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 2cml_1_D DATA FIRST_RESID 3088 DATA SEQUENCE RTFLNLTKPL cEVNSWHILS KDNAIRIGED AHILVTREPY LScDPQGcRM DATA SEQUENCE FALSQGTTLR GRHANGTIHD RSPFRALISW EMGQAPSPYN TRVEcIGWSS DATA SEQUENCE TScHDGMSRM SIcMSGPNNN ASAVVWYGGR PITEIPSWAG NILRTQESEc DATA SEQUENCE VcHKGVcPVV MTDGPANNRA ATKIIYFKEG KIQKIEELAG NAQHIEEcSc DATA SEQUENCE YGAGGVIKcI cRDNWKGANR PVITIDPEMM THTSKYLcSK VLTDTSRPND DATA SEQUENCE PTNGNcDAPI TGGSPDPGVK GFAFLDGENS WLGRTISKDS RSGYEMLKVP DATA SEQUENCE NAETDIQSGP ISNQVIVNNQ NWSGYSGAFI DYWANKEcFN PcFYVELIRG DATA SEQUENCE RPKESSVLWT SNSIVALcGS KKRLGSWSWH DGAEIIYFE 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 3088 R HA 0.000 nan 4.340 nan 0.000 0.208 3088 R C 0.000 176.294 176.300 -0.010 0.000 0.893 3088 R CA 0.000 56.111 56.100 0.018 0.000 0.921 3088 R CB 0.000 30.305 30.300 0.009 0.000 0.687 3089 T N -1.138 113.438 114.554 0.037 0.000 2.900 3089 T HA 0.534 4.883 4.350 -0.001 0.000 0.303 3089 T C -0.045 174.723 174.700 0.113 0.000 1.142 3089 T CA -0.798 61.297 62.100 -0.008 0.000 1.007 3089 T CB 1.103 70.013 68.868 0.070 0.000 1.156 3089 T HN 0.304 nan 8.240 nan 0.000 0.490 3090 F N 1.406 121.441 119.950 0.143 0.000 2.623 3090 F HA 0.138 4.664 4.527 -0.000 0.000 0.383 3090 F C 1.056 176.942 175.800 0.143 0.000 1.077 3090 F CA -0.996 57.090 58.000 0.144 0.000 1.268 3090 F CB 0.385 39.426 39.000 0.067 0.000 1.053 3090 F HN 0.476 nan 8.300 nan 0.000 0.571 3091 L N 5.777 127.254 121.223 0.425 0.000 2.462 3091 L HA 0.155 4.494 4.340 -0.001 0.000 0.272 3091 L C -0.591 176.304 176.870 0.042 0.000 1.166 3091 L CA -0.015 54.946 54.840 0.201 0.000 0.880 3091 L CB -0.065 42.051 42.059 0.094 0.000 1.142 3091 L HN 0.423 nan 8.230 nan 0.000 0.473 3092 N N 5.664 124.384 118.700 0.033 0.000 2.362 3092 N HA 0.345 5.085 4.740 -0.001 0.000 0.298 3092 N C -0.699 174.950 175.510 0.232 0.000 1.048 3092 N CA -0.437 52.604 53.050 -0.015 0.000 0.858 3092 N CB 1.971 40.415 38.487 -0.071 0.000 1.218 3092 N HN 0.628 nan 8.380 nan 0.000 0.488 3093 L N 1.587 123.092 121.223 0.469 0.000 2.583 3093 L HA 0.144 4.484 4.340 -0.001 0.000 0.239 3093 L C 1.476 178.618 176.870 0.454 0.000 1.347 3093 L CA -0.078 55.059 54.840 0.495 0.000 1.246 3093 L CB -0.922 41.312 42.059 0.292 0.000 1.496 3093 L HN 0.643 nan 8.230 nan 0.000 0.413 3094 T N -3.860 110.887 114.554 0.322 0.000 3.057 3094 T HA 0.090 4.440 4.350 -0.001 0.000 0.254 3094 T C 0.894 175.560 174.700 -0.057 0.000 1.094 3094 T CA -0.087 62.088 62.100 0.125 0.000 1.088 3094 T CB 0.172 69.098 68.868 0.096 0.000 0.934 3094 T HN 0.260 nan 8.240 nan 0.000 0.497 3095 K N 2.739 122.916 120.400 -0.373 0.000 2.154 3095 K HA 0.393 4.713 4.320 -0.001 0.000 0.264 3095 K C -2.576 173.813 176.600 -0.352 0.000 1.008 3095 K CA -2.162 53.754 56.287 -0.619 0.000 0.937 3095 K CB 0.582 32.346 32.500 -1.227 0.000 1.002 3095 K HN 0.176 nan 8.250 nan 0.000 0.469 3096 P HA 0.147 nan 4.420 nan 0.000 0.278 3096 P C -0.278 177.032 177.300 0.017 0.000 1.266 3096 P CA -0.487 62.602 63.100 -0.019 0.000 0.807 3096 P CB 0.637 32.329 31.700 -0.013 0.000 1.094 3097 L N 0.311 121.606 121.223 0.121 0.000 2.461 3097 L HA 0.087 4.427 4.340 -0.001 0.000 0.272 3097 L C 0.771 177.647 176.870 0.010 0.000 1.197 3097 L CA -0.167 54.732 54.840 0.099 0.000 0.836 3097 L CB 0.160 42.284 42.059 0.109 0.000 1.105 3097 L HN 0.436 nan 8.230 nan 0.000 0.477 3098 c N 1.650 120.223 118.600 -0.045 0.000 2.580 3098 c HA 0.104 4.674 4.570 -0.001 0.000 0.371 3098 c C 0.762 174.809 174.090 -0.071 0.000 1.308 3098 c CA -0.676 55.610 56.329 -0.070 0.000 2.428 3098 c CB 0.416 42.863 42.510 -0.104 0.000 2.529 3098 c HN 0.719 nan 8.230 nan 0.000 0.657 3099 E N 0.476 120.643 120.200 -0.055 0.000 2.373 3099 E HA 0.398 4.748 4.350 -0.001 0.000 0.267 3099 E C -1.314 175.234 176.600 -0.088 0.000 1.032 3099 E CA -0.047 56.336 56.400 -0.028 0.000 0.889 3099 E CB 0.605 30.297 29.700 -0.012 0.000 0.984 3099 E HN 0.501 nan 8.360 nan 0.000 0.425 3100 V N 5.025 124.917 119.914 -0.037 0.000 2.638 3100 V HA 0.231 4.350 4.120 -0.001 0.000 0.306 3100 V C 0.029 176.177 176.094 0.089 0.000 1.052 3100 V CA -0.810 61.350 62.300 -0.234 0.000 0.885 3100 V CB 1.761 33.128 31.823 -0.760 0.000 0.999 3100 V HN 0.748 nan 8.190 nan 0.000 0.424 3101 N N 1.557 120.241 118.700 -0.026 0.000 2.168 3101 N HA 0.164 4.904 4.740 -0.001 0.000 0.216 3101 N C 0.344 175.935 175.510 0.136 0.000 1.259 3101 N CA 0.652 53.826 53.050 0.207 0.000 0.902 3101 N CB 1.417 39.962 38.487 0.097 0.000 1.079 3101 N HN 0.827 nan 8.380 nan 0.000 0.507 3102 S N -1.267 114.282 115.700 -0.252 0.000 2.724 3102 S HA 0.622 5.092 4.470 -0.001 0.000 0.278 3102 S C -2.138 172.045 174.600 -0.696 0.000 1.190 3102 S CA -0.895 57.131 58.200 -0.290 0.000 0.860 3102 S CB 1.216 64.438 63.200 0.038 0.000 1.206 3102 S HN 0.119 nan 8.310 nan 0.000 0.507 3103 W N 1.255 122.519 121.300 -0.060 0.000 2.683 3103 W HA 0.622 5.282 4.660 -0.001 0.000 0.329 3103 W C -0.111 176.428 176.519 0.033 0.000 1.037 3103 W CA -0.367 56.944 57.345 -0.058 0.000 1.232 3103 W CB 1.120 30.597 29.460 0.029 0.000 1.390 3103 W HN 1.016 nan 8.180 nan 0.000 0.465 3104 H N 0.450 119.612 119.070 0.153 0.000 2.496 3104 H HA 0.641 5.197 4.556 -0.001 0.000 0.342 3104 H C -0.491 174.868 175.328 0.052 0.000 1.170 3104 H CA -1.172 54.940 56.048 0.106 0.000 1.274 3104 H CB 