800 0.030 0.000 2.348 2597 G HA2 0.497 4.457 3.960 0.001 0.000 0.312 2597 G HA3 0.497 4.457 3.960 0.001 0.000 0.312 2597 G C -0.757 174.047 174.900 -0.160 0.000 1.126 2597 G CA -0.620 44.462 45.100 -0.031 0.000 0.865 2597 G HN 0.710 nan 8.290 nan 0.000 0.474 2598 N N 0.780 119.358 118.700 -0.203 0.000 2.262 2598 N HA 0.389 5.129 4.740 0.001 0.000 0.295 2598 N C 0.977 176.397 175.510 -0.149 0.000 1.161 2598 N CA -0.184 52.688 53.050 -0.296 0.000 0.767 2598 N CB 2.353 40.468 38.487 -0.620 0.000 1.499 2598 N HN 0.347 nan 8.380 nan 0.000 0.476 2599 A N 1.103 123.837 122.820 -0.143 0.000 2.121 2599 A HA -0.157 4.163 4.320 0.001 0.000 0.218 2599 A C 1.081 178.634 177.584 -0.053 0.000 1.154 2599 A CA 1.650 53.631 52.037 -0.093 0.000 0.679 2599 A CB -0.472 18.463 19.000 -0.109 0.000 0.795 2599 A HN 0.799 nan 8.150 nan 0.000 0.458 2600 D N -0.721 119.655 120.400 -0.041 0.000 2.378 2600 D HA -0.058 4.583 4.640 0.001 0.000 0.227 2600 D C 0.892 177.209 176.300 0.029 0.000 1.012 2600 D CA 1.200 55.205 54.000 0.007 0.000 0.905 2600 D CB -0.620 40.210 40.800 0.050 0.000 0.895 2600 D HN 0.812 nan 8.370 nan 0.000 0.532 2601 S N -3.737 111.975 115.700 0.021 0.000 3.018 2601 S HA -0.219 4.251 4.470 0.001 0.000 0.274 2601 S C 0.350 175.014 174.600 0.107 0.000 1.300 2601 S CA 1.105 59.343 58.200 0.064 0.000 1.179 2601 S CB -2.748 60.501 63.200 0.082 0.000 1.427 2601 S HN 0.430 nan 8.310 nan 0.000 0.668 2602 T N 1.051 115.653 114.554 0.081 0.000 2.944 2602 T HA 0.730 5.081 4.350 0.001 0.000 0.284 2602 T C -0.543 174.205 174.700 0.081 0.000 1.010 2602 T CA 0.055 62.199 62.100 0.073 0.000 1.025 2602 T CB 1.673 70.598 68.868 0.094 0.000 1.079 2602 T HN 0.694 nan 8.240 nan 0.000 0.516 2603 V N 3.033 122.925 119.914 -0.036 0.000 2.760 2603 V HA 0.543 4.664 4.120 0.001 0.000 0.309 2603 V C -0.607 175.381 176.094 -0.177 0.000 1.077 2603 V CA -0.861 61.405 62.300 -0.058 0.000 0.910 2603 V CB 2.168 33.865 31.823 -0.211 0.000 1.008 2603 V HN 0.758 nan 8.190 nan 0.000 0.424 2604 K N 4.272 124.602 120.400 -0.117 0.000 2.328 2604 K HA 0.749 5.069 4.320 0.001 0.000 0.246 2604 K C -1.415 174.863 176.600 -0.536 0.000 0.955 2604 K CA -0.730 55.261 56.287 -0.494 0.000 0.817 2604 K CB 2.883 34.853 32.500 -0.882 0.000 1.208 2604 K HN 0.493 nan 8.250 nan 0.000 0.432 2605 I N 1.863 122.001 120.570 -0.720 0.000 2.406 2605 I HA 0.423 4.593 4.170 0.001 0.000 0.290 2605 I C -1.241 174.553 176.117 -0.538 0.000 0.999 2605 I CA -0.765 60.242 61.300 -0.488 0.000 1.124 2605 I CB 0.958 38.740 38.000 -0.365 0.000 1.289 2605 I HN 0.467 nan 8.210 nan 0.000 0.441 2606 W N 3.875 125.074 121.300 -0.168 0.000 2.882 2606 W HA 0.399 5.059 4.660 0.001 0.000 0.345 2606 W C -0.420 176.018 176.519 -0.135 0.000 1.125 2606 W CA -0.685 56.571 57.345 -0.148 0.000 1.167 2606 W CB 0.731 30.108 29.460 -0.139 0.000 1.431 2606 W HN 0.260 nan 8.180 nan 0.000 0.543 2607 D N 2.679 123.145 120.400 0.108 0.000 2.443 2607 D HA 0.148 4.788 4.640 0.001 0.000 0.221 2607 D C 0.936 177.207 176.300 -0.048 0.000 1.097 2607 D CA -0.355 53.653 54.000 0.014 0.000 0.865 2607 D CB 0.773 41.562 40.800 -0.019 0.000 1.034 2607 D HN 0.555 nan 8.370 nan 0.000 0.511 2608 I N 0.605 121.138 120.570 -0.060 0.000 3.334 2608 I HA -0.028 4.143 4.170 0.001 0.000 0.282 2608 I C 1.556 177.592 176.117 -0.134 0.000 1.313 2608 I CA 0.319 61.531 61.300 -0.147 0.000 1.396 2608 I CB 0.145 38.052 38.000 -0.156 0.000 1.054 2608 I HN 0.038 nan 8.210 nan 0.000 0.495 2609 K N 1.281 121.633 120.400 -0.079 0.000 2.067 2609 K HA -0.024 4.297 4.320 0.001 0.000 0.203 2609 K C 2.174 178.836 176.600 0.103 0.000 1.048 2609 K CA 1.791 58.095 56.287 0.028 0.000 0.954 2609 K CB 0.021 32.536 32.500 0.026 0.000 0.737 2609 K HN 0.563 nan 8.250 nan 0.000 0.444 2610 T N -3.691 110.835 114.554 -0.046 0.000 3.037 2610 T HA 0.173 4.523 4.350 0.001 0.000 0.251 2610 T C 1.392 175.920 174.700 -0.288 0.000 1.079 2610 T CA 0.677 62.743 62.100 -0.057 0.000 1.067 2610 T CB 0.678 