1.214 30.993 29.762 0.028 0.000 1.538 3104 H HN 0.413 nan 8.280 nan 0.000 0.542 3105 I N 2.864 123.488 120.570 0.090 0.000 2.533 3105 I HA -0.000 4.169 4.170 -0.001 0.000 0.284 3105 I C 0.207 176.255 176.117 -0.116 0.000 1.109 3105 I CA -0.005 61.172 61.300 -0.205 0.000 1.412 3105 I CB 0.238 37.981 38.000 -0.428 0.000 1.396 3105 I HN 0.786 nan 8.210 nan 0.000 0.543 3106 L N 5.776 126.838 121.223 -0.268 0.000 2.265 3106 L HA 0.411 4.750 4.340 -0.001 0.000 0.195 3106 L C 0.641 177.447 176.870 -0.106 0.000 1.083 3106 L CA 0.916 55.693 54.840 -0.106 0.000 0.798 3106 L CB -0.020 41.990 42.059 -0.081 0.000 0.989 3106 L HN 0.670 nan 8.230 nan 0.000 0.472 3107 S N -1.310 114.280 115.700 -0.183 0.000 2.596 3107 S HA 0.598 5.068 4.470 -0.001 0.000 0.270 3107 S C -1.547 172.933 174.600 -0.200 0.000 1.155 3107 S CA -0.759 57.349 58.200 -0.152 0.000 0.827 3107 S CB 1.264 64.401 63.200 -0.106 0.000 1.130 3107 S HN 0.150 nan 8.310 nan 0.000 0.467 3108 K N 1.186 121.514 120.400 -0.120 0.000 2.570 3108 K HA 0.278 4.598 4.320 -0.001 0.000 0.256 3108 K C -1.122 175.482 176.600 0.007 0.000 0.939 3108 K CA -0.441 55.805 56.287 -0.069 0.000 0.833 3108 K CB 0.968 33.422 32.500 -0.076 0.000 1.318 3108 K HN 0.654 nan 8.250 nan 0.000 0.433 3109 D N 2.739 123.167 120.400 0.047 0.000 2.389 3109 D HA -0.031 4.609 4.640 -0.001 0.000 0.206 3109 D C -0.285 176.053 176.300 0.064 0.000 1.055 3109 D CA 0.085 54.133 54.000 0.080 0.000 0.856 3109 D CB 0.029 40.926 40.800 0.162 0.000 0.957 3109 D HN 0.649 nan 8.370 nan 0.000 0.509 3110 N N 0.522 119.262 118.700 0.067 0.000 2.710 3110 N HA -0.231 4.509 4.740 -0.001 0.000 0.249 3110 N C 1.054 176.596 175.510 0.054 0.000 1.059 3110 N CA 0.736 53.827 53.050 0.070 0.000 0.720 3110 N CB -1.137 37.391 38.487 0.069 0.000 0.983 3110 N HN 0.468 nan 8.380 nan 0.000 0.544 3111 A N 0.246 123.090 122.820 0.040 0.000 1.933 3111 A HA -0.134 4.185 4.320 -0.001 0.000 0.218 3111 A C 2.192 179.770 177.584 -0.009 0.000 1.175 3111 A CA 1.161 53.190 52.037 -0.012 0.000 0.628 3111 A CB -0.036 18.941 19.000 -0.038 0.000 0.814 3111 A HN 0.340 nan 8.150 nan 0.000 0.444 3112 I N -0.493 120.104 120.570 0.045 0.000 2.233 3112 I HA -0.146 4.023 4.170 -0.001 0.000 0.243 3112 I C 2.503 178.768 176.117 0.247 0.000 1.093 3112 I CA 1.174 62.532 61.300 0.097 0.000 1.380 3112 I CB -1.547 36.526 38.000 0.121 0.000 1.067 3112 I HN 0.337 nan 8.210 nan 0.000 0.413 3113 R N 0.888 121.509 120.500 0.202 0.000 2.094 3113 R HA -0.173 4.167 4.340 -0.001 0.000 0.239 3113 R C 2.368 178.724 176.300 0.093 0.000 1.137 3113 R CA 1.647 57.849 56.100 0.170 0.000 0.943 3113 R CB -0.454 29.922 30.300 0.125 0.000 0.850 3113 R HN 0.314 nan 8.270 nan 0.000 0.433 3114 I N -0.267 120.334 120.570 0.051 0.000 2.315 3114 I HA -0.145 4.025 4.170 -0.001 0.000 0.248 3114 I C 2.349 178.449 176.117 -0.029 0.000 1.117 3114 I CA 1.372 62.671 61.300 -0.002 0.000 1.404 3114 I CB -0.529 37.461 38.000 -0.018 0.000 1.071 3114 I HN 0.340 nan 8.210 nan 0.000 0.419 3115 G N -0.022 108.771 108.800 -0.011 0.000 2.776 3115 G HA2 -0.189 3.771 3.960 -0.001 0.000 0.209 3115 G HA3 -0.189 3.771 3.960 -0.001 0.000 0.209 3115 G C 1.507 176.425 174.900 0.030 0.000 1.145 3115 G CA 0.070 45.143 45.100 -0.045 0.000 0.791 3115 G HN 0.291 nan 8.290 nan 0.000 0.530 3116 E N 0.740 120.988 120.200 0.080 0.000 2.274 3116 E HA -0.087 4.263 4.350 -0.001 0.000 0.194 3116 E C 1.429 177.944 176.600 -0.141 0.000 0.996 3116 E CA 1.336 57.702 56.400 -0.056 0.000 0.840 3116 E CB 0.173 29.661 29.700 -0.354 0.000 0.772 3116 E HN 0.537 nan 8.360 nan 0.000 0.491 3117 D N -1.295 119.022 120.400 -0.138 0.000 2.434 3117 D HA 0.203 4.843 4.640 -0.001 0.000 0.288 3117 D C 0.324 176.457 176.300 -0.279 0.000 1.083 3117 D CA 0.514 54.406 54.000 -0.180 0.000 0.903 3117 D CB 0.470 41.177 40.800 -0.155 0.000 1.476 3117 D HN 0.139 nan 8.370 nan 0.000 0.502 3118 A N -0.380 122.293 122.820 -0.245 0.000 2.274 3118 A HA 0.536 4.856 4.320 -0.001 0.000 0.297 3118 A C -0.891 176.476 177.584 -0.362 0.000 1.191 3118 A CA -0.358 51.507 52.037 -0.288 0.000 0.889 3118 A CB 0.205 19.128 19.000 -0.128 0.000 1.294 3118 A HN 0.397 nan 8.150 nan 0.000 0.506 3119 H N 0.187 119.221 119.070 -0.059 0.000 2.702 3119 H HA 0.361 4.917 4.556 -0.000 0.000 0.252 3119 H C -0.686 174.496 175.328 -0.244 0.000 1.493 3119 H CA -0.216 55.752 56.048 -0.134 0.000 1.273 3119 H CB 0.015 29.711 29.762 -0.111 0.000 1.537 3119 H HN 0.266 nan 8.280 nan 0.000 0.547 3120 I N 3.534 124.013 120.570 -0.151 0.000 2.336 3120 I HA 0.107 4.276 4.170 -0.001 0.000 0.292 3120 I C 0.426 176.398 176.117 -0.242 0.000 0.991 3120 I CA -0.601 60.564 61.300 -0.226 0.000 1.227 3120 I CB 1.177 39.052 38.000 -0.209 0.000 1.366 3120 I HN 0.448 nan 8.210 nan 0.000 0.466 3121 L N 5.915 126.965 121.223 -0.289 0.000 2.490 3121 L HA 0.065 4.404 4.340 -0.001 0.000 0.274 3121 L C 0.184 176.915 176.870 -0.232 0.000 1.201 3121 L CA -0.169 54.519 54.840 -0.253 0.000 0.869 3121 L CB 0.415 42.306 42.059 -0.280 0.000 1.123 3121 L HN 0.267 nan 8.230 nan 0.000 0.484 3122 V N 2.624 122.427 119.914 -0.184 0.000 2.521 3122 V HA 0.212 4.332 4.120 -0.001 0.000 0.286 3122 V C 0.656 176.692 176.094 -0.096 0.000 1.034 3122 V CA -0.015 62.190 62.300 -0.157 0.000 1.045 3122 V CB 0.796 32.551 31.823 -0.113 0.000 0.974 3122 V HN 0.986 nan 8.190 nan 0.000 0.480 3123 T N 3.646 