69.526 68.868 -0.034 0.000 0.948 2610 T HN 0.340 nan 8.240 nan 0.000 0.496 2611 G N 1.121 109.582 108.800 -0.564 0.000 2.199 2611 G HA2 -0.293 3.668 3.960 0.001 0.000 0.254 2611 G HA3 -0.293 3.668 3.960 0.001 0.000 0.254 2611 G C -0.052 174.761 174.900 -0.145 0.000 0.982 2611 G CA 0.235 44.950 45.100 -0.641 0.000 0.632 2611 G HN 0.923 nan 8.290 nan 0.000 0.529 2612 Q N 0.227 119.979 119.800 -0.080 0.000 2.337 2612 Q HA 0.362 4.703 4.340 0.001 0.000 0.270 2612 Q C 0.599 176.616 176.000 0.029 0.000 1.002 2612 Q CA 0.073 55.865 55.803 -0.017 0.000 0.888 2612 Q CB 0.528 29.241 28.738 -0.042 0.000 1.222 2612 Q HN 0.627 nan 8.270 nan 0.000 0.400 2613 C N 7.139 126.412 119.300 -0.045 0.000 2.252 2613 C HA 0.274 4.735 4.460 0.001 0.000 0.342 2613 C C 1.489 176.294 174.990 -0.307 0.000 1.110 2613 C CA -0.647 58.178 59.018 -0.322 0.000 1.581 2613 C CB -1.709 25.721 27.740 -0.517 0.000 2.087 2613 C HN 1.081 nan 8.230 nan 0.000 0.500 2614 L N 3.363 124.422 121.223 -0.272 0.000 2.046 2614 L HA -0.044 4.296 4.340 0.001 0.000 0.208 2614 L C 1.241 177.968 176.870 -0.238 0.000 1.077 2614 L CA 1.397 56.113 54.840 -0.207 0.000 0.747 2614 L CB -0.387 41.575 42.059 -0.161 0.000 0.896 2614 L HN 0.674 nan 8.230 nan 0.000 0.432 2615 Q N -1.368 118.229 119.800 -0.340 0.000 2.472 2615 Q HA 0.370 4.710 4.340 0.001 0.000 0.281 2615 Q C -1.198 174.561 176.000 -0.402 0.000 0.997 2615 Q CA -0.275 55.348 55.803 -0.300 0.000 0.828 2615 Q CB 2.399 31.000 28.738 -0.228 0.000 1.443 2615 Q HN -0.140 nan 8.270 nan 0.000 0.390 2616 T N 1.671 116.029 114.554 -0.327 0.000 2.809 2616 T HA 0.493 4.843 4.350 0.001 0.000 0.284 2616 T C -0.058 174.456 174.700 -0.311 0.000 0.992 2616 T CA -0.524 61.368 62.100 -0.346 0.000 0.957 2616 T CB 0.469 69.165 68.868 -0.287 0.000 0.942 2616 T HN 0.262 nan 8.240 nan 0.000 0.439 2617 L N 5.404 126.354 121.223 -0.455 0.000 2.312 2617 L HA 0.390 4.730 4.340 0.001 0.000 0.287 2617 L C 0.872 177.438 176.870 -0.507 0.000 1.091 2617 L CA -0.108 54.270 54.840 -0.770 0.000 0.846 2617 L CB -0.252 40.850 42.059 -1.595 0.000 1.219 2617 L HN 0.776 nan 8.230 nan 0.000 0.439 2618 Q N 2.874 122.609 119.800 -0.109 0.000 2.634 2618 Q HA 0.785 5.125 4.340 0.001 0.000 0.417 2618 Q C 0.125 176.229 176.000 0.174 0.000 0.592 2618 Q CA -0.451 55.392 55.803 0.067 0.000 0.952 2618 Q CB 1.347 30.079 28.738 -0.010 0.000 1.171 2618 Q HN 0.461 nan 8.270 nan 0.000 0.369 2619 G N 0.344 109.186 108.800 0.069 0.000 2.685 2619 G HA2 -0.148 3.812 3.960 0.001 0.000 0.387 2619 G HA3 -0.148 3.812 3.960 0.001 0.000 0.387 2619 G C -2.305 172.580 174.900 -0.025 0.000 1.324 2619 G CA -0.323 44.801 45.100 0.041 0.000 0.878 2619 G HN 0.451 nan 8.290 nan 0.000 0.527 2620 P HA -0.059 nan 4.420 nan 0.000 0.217 2620 P C 1.104 178.279 177.300 -0.208 0.000 1.148 2620 P CA 1.584 64.624 63.100 -0.101 0.000 0.828 2620 P CB 0.019 31.672 31.700 -0.078 0.000 0.783 2621 N N -0.523 117.953 118.700 -0.374 0.000 2.279 2621 N HA 0.046 4.786 4.740 0.001 0.000 0.226 2621 N C 0.393 175.509 175.510 -0.657 0.000 1.126 2621 N CA -0.005 52.593 53.050 -0.753 0.000 0.846 2621 N CB 0.236 37.699 38.487 -1.706 0.000 1.050 2621 N HN 0.418 nan 8.380 nan 0.000 0.502 2622 K N 0.072 120.338 120.400 -0.224 0.000 2.156 2622 K HA 0.113 4.434 4.320 0.001 0.000 0.242 2622 K C 0.038 176.592 176.600 -0.076 0.000 1.033 2622 K CA -0.131 56.161 56.287 0.010 0.000 0.878 2622 K CB 0.562 33.110 32.500 0.080 0.000 1.057 2622 K HN 0.032 nan 8.250 nan 0.000 0.505 2623 H N 0.936 120.089 119.070 0.138 0.000 2.707 2623 H HA -0.005 4.551 4.556 0.001 0.000 0.359 2623 H C 0.714 176.061 175.328 0.033 0.000 1.113 2623 H CA 0.086 56.185 56.048 0.084 0.000 1.422 2623 H CB 1.295 31.125 29.762 0.114 0.000 1.443 2623 H HN 0.594 nan 8.280 nan 0.000 0.591 2624 Q N 1.105 120.995 119.800 0.150 0.000 2.425 2624 Q HA 0.084 4.424 4.340 0.001 0.000 0.204 2624 Q C 0.143 176.181 176.000 0.064 0.000 0.933 2624 Q CA 0.188 56.033 55.803 0.071 0.000 0.939 2624 Q CB 