118.155 114.554 -0.075 0.000 2.831 3123 T HA 0.850 5.199 4.350 -0.001 0.000 0.287 3123 T C -0.530 174.174 174.700 0.007 0.000 1.070 3123 T CA -0.969 61.116 62.100 -0.024 0.000 1.010 3123 T CB 2.722 71.581 68.868 -0.016 0.000 1.264 3123 T HN 0.605 nan 8.240 nan 0.000 0.532 3124 R N -0.709 119.807 120.500 0.027 0.000 2.789 3124 R HA 0.348 4.688 4.340 -0.001 0.000 0.279 3124 R C -1.345 174.975 176.300 0.033 0.000 1.010 3124 R CA -0.706 55.399 56.100 0.007 0.000 0.855 3124 R CB 0.980 31.258 30.300 -0.037 0.000 1.312 3124 R HN 0.894 nan 8.270 nan 0.000 0.479 3125 E N -0.189 120.003 120.200 -0.012 0.000 2.252 3125 E HA -0.154 4.195 4.350 -0.001 0.000 0.218 3125 E C -2.503 174.235 176.600 0.229 0.000 1.253 3125 E CA 0.671 57.132 56.400 0.103 0.000 0.705 3125 E CB -1.227 28.549 29.700 0.128 0.000 1.172 3125 E HN 0.271 nan 8.360 nan 0.000 0.369 3126 P HA 0.383 nan 4.420 nan 0.000 0.278 3126 P C -0.513 176.681 177.300 -0.176 0.000 1.266 3126 P CA -0.234 62.866 63.100 -0.001 0.000 0.807 3126 P CB 0.767 32.441 31.700 -0.044 0.000 1.094 3127 Y N -2.443 117.470 120.300 -0.645 0.000 2.895 3127 Y HA 0.629 5.179 4.550 -0.000 0.000 0.339 3127 Y C -1.898 173.557 175.900 -0.741 0.000 1.363 3127 Y CA -1.298 56.138 58.100 -1.107 0.000 1.085 3127 Y CB 0.257 38.406 38.460 -0.518 0.000 1.500 3127 Y HN 0.119 nan 8.280 nan 0.000 0.442 3128 L N 1.318 122.211 121.223 -0.551 0.000 2.327 3128 L HA 0.835 5.174 4.340 -0.001 0.000 0.258 3128 L C -0.785 175.822 176.870 -0.439 0.000 1.024 3128 L CA -1.033 53.410 54.840 -0.661 0.000 0.825 3128 L CB 1.952 43.253 42.059 -1.265 0.000 1.386 3128 L HN 0.822 nan 8.230 nan 0.000 0.417 3129 S N -0.127 115.416 115.700 -0.261 0.000 2.548 3129 S HA 0.598 5.068 4.470 -0.001 0.000 0.278 3129 S C -1.060 173.606 174.600 0.110 0.000 1.150 3129 S CA -0.411 57.763 58.200 -0.043 0.000 0.907 3129 S CB 1.182 64.200 63.200 -0.304 0.000 1.108 3129 S HN 0.674 nan 8.310 nan 0.000 0.459 3130 c N 2.826 121.575 118.600 0.248 0.000 2.505 3130 c HA 0.979 5.549 4.570 -0.001 0.000 0.358 3130 c C -0.305 173.761 174.090 -0.041 0.000 1.226 3130 c CA -0.472 55.976 56.329 0.198 0.000 1.900 3130 c CB 0.905 43.630 42.510 0.358 0.000 2.306 3130 c HN 1.026 nan 8.230 nan 0.000 0.512 3131 D N -1.466 118.639 120.400 -0.492 0.000 2.664 3131 D HA 0.414 5.054 4.640 -0.001 0.000 0.292 3131 D C -2.597 172.917 176.300 -1.311 0.000 1.214 3131 D CA -1.061 52.067 54.000 -1.453 0.000 0.932 3131 D CB -0.048 40.031 40.800 -1.200 0.000 1.420 3131 D HN 0.097 nan 8.370 nan 0.000 0.471 3132 P HA -0.167 nan 4.420 nan 0.000 0.217 3132 P C 1.011 178.125 177.300 -0.309 0.000 1.148 3132 P CA 1.537 64.193 63.100 -0.740 0.000 0.828 3132 P CB 0.204 31.587 31.700 -0.528 0.000 0.783 3133 Q N -1.393 118.218 119.800 -0.314 0.000 2.269 3133 Q HA 0.288 4.628 4.340 -0.001 0.000 0.201 3133 Q C 1.263 177.199 176.000 -0.106 0.000 0.946 3133 Q CA 1.042 56.747 55.803 -0.163 0.000 0.877 3133 Q CB -0.022 28.624 28.738 -0.153 0.000 0.963 3133 Q HN 0.276 nan 8.270 nan 0.000 0.472 3134 G N -2.195 106.534 108.800 -0.117 0.000 2.404 3134 G HA2 0.237 4.196 3.960 -0.001 0.000 0.253 3134 G HA3 0.237 4.196 3.960 -0.001 0.000 0.253 3134 G C -1.478 173.402 174.900 -0.033 0.000 1.253 3134 G CA -0.417 44.658 45.100 -0.043 0.000 0.917 3134 G HN 0.070 nan 8.290 nan 0.000 0.480 3135 c N -0.232 118.354 118.600 -0.024 0.000 2.707 3135 c HA 0.950 5.519 4.570 -0.001 0.000 0.313 3135 c C 0.208 174.223 174.090 -0.125 0.000 1.209 3135 c CA -0.679 55.630 56.329 -0.034 0.000 1.635 3135 c CB 1.493 44.006 42.510 0.006 0.000 2.206 3135 c HN 0.791 nan 8.230 nan 0.000 0.485 3136 R N 0.991 121.398 120.500 -0.155 0.000 2.807 3136 R HA 0.667 5.007 4.340 -0.001 0.000 0.276 3136 R C -1.000 175.014 176.300 -0.478 0.000 0.979 3136 R CA -0.609 55.289 56.100 -0.336 0.000 0.928 3136 R CB 1.670 31.752 30.300 -0.363 0.000 1.191 3136 R HN 0.649 nan 8.270 nan 0.000 0.471 3137 M N 1.988 121.028 119.600 -0.932 0.000 2.314 3137 M HA 0.421 4.901 4.480 -0.001 0.000 0.342 3137 M C -1.135 174.175 176.300 -1.651 0.000 1.171 3137 M CA 0.021 54.573 55.300 -1.247 0.000 1.098 3137 M CB 0.813 32.409 32.600 -1.674 0.000 1.559 3137 M HN 0.341 nan 8.290 nan 0.000 0.459 3138 F N 0.864 120.026 119.950 -1.312 0.000 2.599 3138 F HA 0.858 5.384 4.527 -0.000 0.000 0.311 3138 F C -0.135 175.256 175.800 -0.680 0.000 1.076 3138 F CA -0.714 56.675 58.000 -1.018 0.000 0.937 3138 F CB 2.081 40.226 39.000 -1.425 0.000 1.282 3138 F HN 0.637 nan 8.300 nan 0.000 0.460 3139 A N 1.338 124.132 122.820 -0.043 0.000 2.566 3139 A HA 0.702 5.021 4.320 -0.001 0.000 0.290 3139 A C -2.159 175.501 177.584 0.127 0.000 1.071 3139 A CA -0.810 51.287 52.037 0.100 0.000 0.658 3139 A CB 1.092 20.230 19.000 0.231 0.000 1.285 3139 A HN 0.678 nan 8.150 nan 0.000 0.427 3140 L N 2.082 123.381 121.223 0.126 0.000 2.282 3140 L HA 0.372 4.712 4.340 -0.001 0.000 0.287 3140 L C 0.939 177.848 176.870 0.064 0.000 1.075 3140 L CA -0.248 54.653 54.840 0.102 0.000 0.839 3140 L CB 1.102 43.235 42.059 0.124 0.000 1.219 3140 L HN 0.743 nan 8.230 nan 0.000 0.434 3141 S N 1.931 117.651 115.700 0.035 0.000 2.573 3141 S HA 0.044 4.514 4.470 -0.001 0.000 0.277 3141 S C 0.892 175.512 174.600 0.033 0.000 1.346 3141 S CA -0.319 57.880 58.200 -0.002 0.000 1.034 3141 S CB 0.761 63.938 63.200 -0.039 0.000 0.879 3141 S HN 0.598 nan 8.310 nan 0.000 0.528 3142 Q N 2.112 121.927 119.800 0.025 0.000 2.280 3142 Q HA 0.173 4.513 4.340 -0.001 0.000 0.201 3142 Q C 1.196 177.253 176.000 0.094 0.000 0.890 3142 Q CA 0.561 56.411 55.803 0.078 0.000 0.947 3142 Q CB 0.380 29.163 28.738 0.074 0.000 1.081 3142 Q HN 1.149 nan 8.270 nan 0.000 0.502 3143 G N 1.881 110.704 108.800 0.038 0.000 2.221 3143 G HA2 -0.257 3.702 3.960 -0.001 0.000 0.265 3143 G HA3 -0.257 3.702 3.960 -0.001 0.000 0.265 3143 G C 0.093 174.964 174.900 -0.050 0.000 1.041 3143 G CA 1.035 46.145 45.100 0.015 0.000 0.807 3143 G HN 0.364 nan 8.290 nan 0.000 0.502 3144 T N -1.125 113.397 114.554 -0.052 0.000 2.840 3144 T HA 0.705 5.055 4.350 -0.001 0.000 0.317 3144 T C 0.323 174.973 174.700 -0.085 0.000 1.401 3144 T CA 0.845 62.911 62.100 -0.057 0.000 1.028 3144 T CB 1.369 70.248 68.868 0.018 0.000 1.317 3144 T HN 1.209 nan 8.240 nan 0.000 0.495 3145 T N 1.733 116.238 114.554 -0.082 0.000 2.902 3145 T HA 0.464 4.814 4.350 -0.001 0.000 0.280 3145 T C 1.386 176.002 174.700 -0.141 0.000 0.992 3145 T CA -0.729 61.302 62.100 -0.115 0.000 1.015 3145 T CB 0.966 69.794 68.868 -0.068 0.000 1.044 3145 T HN 0.430 nan 8.240 nan 0.000 0.520 3146 L N 0.534 121.623 121.223 -0.224 0.000 2.017 3146 L HA 0.097 4.437 4.340 -0.001 0.000 0.208 3146 L C 2.486 179.176 176.870 -0.300 0.000 1.073 3146 L CA 1.637 56.237 54.840 -0.399 0.000 0.745 3146 L CB -0.749 41.015 42.059 -0.491 0.000 0.894 3146 L HN 0.549 nan 8.230 nan 0.000 0.432 3147 R N 0.440 120.876 120.500 -0.106 0.000 2.307 3147 R HA 0.195 4.534 4.340 -0.001 0.000 0.199 3147 R C 0.784 177.102 176.300 0.029 0.000 1.000 3147 R CA 0.479 56.585 56.100 0.010 0.000 1.023 3147 R CB -1.279 29.039 30.300 0.030 0.000 0.908 3147 R HN 0.435 nan 8.270 nan 0.000 0.473 3148 G N 0.082 108.890 108.800 0.013 0.000 2.544 3148 G HA2 0.002 3.961 3.960 -0.001 0.000 0.242 3148 G HA3 0.002 3.961 3.960 -0.001 0.000 0.242 3148 G C 0.698 175.620 174.900 0.036 0.000 1.247 3148 G CA -0.491 44.637 45.100 0.047 0.000 0.840 3148 G HN 0.157 nan 8.290 nan 0.000 0.578 3149 R N -0.368 120.131 120.500 -0.002 0.000 2.152 3149 R HA -0.085 4.255 4.340 -0.001 0.000 0.232 3149 R C 1.658 177.861 176.300 -0.162 0.000 1.117 3149 R CA 0.957 57.002 56.100 -0.093 0.000 0.981 3149 R CB -0.106 30.089 30.300 -0.174 0.000 0.870 3149 R HN 0.662 nan 8.270 nan 0.000 0.451 3150 H N -0.437 118.628 119.070 -0.008 0.000 2.559 3150 H HA 0.065 4.620 4.556 -0.001 0.000 0.273 3150 H C 1.768 177.103 175.328 0.011 0.000 1.000 3150 H CA 0.805 56.842 56.048 -0.019 0.000 1.195 3150 H CB 0.208 29.931 29.762 -0.065 0.000 1.368 3150 H HN 0.246 nan 8.280 nan 0.000 0.592 3151 A N 1.304 124.182 122.820 0.097 0.000 2.067 3151 A HA -0.141 4.179 4.320 -0.001 0.000 0.219 3151 A C 1.401 179.086 177.584 0.169 0.000 1.158 3151 A CA 0.153 52.246 52.037 0.093 0.000 0.661 3151 A CB -0.432 18.562 19.000 -0.010 0.000 0.801 3151 A HN 0.225 nan 8.150 nan 0.000 0.452 3152 N N 0.483 119.259 118.700 0.127 0.000 2.414 3152 N HA 0.272 5.012 4.740 -0.001 0.000 0.268 3152 N C 0.939 176.501 175.510 0.087 0.000 1.286 3152 N CA 1.465 54.574 53.050 0.098 0.000 0.896 3152 N CB -0.011 38.497 38.487 0.035 0.000 1.093 3152 N HN 0.683 nan 8.380 nan 0.000 0.480 3153 G N 2.042 110.894 108.800 0.086 0.000 2.159 3153 G HA2 -0.273 3.686 3.960 -0.001 0.000 0.227 3153 G HA3 -0.273 3.686 3.960 -0.001 0.000 0.227 3153 G C 0.724 175.697 174.900 0.121 0.000 0.986 3153 G CA 0.501 45.646 45.100 0.075 0.000 0.651 3153 G HN 0.774 nan 8.290 nan 0.000 0.523 3154 T N -0.985 113.652 114.554 0.139 0.000 3.215 3154 T HA 0.301 4.650 4.350 -0.001 0.000 0.254 3154 T C 2.160 176.929 174.700 0.115 0.000 1.149 3154 T CA 0.798 62.984 62.100 0.143 0.000 1.042 3154 T CB 0.152 69.102 68.868 0.138 0.000 0.966 3154 T HN 0.588 nan 8.240 nan 0.000 0.534 3155 I N 0.709 121.334 120.570 0.092 0.000 2.361 3155 I HA -0.109 4.061 4.170 -0.001 0.000 0.251 3155 I C 1.149 177.306 176.117 0.067 0.000 1.133 3155 I CA 0.736 62.067 61.300 0.052 0.000 1.413 3155 I CB -0.213 37.794 38.000 0.013 0.000 1.073 3155 I HN 0.331 nan 8.210 nan 0.000 0.424 3156 H N 1.577 120.645 119.070 -0.003 0.000 3.034 3156 H HA -0.066 4.490 4.556 -0.001 0.000 0.324 3156 H C 0.861 176.172 175.328 -0.030 0.000 1.015 3156 H CA 0.730 56.766 56.048 -0.021 0.000 1.429 3156 H CB 0.455 30.215 29.762 -0.003 0.000 1.429 3156 H HN 0.203 nan 8.280 nan 0.000 0.585 3157 D N 4.259 124.395 120.400 -0.441 0.000 2.249 3157 D HA 0.005 4.644 4.640 -0.001 0.000 0.205 3157 D C 0.068 176.133 176.300 -0.391 0.000 0.962 3157 D CA 0.957 54.759 54.000 -0.329 0.000 0.860 3157 D CB 0.430 41.050 40.800 -0.301 0.000 0.955 3157 D HN 0.514 nan 8.370 nan 0.000 0.505 3158 R N -0.236 119.851 120.500 -0.688 0.000 2.574 3158 R HA 0.484 4.824 4.340 -0.001 0.000 0.288 3158 R C -0.671 175.432 176.300 -0.329 0.000 1.004 3158 R CA -0.444 55.276 56.100 -0.633 0.000 0.895 3158 R CB 2.432 31.992 30.300 -1.234 0.000 1.191 3158 R HN -0.049 nan 8.270 nan 0.000 0.444 3159 S N 0.805 116.470 115.700 -0.059 0.000 2.615 3159 S HA 0.443 4.913 4.470 -0.001 0.000 0.269 3159 S C -2.614 171.867 174.600 -0.198 0.000 1.161 3159 S CA -1.156 56.966 58.200 -0.131 0.000 0.817 3159 S CB 2.033 65.185 63.200 -0.079 0.000 1.131 3159 S HN 0.308 nan 8.310 nan 0.000 0.467 3160 P HA 0.282 nan 4.420 nan 0.000 0.245 3160 P C 0.172 177.226 177.300 -0.410 0.000 1.212 3160 P CA 0.367 63.170 63.100 -0.496 