0.542 29.302 28.738 0.037 0.000 1.044 2624 Q HN 0.614 nan 8.270 nan 0.000 0.513 2625 S N -1.407 114.342 115.700 0.082 0.000 2.752 2625 S HA 0.701 5.172 4.470 0.001 0.000 0.284 2625 S C -0.704 173.901 174.600 0.010 0.000 1.189 2625 S CA -0.712 57.509 58.200 0.035 0.000 0.835 2625 S CB 0.849 64.058 63.200 0.014 0.000 1.192 2625 S HN 0.158 nan 8.310 nan 0.000 0.506 2626 A N 0.604 123.415 122.820 -0.016 0.000 2.603 2626 A HA 0.404 4.724 4.320 0.001 0.000 0.235 2626 A C 0.107 177.634 177.584 -0.094 0.000 1.035 2626 A CA -0.044 51.967 52.037 -0.044 0.000 0.755 2626 A CB -0.555 18.421 19.000 -0.039 0.000 0.954 2626 A HN 0.928 nan 8.150 nan 0.000 0.511 2627 V N 3.465 123.312 119.914 -0.111 0.000 2.461 2627 V HA 0.233 4.354 4.120 0.001 0.000 0.275 2627 V C 1.608 177.654 176.094 -0.081 0.000 1.047 2627 V CA 0.687 62.886 62.300 -0.167 0.000 0.955 2627 V CB 1.010 32.768 31.823 -0.109 0.000 0.988 2627 V HN 1.173 nan 8.190 nan 0.000 0.471 2628 T N 0.111 114.631 114.554 -0.057 0.000 3.037 2628 T HA 0.173 4.524 4.350 0.001 0.000 0.252 2628 T C 0.406 175.141 174.700 0.059 0.000 1.073 2628 T CA 0.121 62.235 62.100 0.023 0.000 1.091 2628 T CB 0.164 69.073 68.868 0.068 0.000 0.935 2628 T HN 0.589 nan 8.240 nan 0.000 0.488 2629 C N 0.706 120.039 119.300 0.055 0.000 3.275 2629 C HA 0.763 5.223 4.460 0.001 0.000 0.340 2629 C C -2.249 172.809 174.990 0.113 0.000 1.366 2629 C CA -1.180 57.895 59.018 0.095 0.000 1.227 2629 C CB 1.015 28.826 27.740 0.119 0.000 1.512 2629 C HN 0.873 nan 8.230 nan 0.000 0.461 2630 L N 1.508 122.817 121.223 0.143 0.000 2.710 2630 L HA 0.824 5.165 4.340 0.001 0.000 0.260 2630 L C -1.402 175.594 176.870 0.209 0.000 0.993 2630 L CA -0.285 54.662 54.840 0.178 0.000 0.877 2630 L CB 1.696 43.849 42.059 0.157 0.000 1.461 2630 L HN 0.628 nan 8.230 nan 0.000 0.413 2631 Q N 1.613 121.555 119.800 0.237 0.000 2.416 2631 Q HA 0.759 5.100 4.340 0.001 0.000 0.281 2631 Q C -1.565 174.625 176.000 0.318 0.000 1.067 2631 Q CA -0.332 55.609 55.803 0.231 0.000 0.809 2631 Q CB 3.264 32.096 28.738 0.156 0.000 1.418 2631 Q HN 0.823 nan 8.270 nan 0.000 0.411 2632 F N -0.578 119.399 119.950 0.045 0.000 2.741 2632 F HA 0.748 5.275 4.527 0.000 0.000 0.313 2632 F C -1.294 174.502 175.800 -0.007 0.000 1.153 2632 F CA -0.847 57.169 58.000 0.027 0.000 0.931 2632 F CB 1.295 40.318 39.000 0.038 0.000 1.335 2632 F HN 0.637 nan 8.300 nan 0.000 0.460 2633 N N -0.601 118.099 118.700 -0.001 0.000 3.418 2633 N HA 0.278 5.018 4.740 0.001 0.000 0.316 2633 N C -0.456 175.053 175.510 -0.003 0.000 1.601 2633 N CA -0.554 52.402 53.050 -0.156 0.000 0.805 2633 N CB 0.675 39.065 38.487 -0.163 0.000 1.873 2633 N HN 0.700 nan 8.380 nan 0.000 0.615 2634 K N -1.224 119.124 120.400 -0.086 0.000 2.362 2634 K HA 0.119 4.439 4.320 0.001 0.000 0.200 2634 K C 0.306 176.813 176.600 -0.154 0.000 1.046 2634 K CA 1.187 57.434 56.287 -0.066 0.000 0.952 2634 K CB -0.234 32.217 32.500 -0.083 0.000 0.753 2634 K HN 0.344 nan 8.250 nan 0.000 0.466 2635 N N -0.360 118.134 118.700 -0.344 0.000 2.545 2635 N HA 0.161 4.902 4.740 0.001 0.000 0.190 2635 N C -0.149 174.990 175.510 -0.618 0.000 1.043 2635 N CA 0.500 53.148 53.050 -0.671 0.000 0.879 2635 N CB 0.358 38.030 38.487 -1.357 0.000 1.210 2635 N HN 0.097 nan 8.380 nan 0.000 0.437 2636 F N -0.025 119.897 119.950 -0.048 0.000 2.631 2636 F HA 0.620 5.147 4.527 0.000 0.000 0.328 2636 F C -0.159 175.690 175.800 0.082 0.000 1.067 2636 F CA -1.233 56.758 58.000 -0.015 0.000 0.969 2636 F CB 1.486 40.406 39.000 -0.134 0.000 1.332 2636 F HN -0.435 nan 8.300 nan 0.000 0.490 2637 V N 2.394 122.535 119.914 0.379 0.000 2.540 2637 V HA 0.481 4.601 4.120 0.001 0.000 0.302 2637 V C -0.503 175.817 176.094 0.377 0.000 1.035 2637 V CA -0.711 61.780 62.300 0.320 0.000 0.873 2637 V CB 1.964 33.882 31.823 0.159 0.000 0.992 2637 V HN 0.523 nan 8.190 nan 0.000 0.428 2638 I N 4.364 125.113 120.570 0.299 0.000 2.378 2638 I HA 0.604 4.774 4.170 0.001 0.000 0.291 2638 I C 0.076 176.389 176.117 0.326 0.000 0.992 2638 I CA -0.226 61.246 61.300 0.287 0.000 1.154 2638 I CB 2.138 40.248 38.000 0.183 0.000 1.315 2638 I HN 0.752 nan 8.210 nan 0.000 0.448 2639 T N 1.604 116.416 114.554 0.430 0.000 2.876 2639 T HA 0.717 5.068 4.350 0.001 0.000 0.289 2639 T C -0.334 174.584 174.700 0.363 0.000 1.014 2639 T CA -0.766 61.582 62.100 0.413 0.000 0.986 2639 T CB 1.815 71.049 68.868 0.610 0.000 1.021 2639 T HN 0.566 nan 8.240 nan 0.000 0.458 2640 S N 1.401 117.191 115.700 0.151 0.000 2.607 2640 S HA 0.895 5.365 4.470 0.001 0.000 0.303 2640 S C -0.421 174.074 174.600 -0.175 0.000 1.086 2640 S CA -0.771 57.463 58.200 0.057 0.000 0.995 2640 S CB 1.806 65.051 63.200 0.075 0.000 1.084 2640 S HN 1.215 nan 8.310 nan 0.000 0.507 2641 S N -0.577 115.030 115.700 -0.155 0.000 2.615 2641 S HA 0.386 4.856 4.470 0.001 0.000 0.269 2641 S C -0.626 173.921 174.600 -0.089 0.000 1.161 2641 S CA -0.611 57.462 58.200 -0.213 0.000 0.817 2641 S CB 1.300 64.239 63.200 -0.436 0.000 1.131 2641 S HN 0.680 nan 8.310 nan 0.000 0.467 2642 D N 1.384 121.743 120.400 -0.067 0.000 2.350 2642 D HA -0.035 4.605 4.640 0.001 0.000 0.216 2642 D C 0.934 177.212 176.300 -0.037 0.000 0.968 2642 D CA 1.011 54.980 54.000 -0.053 0.000 0.894 2642 D CB -0.193 40.595 40.800 -0.020 0.000 0.909 2642 D HN 0.736 nan 8.370 nan 0.000 0.520 2643 D N -0.465 119.935 120.400 0.000 0.000 2.363 2643 D HA 0.033 4.674 4.640 0.001 0.000 0.226 2643 D C 1.474 177.783 176.300 0.015 0.000 1.020 2643 D CA 0.679 54.696 54.000 0.028 0.000 0.892 2643 D CB -0.434 40.420 40.800 0.090 0.000 0.900 2643 D HN 0.131 nan 8.370 nan 0.000 0.531 2644 G N -0.126 108.664 108.800 -0.016 0.000 2.143 2644 G HA2 -0.241 3.720 3.960 0.001 0.000 0.248 2644 G HA3 -0.241 3.720 3.960 0.001 0.000 0.248 2644 G C 0.344 175.248 174.900 0.008 0.000 0.991 2644 G CA 0.703 45.781 45.100 -0.036 0.000 0.689 2644 G HN 0.891 nan 8.290 nan 0.000 0.522 2645 T N -3.014 111.585 114.554 0.076 0.000 2.924 2645 T HA 0.758 5.108 4.350 0.001 0.000 0.291 2645 T C -0.575 174.239 174.700 0.189 0.000 1.045 2645 T CA -0.553 61.618 62.100 0.118 0.000 1.015 2645 T CB 3.086 72.036 68.868 0.137 0.000 1.103 2645 T HN 0.846 nan 8.240 nan 0.000 0.496 2646 V N 2.211 122.226 119.914 0.168 0.000 2.444 2646 V HA 0.522 4.642 4.120 0.001 0.000 0.294 2646 V C -0.262 175.946 176.094 0.191 0.000 1.022 2646 V CA -0.835 61.589 62.300 0.206 0.000 0.850 2646 V CB 1.603 33.517 31.823 0.150 0.000 0.992 2646 V HN 0.905 nan 8.190 nan 0.000 0.426 2647 K N 4.305 124.856 120.400 0.252 0.000 2.208 2647 K HA 0.665 4.985 4.320 0.001 0.000 0.247 2647 K C -1.223 175.371 176.600 -0.010 0.000 0.953 2647 K CA -0.778 55.550 56.287 0.067 0.000 0.837 2647 K CB 2.521 34.998 32.500 -0.040 0.000 1.131 2647 K HN 0.393 nan 8.250 nan 0.000 0.431 2648 L N 2.713 123.761 121.223 -0.292 0.000 2.322 2648 L HA 0.498 4.838 4.340 0.001 0.000 0.281 2648 L C -1.640 174.978 176.870 -0.419 0.000 1.014 2648 L CA -0.501 54.187 54.840 -0.253 0.000 0.815 2648 L CB 0.792 42.644 42.059 -0.344 0.000 1.247 2648 L HN 0.688 nan 8.230 nan 0.000 0.421 2649 W N 2.500 123.800 121.300 -0.001 0.000 2.882 2649 W HA 0.341 5.001 4.660 0.001 0.000 0.345 2649 W C -0.266 176.336 176.519 0.138 0.000 1.125 2649 W CA -0.599 56.778 57.345 0.052 0.000 1.167 2649 W CB 0.857 30.370 29.460 0.088 0.000 1.431 2649 W HN 0.351 nan 8.180 nan 0.000 0.543 2650 D N 2.110 122.726 120.400 0.359 0.000 2.347 2650 D HA 0.062 4.703 4.640 0.001 0.000 0.235 2650 D C 0.685 177.084 176.300 0.164 0.000 1.149 2650 D CA -0.096 54.051 54.000 0.245 0.000 0.850 2650 D CB 1.546 42.439 40.800 0.154 0.000 1.061 2650 D HN 0.531 nan 8.370 nan 0.000 0.487 2651 L N 5.030 126.312 121.223 0.099 0.000 2.046 2651 L HA -0.145 4.196 4.340 0.001 0.000 0.208 2651 L C 2.054 178.916 176.870 -0.014 0.000 1.077 2651 L CA 1.454 56.310 54.840 0.027 0.000 0.747 2651 L CB 0.052 42.123 42.059 0.020 0.000 0.896 2651 L HN 0.310 nan 8.230 nan 0.000 0.432 2652 K N -1.207 119.182 