0.000 0.774 3160 P CB -0.389 30.999 31.700 -0.520 0.000 0.999 3161 F N -0.906 119.095 119.950 0.086 0.000 2.664 3161 F HA 0.259 4.786 4.527 -0.000 0.000 0.303 3161 F C 1.146 176.969 175.800 0.039 0.000 1.092 3161 F CA -0.670 57.355 58.000 0.042 0.000 1.305 3161 F CB -0.025 38.988 39.000 0.021 0.000 1.054 3161 F HN -0.332 nan 8.300 nan 0.000 0.565 3162 R N 1.568 122.142 120.500 0.123 0.000 2.404 3162 R HA 0.796 5.136 4.340 -0.001 0.000 0.291 3162 R C -0.505 175.823 176.300 0.046 0.000 1.025 3162 R CA -0.520 55.642 56.100 0.103 0.000 0.991 3162 R CB 1.507 31.893 30.300 0.144 0.000 1.053 3162 R HN 0.134 nan 8.270 nan 0.000 0.479 3163 A N 2.311 125.146 122.820 0.024 0.000 2.549 3163 A HA 0.348 4.667 4.320 -0.001 0.000 0.297 3163 A C -1.393 176.181 177.584 -0.017 0.000 1.061 3163 A CA -0.803 51.219 52.037 -0.025 0.000 0.690 3163 A CB 1.458 20.431 19.000 -0.045 0.000 1.287 3163 A HN 0.589 nan 8.150 nan 0.000 0.402 3164 L N 3.313 124.512 121.223 -0.040 0.000 2.418 3164 L HA 0.555 4.895 4.340 -0.001 0.000 0.274 3164 L C -0.164 176.678 176.870 -0.046 0.000 1.135 3164 L CA 0.337 55.174 54.840 -0.005 0.000 0.870 3164 L CB -0.195 41.874 42.059 0.017 0.000 1.154 3164 L HN 0.524 nan 8.230 nan 0.000 0.462 3165 I N 2.397 122.962 120.570 -0.008 0.000 2.530 3165 I HA 0.801 4.971 4.170 -0.001 0.000 0.297 3165 I C -0.368 175.697 176.117 -0.086 0.000 1.011 3165 I CA -0.539 60.747 61.300 -0.023 0.000 1.107 3165 I CB 2.027 40.042 38.000 0.024 0.000 1.285 3165 I HN 0.658 nan 8.210 nan 0.000 0.436 3166 S N 4.097 119.639 115.700 -0.264 0.000 2.542 3166 S HA 0.857 5.327 4.470 -0.001 0.000 0.293 3166 S C -1.207 173.244 174.600 -0.248 0.000 1.089 3166 S CA -0.610 57.132 58.200 -0.763 0.000 0.961 3166 S CB 1.506 63.831 63.200 -1.458 0.000 1.062 3166 S HN 1.010 nan 8.310 nan 0.000 0.483 3167 W N 0.318 121.297 121.300 -0.535 0.000 3.042 3167 W HA 0.677 5.337 4.660 -0.001 0.000 0.342 3167 W C -0.924 175.426 176.519 -0.282 0.000 1.240 3167 W CA -0.962 56.185 57.345 -0.331 0.000 1.166 3167 W CB 0.457 29.766 29.460 -0.252 0.000 1.469 3167 W HN 0.830 nan 8.180 nan 0.000 0.579 3168 E N 2.735 122.933 120.200 -0.003 0.000 2.376 3168 E HA 0.053 4.403 4.350 -0.001 0.000 0.266 3168 E C 0.138 176.666 176.600 -0.121 0.000 1.009 3168 E CA -0.522 55.824 56.400 -0.091 0.000 0.902 3168 E CB 0.659 30.348 29.700 -0.018 0.000 0.972 3168 E HN 0.657 nan 8.360 nan 0.000 0.439 3169 M N 5.006 124.483 119.600 -0.205 0.000 2.290 3169 M HA -0.009 4.471 4.480 -0.001 0.000 0.356 3169 M C 0.886 177.144 176.300 -0.071 0.000 1.448 3169 M CA 1.881 57.056 55.300 -0.209 0.000 0.993 3169 M CB -0.097 32.396 32.600 -0.177 0.000 1.934 3169 M HN 0.892 nan 8.290 nan 0.000 0.461 3170 G N 2.825 111.608 108.800 -0.028 0.000 2.258 3170 G HA2 -0.243 3.717 3.960 -0.001 0.000 0.233 3170 G HA3 -0.243 3.717 3.960 -0.001 0.000 0.233 3170 G C 0.018 174.977 174.900 0.098 0.000 1.006 3170 G CA 0.168 45.285 45.100 0.029 0.000 0.620 3170 G HN 0.693 nan 8.290 nan 0.000 0.511 3171 Q N 1.036 120.931 119.800 0.158 0.000 2.395 3171 Q HA 0.527 4.866 4.340 -0.001 0.000 0.271 3171 Q C 0.734 176.854 176.000 0.201 0.000 1.026 3171 Q CA 0.290 56.195 55.803 0.170 0.000 0.900 3171 Q CB 0.864 29.716 28.738 0.190 0.000 1.266 3171 Q HN 0.846 nan 8.270 nan 0.000 0.430 3172 A N 4.015 126.826 122.820 -0.016 0.000 2.340 3172 A HA 0.381 4.701 4.320 -0.001 0.000 0.268 3172 A C -2.179 175.049 177.584 -0.592 0.000 1.100 3172 A CA -1.399 50.522 52.037 -0.194 0.000 0.803 3172 A CB 0.067 18.982 19.000 -0.141 0.000 1.043 3172 A HN 0.478 nan 8.150 nan 0.000 0.488 3173 P HA 0.170 nan 4.420 nan 0.000 0.280 3173 P C -0.264 176.612 177.300 -0.707 0.000 1.386 3173 P CA 0.129 62.419 63.100 -1.351 0.000 0.899 3173 P CB 0.644 31.216 31.700 -1.880 0.000 1.098 3174 S N 3.800 119.175 115.700 -0.541 0.000 2.767 3174 S HA 0.596 5.066 4.470 -0.001 0.000 0.300 3174 S C -1.986 172.297 174.600 -0.529 0.000 1.123 3174 S CA -1.809 56.104 58.200 -0.479 0.000 0.992 3174 S CB 0.894 63.846 63.200 -0.414 0.000 1.138 3174 S HN 0.027 nan 8.310 nan 0.000 0.550 3175 P HA 0.058 nan 4.420 nan 0.000 0.228 3175 P C 0.145 177.223 177.300 -0.370 0.000 1.151 3175 P CA 1.010 63.768 63.100 -0.571 0.000 0.770 3175 P CB -0.287 31.049 31.700 -0.608 0.000 0.786 3176 Y N -0.951 119.285 120.300 -0.106 0.000 2.478 3176 Y HA 0.147 4.697 4.550 -0.000 0.000 0.261 3176 Y C 1.580 177.431 175.900 -0.083 0.000 1.127 3176 Y CA -0.226 57.824 58.100 -0.084 0.000 1.288 3176 Y CB -0.208 38.212 38.460 -0.066 0.000 1.084 3176 Y HN 0.086 nan 8.280 nan 0.000 0.530 3177 N N -0.358 118.318 118.700 -0.039 0.000 2.184 3177 N HA 0.032 4.771 4.740 -0.001 0.000 0.234 3177 N C -0.533 174.950 175.510 -0.046 0.000 1.282 3177 N CA 0.076 53.107 53.050 -0.032 0.000 0.877 3177 N CB -0.152 38.316 38.487 -0.031 0.000 1.184 3177 N HN 0.043 nan 8.380 nan 0.000 0.510 3178 T N -1.523 112.978 114.554 -0.089 0.000 2.829 3178 T HA 0.483 4.833 4.350 -0.001 0.000 0.280 3178 T C -0.245 174.414 174.700 -0.068 0.000 0.999 3178 T CA -0.905 61.156 62.100 -0.066 0.000 0.983 3178 T CB 2.500 71.272 68.868 -0.160 0.000 0.968 3178 T HN 0.212 nan 8.240 nan 0.000 0.446 3179 R N 2.125 122.579 120.500 -0.077 0.000 2.312 3179 R HA 0.545 4.885 4.340 -0.001 0.000 0.311 3179 R C -0.959 175.264 176.300 -0.129 0.000 1.004 3179 R CA -0.676 55.362 56.100 -0.104 0.000 0.902 3179 R CB 0.831 31.058 30.300 -0.121 0.000 1.073 3179 R HN 0.581 nan 8.270 nan 0.000 0.457 3180 V N 5.391 125.225 119.914 -0.133 0.000 2.439 3180 V HA 0.028 4.147 4.120 -0.001 0.000 0.271 3180 V C 0.891 176.822 176.094 -0.272 0.000 1.040 3180 V CA 0.056 62.254 62.300 -0.171 0.000 1.002 3180 V CB 1.263 32.998 31.823 -0.146 0.000 1.000 3180 V HN 0.908 nan 8.190 nan 0.000 0.477 3181 E N 2.850 122.872 120.200 -0.296 0.000 2.140 3181 E HA 0.067 4.416 4.350 -0.001 0.000 0.191 3181 E C 0.481 176.581 176.600 -0.833 0.000 0.973 3181 E CA 1.011 57.172 56.400 -0.398 0.000 0.829 3181 E CB 0.432 30.024 29.700 -0.179 0.000 0.781 3181 E HN 0.929 nan 8.360 nan 0.000 0.466 3182 c N -1.263 116.936 118.600 -0.668 0.000 3.216 3182 c HA 0.516 5.086 4.570 -0.001 0.000 0.346 3182 c C -1.096 172.820 174.090 -0.290 0.000 1.384 3182 c CA -1.347 54.556 56.329 -0.710 0.000 1.208 3182 c CB 0.633 42.749 42.510 -0.656 0.000 1.483 3182 c HN 0.021 nan 8.230 nan 0.000 0.453 3183 I N 2.347 122.832 120.570 -0.143 0.000 2.339 3183 I HA 0.791 4.960 4.170 -0.001 0.000 0.290 3183 I C 0.743 176.779 176.117 -0.136 0.000 0.994 3183 I CA 0.893 62.142 61.300 -0.085 0.000 1.191 3183 I CB 0.435 38.427 38.000 -0.013 0.000 1.343 3183 I HN 1.484 nan 8.210 nan 0.000 0.458 3184 G N 6.498 115.202 108.800 -0.161 0.000 2.343 3184 G HA2 0.136 4.096 3.960 -0.001 0.000 0.289 3184 G HA3 0.136 4.096 3.960 -0.001 0.000 0.289 3184 G C -1.147 173.643 174.900 -0.183 0.000 1.295 3184 G CA -0.551 44.342 45.100 -0.346 0.000 0.869 3184 G HN 0.619 nan 8.290 nan 0.000 0.522 3185 W N -0.233 121.055 121.300 -0.021 0.000 2.467 3185 W HA 0.648 5.308 4.660 -0.001 0.000 0.369 3185 W C -0.116 176.401 176.519 -0.005 0.000 0.938 3185 W CA 0.007 57.338 57.345 -0.023 0.000 1.845 3185 W CB 0.459 29.883 29.460 -0.060 0.000 1.167 3185 W HN 0.832 nan 8.180 nan 0.000 0.558 3186 S N 1.825 117.607 115.700 0.138 0.000 2.562 3186 S HA 0.515 4.985 4.470 -0.001 0.000 0.274 3186 S C -0.692 173.912 174.600 0.008 0.000 1.160 3186 S CA -0.063 58.226 58.200 0.149 0.000 0.933 3186 S CB 1.515 64.842 63.200 0.213 0.000 1.100 3186 S HN 0.241 nan 8.310 nan 0.000 0.468 3187 S N 2.466 118.201 115.700 0.058 0.000 2.661 3187 S HA 0.914 5.384 4.470 -0.001 0.000 0.285 3187 S C -0.608 173.981 174.600 -0.018 0.000 1.138 3187 S CA -0.513 57.710 58.200 0.039 0.000 0.855 3187 S CB 1.928 65.207 63.200 0.132 0.000 1.136 3187 S HN 0.837 nan 8.310 nan 0.000 0.484 3188 T N -0.176 114.362 114.554 -0.028 0.000 2.821 3188 T HA 0.752 5.102 4.350 -0.001 0.000 0.306 3188 T C -1.674 173.010 174.700 -0.026 0.000 1.313 3188 T CA -0.265 61.768 62.100 -0.113 0.000 1.012 3188 T CB 1.580 70.385 68.868 -0.106 0.000 1.298 3188 T HN 1.210 nan 8.240 nan 0.000 0.502 3189 S N 0.267 115.933 115.700 -0.057 0.000 2.542 3189 S HA 0.727 5.197 4.470 -0.001 0.000 0.276 3189 S C -1.476 173.094 174.600 -0.050 0.000 1.148 3189 S CA -0.332 57.836 58.200 -0.054 0.000 0.886 3189 S CB 0.224 63.337 63.200 -0.146 0.000 1.109 3189 S HN 1.440 nan 8.310 nan 0.000 0.458 3190 c N 2.769 121.387 118.600 0.030 0.000 3.284 3190 c HA 0.670 5.240 4.570 -0.001 0.000 0.338 3190 c C -1.157 173.054 174.090 0.202 0.000 1.237 3190 c CA -0.880 55.528 56.329 0.131 0.000 1.276 3190 c CB 0.854 43.448 42.510 0.140 0.000 1.601 3190 c HN 1.001 nan 8.230 nan 0.000 0.494 3191 H N 1.630 120.827 119.070 0.213 0.000 2.458 3191 H HA 0.382 4.938 4.556 -0.001 0.000 0.330 3191 H C -0.124 175.432 175.328 0.381 0.000 1.111 3191 H CA 0.518 56.690 56.048 0.208 0.000 1.245 3191 H CB 2.004 31.775 29.762 0.015 0.000 1.456 3191 H HN 0.952 nan 8.280 nan 0.000 0.488 3192 D N 2.102 122.658 120.400 0.261 0.000 2.340 3192 D HA 0.127 4.767 4.640 -0.001 0.000 0.217 3192 D C 1.434 178.127 176.300 0.656 0.000 1.081 3192 D CA 0.498 54.756 54.000 0.430 0.000 0.842 3192 D CB 0.350 41.354 40.800 0.340 0.000 0.934 3192 D HN 0.870 nan 8.370 nan 0.000 0.511 3193 G N 0.116 109.437 108.800 0.867 0.000 2.254 3193 G HA2 -0.325 3.635 3.960 -0.001 0.000 0.225 3193 G HA3 -0.325 3.635 3.960 -0.001 0.000 0.225 3193 G C 1.022 176.212 174.900 0.482 0.000 1.003 3193 G CA 0.468 46.033 45.100 0.776 0.000 0.622 3193 G HN 0.283 nan 8.290 nan 0.000 0.507 3194 M N -0.207 119.586 119.600 0.321 0.000 2.858 3194 M HA 0.338 4.817 4.480 -0.001 0.000 0.255 3194 M C 0.707 176.959 176.300 -0.080 0.000 1.336 3194 M CA 1.279 56.650 55.300 0.119 0.000 1.220 3194 M CB 0.484 33.104 32.600 0.033 0.000 1.252 3194 M HN 0.196 nan 8.290 nan 0.000 0.538 3195 S N -0.351 115.077 115.700 -0.454 0.000 2.596 3195 S HA 0.480 4.950 4.470 -0.001 0.000 0.270 3195 S C -0.843 173.205 174.600 -0.921 0.000 1.155 3195 S CA -0.897 56.862 58.200 -0.734 0.000 0.827 3195 S CB 3.041 65.684 63.200 -0.929 0.000 1.130 3195 S HN 0.282 nan 8.310 nan 0.000 0.467 3196 R N 1.444 121.613 120.500 -0.551 0.000 2.254 3196 R HA 0.511 4.851 4.340 -0.001 0.000 0.318 3196 R C -0.531 175.725 176.300 -0.074 0.000 1.031 3196 R CA -0.304 55.682 56.100 -0.191 0.000 0.905 3196 R CB 0.582 30.918 30.300 0.059 0.000 1.050 3196 R HN 0.754 nan 8.270 nan 0.000 0.456 3197 M N 3.818 123.477 119.600 0.098 0.000 2.144 3197 M HA 0.259 4.739 4.480 -0.001 0.000 0.356 3197 M C -1.253 175.093 176.300 0.078 0.000 1.217 3197 M CA 0.058 55.458 55.300 0.166 0.000 1.087 3197 M CB 1.348 34.046 32.600 0.162 0.000 1.609 3197 M HN 0.636 nan 8.290 nan 0.000 0.467 3198 S N 5.910 121.664 115.700 0.090 0.000 2.513 