120.400 -0.019 0.000 2.155 2652 K HA -0.083 4.237 4.320 0.001 0.000 0.203 2652 K C 1.746 178.339 176.600 -0.013 0.000 1.052 2652 K CA 1.700 57.972 56.287 -0.025 0.000 0.948 2652 K CB -0.115 32.367 32.500 -0.031 0.000 0.728 2652 K HN 0.560 nan 8.250 nan 0.000 0.448 2653 T N -4.135 110.426 114.554 0.013 0.000 3.001 2653 T HA 0.213 4.563 4.350 0.001 0.000 0.251 2653 T C 1.420 176.139 174.700 0.032 0.000 1.040 2653 T CA 0.367 62.479 62.100 0.021 0.000 0.985 2653 T CB 0.743 69.634 68.868 0.038 0.000 1.011 2653 T HN 0.270 nan 8.240 nan 0.000 0.509 2654 G N 1.328 110.158 108.800 0.049 0.000 2.162 2654 G HA2 -0.244 3.716 3.960 0.001 0.000 0.260 2654 G HA3 -0.244 3.716 3.960 0.001 0.000 0.260 2654 G C -0.212 174.808 174.900 0.200 0.000 0.976 2654 G CA 0.278 45.410 45.100 0.053 0.000 0.655 2654 G HN 0.673 nan 8.290 nan 0.000 0.533 2655 E N -0.715 119.620 120.200 0.226 0.000 2.319 2655 E HA 0.530 4.880 4.350 0.001 0.000 0.268 2655 E C 0.065 176.906 176.600 0.400 0.000 1.050 2655 E CA -0.970 55.600 56.400 0.283 0.000 0.878 2655 E CB 0.933 30.726 29.700 0.155 0.000 1.066 2655 E HN 0.283 nan 8.360 nan 0.000 0.406 2656 F N 2.587 122.625 119.950 0.148 0.000 2.484 2656 F HA 0.145 4.672 4.527 0.000 0.000 0.360 2656 F C 0.377 176.050 175.800 -0.211 0.000 1.101 2656 F CA 0.137 57.955 58.000 -0.302 0.000 1.251 2656 F CB 0.420 39.124 39.000 -0.493 0.000 1.132 2656 F HN 0.425 nan 8.300 nan 0.000 0.570 2657 I N 3.769 123.697 120.570 -1.070 0.000 2.962 2657 I HA 0.158 4.328 4.170 0.001 0.000 0.246 2657 I C 0.202 175.579 176.117 -1.233 0.000 1.091 2657 I CA -0.090 60.727 61.300 -0.804 0.000 1.469 2657 I CB 0.099 37.833 38.000 -0.444 0.000 1.324 2657 I HN 0.634 nan 8.210 nan 0.000 0.461 2658 R N 0.415 120.027 120.500 -1.479 0.000 2.741 2658 R HA 0.313 4.653 4.340 0.001 0.000 0.274 2658 R C -1.747 174.249 176.300 -0.507 0.000 1.029 2658 R CA -0.739 54.798 56.100 -0.938 0.000 0.880 2658 R CB 0.783 30.840 30.300 -0.405 0.000 1.264 2658 R HN -0.060 nan 8.270 nan 0.000 0.465 2659 N N 0.906 119.568 118.700 -0.062 0.000 2.439 2659 N HA 0.148 4.889 4.740 0.001 0.000 0.249 2659 N C 0.347 175.855 175.510 -0.004 0.000 1.003 2659 N CA -0.534 52.541 53.050 0.042 0.000 0.942 2659 N CB 1.108 39.651 38.487 0.093 0.000 1.115 2659 N HN 0.325 nan 8.380 nan 0.000 0.505 2660 L N 2.453 123.683 121.223 0.011 0.000 2.156 2660 L HA 0.110 4.451 4.340 0.001 0.000 0.208 2660 L C 0.314 177.214 176.870 0.049 0.000 1.095 2660 L CA 0.988 55.861 54.840 0.055 0.000 0.770 2660 L CB -0.148 41.985 42.059 0.123 0.000 0.914 2660 L HN 0.324 nan 8.230 nan 0.000 0.439 2661 V N -1.320 118.623 119.914 0.047 0.000 2.760 2661 V HA 0.476 4.596 4.120 0.001 0.000 0.309 2661 V C -0.532 175.575 176.094 0.023 0.000 1.077 2661 V CA -0.571 61.743 62.300 0.024 0.000 0.910 2661 V CB 2.163 34.001 31.823 0.026 0.000 1.008 2661 V HN 0.080 nan 8.190 nan 0.000 0.424 2662 T N 5.188 119.743 114.554 0.001 0.000 3.135 2662 T HA 0.347 4.697 4.350 0.001 0.000 0.357 2662 T C -0.615 174.074 174.700 -0.019 0.000 1.112 2662 T CA -0.417 61.682 62.100 -0.001 0.000 1.290 2662 T CB 0.520 69.387 68.868 -0.001 0.000 1.018 2662 T HN 0.234 nan 8.240 nan 0.000 0.527 2663 L N 3.096 124.302 121.223 -0.028 0.000 2.540 2663 L HA 0.161 4.502 4.340 0.001 0.000 0.276 2663 L C 1.776 178.623 176.870 -0.038 0.000 1.212 2663 L CA 0.569 55.382 54.840 -0.045 0.000 0.893 2663 L CB 0.092 42.111 42.059 -0.068 0.000 1.138 2663 L HN 0.601 nan 8.230 nan 0.000 0.491 2664 E N 1.117 121.294 120.200 -0.039 0.000 2.150 2664 E HA -0.155 4.195 4.350 0.001 0.000 0.193 2664 E C 1.411 177.991 176.600 -0.034 0.000 0.985 2664 E CA 1.359 57.740 56.400 -0.032 0.000 0.814 2664 E CB 0.070 29.751 29.700 -0.031 0.000 0.752 2664 E HN 0.788 nan 8.360 nan 0.000 0.466 2665 S N 0.224 115.898 115.700 -0.042 0.000 2.650 2665 S HA 0.093 4.564 4.470 0.001 0.000 0.219 2665 S C 1.859 176.430 174.600 -0.048 0.000 0.960 2665 S CA 0.192 58.366 58.200 -0.043 0.000 0.925 2665 S CB 0.152 63.321 63.200 -0.052 0.000 0.775 2665 S HN 0.276 nan 8.310 nan 0.000 0.525 2666 G N 2.331 111.104 108.800 -0.045 0.000 2.513 2666 G HA2 -0.099 3.861 3.960 0.001 0.000 0.219 2666 G HA3 -0.099 3.861 3.960 0.001 0.000 0.219 2666 G C 1.277 176.158 174.900 -0.032 0.000 1.160 2666 G CA 0.634 45.709 45.100 -0.042 0.000 0.767 2666 G HN 0.676 nan 8.290 nan 0.000 0.571 2667 G N -0.390 108.396 108.800 -0.024 0.000 2.920 2667 G HA2 0.248 4.208 3.960 0.001 0.000 0.208 2667 G HA3 0.248 4.208 3.960 0.001 0.000 0.208 2667 G C 1.124 176.013 174.900 -0.017 0.000 1.159 2667 G CA 1.147 46.236 45.100 -0.017 0.000 0.784 2667 G HN 0.867 nan 8.290 nan 0.000 0.535 2668 S N -2.128 113.558 115.700 -0.022 0.000 2.902 2668 S HA 0.525 4.995 4.470 0.001 0.000 0.250 2668 S C 1.073 175.661 174.600 -0.021 0.000 1.046 2668 S CA 0.548 58.737 58.200 -0.018 0.000 1.069 2668 S CB 0.501 63.691 63.200 -0.016 0.000 0.967 2668 S HN 1.141 nan 8.310 nan 0.000 0.530 2669 G N 0.587 109.368 108.800 -0.030 0.000 2.617 2669 G HA2 -0.001 3.960 3.960 0.001 0.000 0.197 2669 G HA3 -0.001 3.960 3.960 0.001 0.000 0.197 2669 G C 0.574 175.427 174.900 -0.078 0.000 1.017 2669 G CA -0.259 44.820 45.100 -0.035 0.000 0.713 2669 G HN 1.150 nan 8.290 nan 0.000 0.481 2670 G N 0.196 108.942 108.800 -0.090 0.000 2.305 2670 G HA2 0.530 4.490 3.960 0.001 0.000 0.243 2670 G HA3 0.530 4.490 3.960 0.001 0.000 0.243 2670 G C -0.340 174.445 174.900 -0.190 0.000 1.288 2670 G CA 0.914 45.928 45.100 -0.143 0.000 0.901 2670 G HN 1.112 nan 8.290 nan 0.000 0.516 2671 V N 2.324 122.037 119.914 -0.335 0.000 3.007 2671 V HA 0.414 4.534 4.120 0.001 0.000 0.311 2671 V C -0.407 175.370 176.094 -0.529 0.000 1.120 2671 V CA -0.671 61.386 62.300 -0.406 0.000 0.980 2671 V CB 2.575 34.111 31.823 -0.480 0.000 1.033 2671 V HN 0.574 nan 8.190 nan 0.000 0.429 2672 V N 3.641 123.355 119.914 -0.334 0.000 2.313 2672 V HA 0.257 4.377 4.120 0.001 0.000 0.278 2672 V C 0.346 176.370 176.094 -0.117 0.000 1.017 2672 V CA -0.361 61.800 62.300 -0.230 0.000 0.823 2672 V CB 1.332 33.110 31.823 -0.075 0.000 1.010 2672 V HN 0.981 nan 8.190 nan 0.000 0.443 2673 W N 4.578 125.882 121.300 0.007 0.000 2.409 2673 W HA 0.102 4.763 4.660 0.001 0.000 0.299 2673 W C 1.094 177.625 176.519 0.019 0.000 1.203 2673 W CA 0.435 57.787 57.345 0.011 0.000 1.298 2673 W CB 0.106 29.568 29.460 0.004 0.000 1.127 2673 W HN 0.581 nan 8.180 nan 0.000 0.528 2674 R N -0.579 120.073 120.500 0.254 0.000 2.712 2674 R HA 0.591 4.931 4.340 0.001 0.000 0.272 2674 R C -1.015 175.367 176.300 0.137 0.000 1.032 2674 R CA -0.785 55.419 56.100 0.173 0.000 0.874 2674 R CB 1.189 31.587 30.300 0.162 0.000 1.256 2674 R HN -0.013 nan 8.270 nan 0.000 0.468 2675 I N -2.144 118.508 120.570 0.136 0.000 2.969 2675 I HA 0.707 4.877 4.170 0.001 0.000 0.307 2675 I C -1.048 175.169 176.117 0.167 0.000 1.149 2675 I CA -1.380 60.003 61.300 0.138 0.000 1.008 2675 I CB 2.685 40.778 38.000 0.156 0.000 1.232 2675 I HN 0.395 nan 8.210 nan 0.000 0.435 2676 R N 2.500 123.118 120.500 0.197 0.000 2.604 2676 R HA 0.843 5.183 4.340 0.001 0.000 0.281 2676 R C -1.492 175.047 176.300 0.397 0.000 1.020 2676 R CA -0.850 55.423 56.100 0.288 0.000 0.899 2676 R CB 2.201 32.715 30.300 0.356 0.000 1.205 2676 R HN 0.990 nan 8.270 nan 0.000 0.450 2677 A N 1.143 124.187 122.820 0.374 0.000 2.435 2677 A HA 0.720 5.040 4.320 0.001 0.000 0.304 2677 A C -0.280 177.478 177.584 0.290 0.000 1.064 2677 A CA -0.506 51.785 52.037 0.423 0.000 0.727 2677 A CB 1.583 20.773 19.000 0.317 0.000 1.284 2677 A HN 0.770 nan 8.150 nan 0.000 0.415 2678 S N 0.536 116.443 115.700 0.344 0.000 2.786 2678 S HA 0.391 4.861 4.470 0.001 0.000 0.307 2678 S C 0.835 175.586 174.600 0.251 0.000 1.121 2678 S CA 0.004 58.271 58.200 0.112 0.000 0.975 2678 S CB 0.918 64.092 63.200 -0.042 0.000 1.220 2678 S HN 0.722 nan 8.310 nan 0.000 0.550 2679 N N 0.692 119.495 118.700 0.172 0.000 2.166 2679 N HA -0.111 4.629 4.740 0.001 0.000 0.186 2679 N C 1.561 177.366 175.510 0.492 