3198 S HA 0.732 5.202 4.470 -0.001 0.000 0.299 3198 S C -0.803 173.820 174.600 0.039 0.000 1.087 3198 S CA -0.716 57.505 58.200 0.036 0.000 1.012 3198 S CB 1.559 64.750 63.200 -0.015 0.000 1.044 3198 S HN 0.717 nan 8.310 nan 0.000 0.485 3199 I N 1.548 122.114 120.570 -0.008 0.000 2.499 3199 I HA 0.439 4.609 4.170 -0.001 0.000 0.288 3199 I C -1.081 175.020 176.117 -0.027 0.000 1.048 3199 I CA -0.449 60.846 61.300 -0.009 0.000 1.062 3199 I CB 1.693 39.648 38.000 -0.076 0.000 1.238 3199 I HN 0.504 nan 8.210 nan 0.000 0.426 3200 c N 6.151 124.730 118.600 -0.034 0.000 2.498 3200 c HA 0.646 5.216 4.570 -0.001 0.000 0.316 3200 c C 0.011 173.976 174.090 -0.209 0.000 1.209 3200 c CA -0.641 55.614 56.329 -0.123 0.000 1.518 3200 c CB 1.463 43.893 42.510 -0.134 0.000 2.147 3200 c HN 0.609 nan 8.230 nan 0.000 0.483 3201 M N 3.184 122.545 119.600 -0.399 0.000 2.233 3201 M HA 0.547 5.027 4.480 -0.001 0.000 0.355 3201 M C 0.415 175.971 176.300 -1.240 0.000 1.191 3201 M CA 0.582 55.469 55.300 -0.689 0.000 1.101 3201 M CB 1.241 33.397 32.600 -0.739 0.000 1.592 3201 M HN 0.850 nan 8.290 nan 0.000 0.461 3202 S N 0.817 115.973 115.700 -0.906 0.000 2.651 3202 S HA 1.029 5.499 4.470 -0.001 0.000 0.279 3202 S C -0.282 174.224 174.600 -0.158 0.000 1.148 3202 S CA -0.251 57.503 58.200 -0.742 0.000 0.837 3202 S CB 1.795 64.790 63.200 -0.342 0.000 1.138 3202 S HN 1.491 nan 8.310 nan 0.000 0.478 3203 G N 0.422 109.341 108.800 0.197 0.000 2.371 3203 G HA2 0.252 4.211 3.960 -0.001 0.000 0.663 3203 G HA3 0.252 4.211 3.960 -0.001 0.000 0.663 3203 G C -3.496 171.579 174.900 0.290 0.000 1.311 3203 G CA -0.375 44.847 45.100 0.204 0.000 0.985 3203 G HN 0.808 nan 8.290 nan 0.000 0.566 3204 P HA 0.308 nan 4.420 nan 0.000 0.278 3204 P C 0.553 177.892 177.300 0.065 0.000 1.258 3204 P CA -0.503 62.644 63.100 0.078 0.000 0.811 3204 P CB 0.774 32.498 31.700 0.041 0.000 1.063 3205 N N 1.380 120.071 118.700 -0.015 0.000 2.133 3205 N HA -0.204 4.536 4.740 -0.001 0.000 0.193 3205 N C 1.071 176.574 175.510 -0.011 0.000 1.012 3205 N CA 1.740 54.763 53.050 -0.046 0.000 0.871 3205 N CB -0.865 37.573 38.487 -0.082 0.000 1.011 3205 N HN 0.585 nan 8.380 nan 0.000 0.435 3206 N N -0.888 117.811 118.700 -0.002 0.000 2.276 3206 N HA 0.059 4.799 4.740 -0.001 0.000 0.212 3206 N C -0.298 175.213 175.510 0.002 0.000 1.127 3206 N CA 0.047 53.093 53.050 -0.007 0.000 0.834 3206 N CB 0.133 38.616 38.487 -0.006 0.000 1.014 3206 N HN -0.038 nan 8.380 nan 0.000 0.491 3207 N N -0.634 118.078 118.700 0.019 0.000 2.381 3207 N HA 0.210 4.950 4.740 -0.001 0.000 0.248 3207 N C -1.263 174.268 175.510 0.036 0.000 1.430 3207 N CA -0.081 52.982 53.050 0.021 0.000 0.993 3207 N CB 0.573 39.075 38.487 0.024 0.000 1.352 3207 N HN 0.359 nan 8.380 nan 0.000 0.520 3208 A N 0.319 123.171 122.820 0.053 0.000 2.332 3208 A HA 0.719 5.039 4.320 -0.001 0.000 0.258 3208 A C 0.401 177.967 177.584 -0.031 0.000 1.087 3208 A CA 0.052 52.133 52.037 0.073 0.000 0.802 3208 A CB 0.350 19.482 19.000 0.220 0.000 1.042 3208 A HN 0.342 nan 8.150 nan 0.000 0.489 3209 S N -0.506 115.146 115.700 -0.079 0.000 2.569 3209 S HA 0.777 5.247 4.470 -0.001 0.000 0.280 3209 S C -0.439 174.085 174.600 -0.126 0.000 1.111 3209 S CA -0.182 57.969 58.200 -0.081 0.000 0.887 3209 S CB 1.622 64.800 63.200 -0.037 0.000 1.095 3209 S HN 1.802 nan 8.310 nan 0.000 0.476 3210 A N 1.459 124.238 122.820 -0.069 0.000 2.301 3210 A HA 0.706 5.026 4.320 -0.001 0.000 0.298 3210 A C -0.417 177.169 177.584 0.004 0.000 1.185 3210 A CA -0.713 51.297 52.037 -0.043 0.000 0.830 3210 A CB 0.287 19.298 19.000 0.017 0.000 1.112 3210 A HN 0.949 nan 8.150 nan 0.000 0.508 3211 V N 3.326 123.259 119.914 0.033 0.000 2.417 3211 V HA 0.383 4.502 4.120 -0.001 0.000 0.291 3211 V C -0.158 176.032 176.094 0.160 0.000 1.024 3211 V CA -0.583 61.763 62.300 0.077 0.000 0.861 3211 V CB 1.442 33.342 31.823 0.127 0.000 0.985 3211 V HN 0.602 nan 8.190 nan 0.000 0.436 3212 V N 3.846 123.791 119.914 0.052 0.000 2.370 3212 V HA 0.418 4.538 4.120 -0.001 0.000 0.279 3212 V C -0.776 175.353 176.094 0.059 0.000 1.029 3212 V CA -0.563 61.740 62.300 0.006 0.000 0.870 3212 V CB 0.972 32.669 31.823 -0.210 0.000 0.984 3212 V HN 0.861 nan 8.190 nan 0.000 0.451 3213 W N 4.122 125.385 121.300 -0.061 0.000 2.551 3213 W HA 0.663 5.323 4.660 -0.001 0.000 0.330 3213 W C -0.607 175.957 176.519 0.076 0.000 1.063 3213 W CA -0.970 56.377 57.345 0.004 0.000 1.222 3213 W CB 1.093 30.549 29.460 -0.007 0.000 1.349 3213 W HN 0.563 nan 8.180 nan 0.000 0.536 3214 Y N 0.804 121.185 120.300 0.135 0.000 2.386 3214 Y HA 0.476 5.026 4.550 -0.000 0.000 0.334 3214 Y C 0.849 176.797 175.900 0.079 0.000 1.002 3214 Y CA -0.324 57.822 58.100 0.076 0.000 1.068 3214 Y CB 2.056 40.535 38.460 0.032 0.000 1.203 3214 Y HN 0.769 nan 8.280 nan 0.000 0.443 3215 G N 3.190 111.683 108.800 -0.511 0.000 2.225 3215 G HA2 -0.071 3.889 3.960 -0.001 0.000 0.267 3215 G HA3 -0.071 3.889 3.960 -0.001 0.000 0.267 3215 G C 0.913 175.796 174.900 -0.029 0.000 1.024 3215 G CA 0.722 45.650 45.100 -0.287 0.000 0.784 3215 G HN 2.147 nan 8.290 nan 0.000 0.507 3216 G N -1.863 106.993 108.800 0.093 0.000 2.176 3216 G HA2 -0.199 3.761 3.960 -0.001 0.000 0.252 3216 G HA3 -0.199 3.761 3.960 -0.001 0.000 0.252 3216 G C 0.162 175.323 174.900 0.436 0.000 1.024 3216 G CA 1.046 46.292 45.100 0.244 0.000 0.755 3216 G HN 