0.000 1.019 2679 N CA 2.335 55.520 53.050 0.225 0.000 0.856 2679 N CB -0.456 38.106 38.487 0.126 0.000 0.993 2679 N HN 0.830 nan 8.380 nan 0.000 0.426 2680 T N -3.766 111.035 114.554 0.413 0.000 3.023 2680 T HA 0.211 4.561 4.350 0.001 0.000 0.253 2680 T C 0.207 175.128 174.700 0.370 0.000 1.038 2680 T CA -0.331 62.008 62.100 0.397 0.000 0.962 2680 T CB 0.022 69.021 68.868 0.217 0.000 1.018 2680 T HN 0.323 nan 8.240 nan 0.000 0.521 2681 K N 0.204 120.900 120.400 0.493 0.000 2.533 2681 K HA 0.750 5.070 4.320 0.001 0.000 0.272 2681 K C -2.099 174.823 176.600 0.537 0.000 0.985 2681 K CA -1.340 55.186 56.287 0.398 0.000 0.876 2681 K CB 1.785 34.436 32.500 0.252 0.000 1.452 2681 K HN 0.032 nan 8.250 nan 0.000 0.439 2682 L N 1.091 122.514 121.223 0.333 0.000 2.381 2682 L HA 0.500 4.840 4.340 0.001 0.000 0.274 2682 L C -1.679 175.240 176.870 0.082 0.000 0.988 2682 L CA -0.572 54.467 54.840 0.333 0.000 0.824 2682 L CB 2.199 44.495 42.059 0.394 0.000 1.263 2682 L HN 0.578 nan 8.230 nan 0.000 0.410 2683 V N 4.223 124.146 119.914 0.014 0.000 2.384 2683 V HA 0.477 4.598 4.120 0.001 0.000 0.287 2683 V C -0.563 175.505 176.094 -0.043 0.000 1.020 2683 V CA -0.472 61.735 62.300 -0.154 0.000 0.850 2683 V CB 1.317 32.899 31.823 -0.402 0.000 0.987 2683 V HN 0.884 nan 8.190 nan 0.000 0.436 2684 C N 4.291 123.555 119.300 -0.060 0.000 2.345 2684 C HA 0.826 5.286 4.460 0.001 0.000 0.323 2684 C C 0.712 175.684 174.990 -0.031 0.000 1.276 2684 C CA -0.928 58.082 59.018 -0.014 0.000 1.543 2684 C CB 0.748 28.482 27.740 -0.010 0.000 2.211 2684 C HN 0.961 nan 8.230 nan 0.000 0.493 2685 A N 3.411 126.256 122.820 0.041 0.000 2.276 2685 A HA 0.726 5.046 4.320 0.001 0.000 0.300 2685 A C -0.372 177.272 177.584 0.101 0.000 1.235 2685 A CA -0.124 51.985 52.037 0.121 0.000 0.867 2685 A CB 0.328 19.466 19.000 0.230 0.000 1.137 2685 A HN 0.770 nan 8.150 nan 0.000 0.527 2686 V N 1.811 121.722 119.914 -0.004 0.000 2.914 2686 V HA 0.938 5.059 4.120 0.001 0.000 0.314 2686 V C 0.673 176.497 176.094 -0.449 0.000 1.084 2686 V CA 0.466 62.595 62.300 -0.286 0.000 0.963 2686 V CB 2.049 33.758 31.823 -0.189 0.000 1.025 2686 V HN 1.563 nan 8.190 nan 0.000 0.432 2687 G N 1.753 110.049 108.800 -0.841 0.000 2.356 2687 G HA2 0.671 4.632 3.960 0.001 0.000 0.281 2687 G HA3 0.671 4.632 3.960 0.001 0.000 0.281 2687 G C -0.956 173.634 174.900 -0.518 0.000 1.246 2687 G CA 0.259 44.995 45.100 -0.608 0.000 0.889 2687 G HN 1.554 nan 8.290 nan 0.000 0.486 2688 S N -1.851 113.760 115.700 -0.148 0.000 2.578 2688 S HA 0.545 5.016 4.470 0.001 0.000 0.272 2688 S C 0.178 174.866 174.600 0.147 0.000 1.145 2688 S CA -0.509 57.675 58.200 -0.026 0.000 0.835 2688 S CB 1.930 65.101 63.200 -0.049 0.000 1.104 2688 S HN 0.756 nan 8.310 nan 0.000 0.458 2689 R N 0.651 121.228 120.500 0.129 0.000 2.210 2689 R HA 0.104 4.445 4.340 0.001 0.000 0.203 2689 R C 0.685 177.025 176.300 0.067 0.000 1.010 2689 R CA 1.227 57.403 56.100 0.125 0.000 1.008 2689 R CB -0.252 30.116 30.300 0.112 0.000 0.923 2689 R HN 0.817 nan 8.270 nan 0.000 0.469 2690 N N -1.067 117.660 118.700 0.045 0.000 2.214 2690 N HA 0.096 4.836 4.740 0.001 0.000 0.214 2690 N C 0.766 176.287 175.510 0.019 0.000 1.132 2690 N CA 0.508 53.574 53.050 0.026 0.000 0.856 2690 N CB 1.079 39.577 38.487 0.017 0.000 1.020 2690 N HN 0.128 nan 8.380 nan 0.000 0.509 2691 G N -0.086 108.728 108.800 0.024 0.000 2.184 2691 G HA2 -0.380 3.580 3.960 0.001 0.000 0.264 2691 G HA3 -0.380 3.580 3.960 0.001 0.000 0.264 2691 G C 1.023 175.925 174.900 0.005 0.000 0.975 2691 G CA 0.952 46.062 45.100 0.018 0.000 0.642 2691 G HN 0.618 nan 8.290 nan 0.000 0.536 2692 T N -2.565 111.986 114.554 -0.006 0.000 3.035 2692 T HA 0.333 4.684 4.350 0.001 0.000 0.268 2692 T C 0.601 175.284 174.700 -0.028 0.000 1.109 2692 T CA 1.404 63.494 62.100 -0.017 0.000 1.119 2692 T CB 0.546 69.401 68.868 -0.022 0.000 0.900 2692 T HN 0.338 nan 8.240 nan 0.000 0.503 2693 E N 1.305 121.485 120.200 -0.034 0.000 2.260 2693 E HA 0.351 4.701 4.350 0.001 0.000 0.266 2693 E C -1.048 175.539 176.600 -0.022 0.000 0.887 2693 E CA -0.353 56.016 56.400 -0.051 0.000 0.777 2693 E CB 2.129 31.764 29.700 -0.110 0.000 1.205 2693 E HN 0.507 nan 8.360 nan 0.000 0.414 2694 E N 0.992 121.188 120.200 -0.006 0.000 2.360 2694 E HA 0.085 4.436 4.350 0.001 0.000 0.269 2694 E C 0.214 176.841 176.600 0.045 0.000 1.022 2694 E CA -0.047 56.372 56.400 0.031 0.000 0.887 2694 E CB 0.844 30.560 29.700 0.028 0.000 0.990 2694 E HN 0.344 nan 8.360 nan 0.000 0.426 2695 T N 2.649 117.279 114.554 0.126 0.000 2.916 2695 T HA 0.239 4.589 4.350 0.001 0.000 0.303 2695 T C -0.408 174.377 174.700 0.142 0.000 1.025 2695 T CA -0.122 62.098 62.100 0.201 0.000 1.142 2695 T CB 0.257 69.362 68.868 0.394 0.000 0.947 2695 T HN 0.610 nan 8.240 nan 0.000 0.544 2696 K N 2.448 122.906 120.400 0.097 0.000 2.680 2696 K HA 0.589 4.910 4.320 0.001 0.000 0.295 2696 K C -1.833 174.723 176.600 -0.074 0.000 1.052 2696 K CA -1.270 55.011 56.287 -0.010 0.000 0.863 2696 K CB 0.726 33.191 32.500 -0.058 0.000 1.549 2696 K HN 0.341 nan 8.250 nan 0.000 0.391 2697 L N 1.113 122.193 121.223 -0.240 0.000 2.334 2697 L HA 0.529 4.869 4.340 0.001 0.000 0.273 2697 L C -0.939 175.778 176.870 -0.254 0.000 1.013 2697 L CA -0.886 53.789 54.840 -0.276 0.000 0.816 2697 L CB 1.234 42.992 42.059 -0.501 0.000 1.278 2697 L HN 0.578 nan 8.230 nan 0.000 0.431 2698 L N 2.566 123.674 121.223 -0.192 0.000 2.322 2698 L HA 0.573 4.914 4.340 0.001 0.000 0.281 2698 L C -0.247 176.516 176.870 -0.178 0.000 1.014 2698 L CA -0.440 54.301 54.840 -0.165 0.000 0.815 2698 L CB 2.008 43.998 42.059 -0.114 0.000 1.247 2698 L HN 0.193 nan 8.230 nan 0.000 0.421 2699 V N 5.278 125.078 119.914 -0.189 0.000 2.350 2699 V HA 0.462 4.583 4.120 0.001 0.000 0.285 2699 V C -0.078 175.905 176.094 -0.185 0.000 1.014 2699 V CA -0.633 61.551 62.300 -0.193 0.000 0.831 2699 V CB 1.616 33.310 31.823 -0.215 0.000 1.000 2699 V HN 0.469 nan 8.190 nan 0.000 0.433 2700 L N 3.590 124.703 121.223 -0.182 0.000 2.325 2700 L HA 0.660 5.000 4.340 0.001 0.000 0.279 2700 L C -0.560 176.048 176.870 -0.437 0.000 1.054 2700 L CA -0.448 54.193 54.840 -0.333 0.000 0.804 2700 L CB 1.709 43.575 42.059 -0.321 0.000 1.200 2700 L HN 0.504 nan 8.230 nan 0.000 0.436 2701 D N 1.317 121.340 120.400 -0.627 0.000 2.391 2701 D HA 0.370 5.011 4.640 0.001 0.000 0.245 2701 D C -0.512 175.276 176.300 -0.854 0.000 1.069 2701 D CA -0.291 53.399 54.000 -0.516 0.000 0.831 2701 D CB 1.395 42.023 40.800 -0.288 0.000 1.204 2701 D HN 0.264 nan 8.370 nan 0.000 0.503 2702 F N 0.876 120.615 119.950 -0.352 0.000 2.735 2702 F HA 0.211 4.739 4.527 0.000 0.000 0.308 2702 F C 0.869 176.552 175.800 -0.194 0.000 1.112 2702 F CA -0.679 57.067 58.000 -0.423 0.000 1.235 2702 F CB 0.385 38.799 39.000 -0.978 0.000 1.027 2702 F HN 0.198 nan 8.300 nan 0.000 0.528 2703 D N 0.798 121.190 120.400 -0.013 0.000 2.361 2703 D HA 0.229 4.869 4.640 0.001 0.000 0.239 2703 D C -0.069 176.234 176.300 0.004 0.000 1.200 2703 D CA 0.557 54.574 54.000 0.028 0.000 0.915 2703 D CB 1.599 42.407 40.800 0.014 0.000 1.170 2703 D HN -0.176 nan 8.370 nan 0.000 0.444 2704 V N 1.601 121.528 119.914 0.020 0.000 2.881 2704 V HA 0.198 4.318 4.120 0.001 0.000 0.316 2704 V C -0.269 175.823 176.094 -0.003 0.000 1.070 2704 V CA -0.889 61.417 62.300 0.009 0.000 0.976 2704 V CB 1.964 33.804 31.823 0.028 0.000 1.038 2704 V HN 0.456 nan 8.190 nan 0.000 0.446 2705 D N 4.611 125.005 120.400 -0.011 0.000 2.402 2705 D HA 0.451 5.092 4.640 0.001 0.000 0.235 2705 D C -0.269 176.020 176.300 -0.018 0.000 1.226 2705 D CA 0.349 54.339 54.000 -0.017 0.000 0.918 2705 D CB 0.867 41.655 40.800 -0.020 0.000 1.043 2705 D HN 0.352 nan 8.370 nan 0.000 0.506 2706 M N 0.000 119.588 119.600 -0.020 0.000 2.572 2706 M HA 0.000 4.480 4.480 0.001 0.000 0.227 2706 M CA 0.000 55.282 55.300 -0.031 0.000 0.988 2706 M CB 0.000 32.581 32.600 -0.031 0.000 1.302 2706 M HN 0.000 nan 8.290 nan 0.000 0.411