1.127 nan 8.290 nan 0.000 0.507 3217 R N -0.074 120.628 120.500 0.337 0.000 2.725 3217 R HA 0.535 4.875 4.340 -0.001 0.000 0.277 3217 R C -2.777 173.348 176.300 -0.291 0.000 0.987 3217 R CA -1.957 54.163 56.100 0.034 0.000 0.901 3217 R CB 2.857 33.156 30.300 -0.002 0.000 1.207 3217 R HN 0.096 nan 8.270 nan 0.000 0.463 3218 P HA 0.188 nan 4.420 nan 0.000 0.279 3218 P C -0.248 176.815 177.300 -0.395 0.000 1.239 3218 P CA -0.191 62.325 63.100 -0.972 0.000 0.789 3218 P CB 1.226 32.208 31.700 -1.196 0.000 0.933 3219 I N 0.402 120.818 120.570 -0.258 0.000 3.739 3219 I HA 0.157 4.326 4.170 -0.001 0.000 0.272 3219 I C 0.787 176.859 176.117 -0.074 0.000 1.167 3219 I CA 0.989 62.227 61.300 -0.104 0.000 1.386 3219 I CB -0.432 37.559 38.000 -0.016 0.000 1.490 3219 I HN 0.256 nan 8.210 nan 0.000 0.452 3220 T N 1.896 116.415 114.554 -0.059 0.000 2.900 3220 T HA 0.576 4.926 4.350 -0.001 0.000 0.295 3220 T C -0.888 173.810 174.700 -0.003 0.000 1.044 3220 T CA -0.501 61.600 62.100 0.002 0.000 0.995 3220 T CB 2.808 71.738 68.868 0.103 0.000 1.072 3220 T HN -0.088 nan 8.240 nan 0.000 0.473 3221 E N 1.260 121.471 120.200 0.019 0.000 2.238 3221 E HA 0.686 5.036 4.350 -0.001 0.000 0.267 3221 E C -0.930 175.712 176.600 0.070 0.000 0.887 3221 E CA -0.588 55.828 56.400 0.027 0.000 0.769 3221 E CB 1.856 31.555 29.700 -0.001 0.000 1.187 3221 E HN 0.475 nan 8.360 nan 0.000 0.416 3222 I N 3.188 123.810 120.570 0.087 0.000 2.468 3222 I HA 0.360 4.530 4.170 -0.001 0.000 0.285 3222 I C -2.365 173.809 176.117 0.094 0.000 1.039 3222 I CA -2.323 59.056 61.300 0.133 0.000 1.074 3222 I CB 1.932 40.070 38.000 0.229 0.000 1.228 3222 I HN 0.292 nan 8.210 nan 0.000 0.436 3223 P HA 0.080 nan 4.420 nan 0.000 0.278 3223 P C -0.064 177.256 177.300 0.034 0.000 1.238 3223 P CA -0.323 62.808 63.100 0.050 0.000 0.794 3223 P CB 1.340 33.075 31.700 0.058 0.000 0.955 3224 S N 1.923 117.576 115.700 -0.079 0.000 2.702 3224 S HA -0.085 4.385 4.470 -0.001 0.000 0.314 3224 S C 0.770 175.337 174.600 -0.056 0.000 1.244 3224 S CA -0.190 57.881 58.200 -0.214 0.000 1.058 3224 S CB -0.405 62.700 63.200 -0.160 0.000 0.783 3224 S HN 0.557 nan 8.310 nan 0.000 0.503 3225 W N 3.701 125.012 121.300 0.019 0.000 2.942 3225 W HA 0.562 5.221 4.660 -0.001 0.000 0.263 3225 W C 1.137 177.661 176.519 0.008 0.000 1.296 3225 W CA 0.089 57.440 57.345 0.011 0.000 1.504 3225 W CB -0.317 29.146 29.460 0.004 0.000 1.096 3225 W HN 0.698 nan 8.180 nan 0.000 0.639 3226 A N 0.438 123.251 122.820 -0.013 0.000 2.628 3226 A HA 0.583 4.903 4.320 -0.001 0.000 0.267 3226 A C 1.647 179.210 177.584 -0.035 0.000 1.159 3226 A CA 0.201 52.257 52.037 0.031 0.000 0.972 3226 A CB -0.505 18.544 19.000 0.081 0.000 1.211 3226 A HN 0.763 nan 8.150 nan 0.000 0.576 3227 G N 0.355 109.114 108.800 -0.069 0.000 2.225 3227 G HA2 -0.274 3.686 3.960 -0.001 0.000 0.267 3227 G HA3 -0.274 3.686 3.960 -0.001 0.000 0.267 3227 G C -0.049 174.821 174.900 -0.051 0.000 1.024 3227 G CA 0.579 45.652 45.100 -0.045 0.000 0.784 3227 G HN 0.727 nan 8.290 nan 0.000 0.507 3228 N N -0.133 118.519 118.700 -0.080 0.000 2.716 3228 N HA 0.372 5.112 4.740 -0.001 0.000 0.245 3228 N C 0.506 175.971 175.510 -0.075 0.000 1.495 3228 N CA -0.262 52.747 53.050 -0.067 0.000 0.759 3228 N CB -0.384 38.071 38.487 -0.053 0.000 1.261 3228 N HN 0.780 nan 8.380 nan 0.000 0.515 3229 I N 0.360 120.901 120.570 -0.047 0.000 6.738 3229 I HA -0.310 3.860 4.170 -0.001 0.000 0.126 3229 I C -0.147 175.994 176.117 0.040 0.000 1.829 3229 I CA -0.112 61.194 61.300 0.010 0.000 2.040 3229 I CB -0.815 37.122 38.000 -0.104 0.000 3.535 3229 I HN 0.301 nan 8.210 nan 0.000 0.170 3230 L N 5.576 126.785 121.223 -0.024 0.000 2.640 3230 L HA 0.149 4.489 4.340 -0.001 0.000 0.280 3230 L C 0.864 177.757 176.870 0.038 0.000 1.229 3230 L CA 1.148 55.884 54.840 -0.173 0.000 0.919 3230 L CB 0.052 41.926 42.059 -0.308 0.000 1.168 3230 L HN 0.577 nan 8.230 nan 0.000 0.496 3231 R N 2.507 123.008 120.500 0.003 0.000 2.692 3231 R HA 0.681 5.021 4.340 -0.001 0.000 0.269 3231 R C -1.048 175.289 176.300 0.061 0.000 1.030 3231 R CA -0.661 55.505 56.100 0.110 0.000 0.882 3231 R CB 1.427 31.837 30.300 0.184 0.000 1.250 3231 R HN 0.528 nan 8.270 nan 0.000 0.465 3232 T N -1.182 113.413 114.554 0.069 0.000 2.550 3232 T HA 0.189 4.539 4.350 -0.001 0.000 0.256 3232 T C 0.490 175.206 174.700 0.026 0.000 0.866 3232 T CA -0.322 61.802 62.100 0.041 0.000 1.163 3232 T CB 1.402 70.287 68.868 0.028 0.000 1.460 3232 T HN 0.641 nan 8.240 nan 0.000 0.498 3233 Q N 0.116 119.905 119.800 -0.019 0.000 2.079 3233 Q HA -0.031 4.309 4.340 -0.001 0.000 0.200 3233 Q C -0.061 175.902 176.000 -0.062 0.000 0.974 3233 Q CA 1.364 57.135 55.803 -0.053 0.000 0.840 3233 Q CB 0.044 28.727 28.738 -0.091 0.000 0.898 3233 Q HN 0.615 nan 8.270 nan 0.000 0.430 3234 E N -0.256 119.881 120.200 -0.106 0.000 2.971 3234 E HA -0.178 4.172 4.350 -0.001 0.000 0.278 3234 E C -0.375 176.003 176.600 -0.370 0.000 1.009 3234 E CA 1.175 57.513 56.400 -0.104 0.000 0.862 3234 E CB -2.178 27.629 29.700 0.178 0.000 1.436 3234 E HN 0.468 nan 8.360 nan 0.000 0.434 3235 S N -1.518 113.787 115.700 -0.659 0.000 2.727 3235 S HA 0.479 4.949 4.470 -0.001 0.000 0.278 3235 S C -0.285 173.886 174.600 -0.716 0.000 1.186 3235 S CA -0.661 57.035 58.200 -0.840 0.000 0.836 3235 S CB 1.987 65.161 63.200 -0.043 0.000 1.186 3235 S HN 0.228 nan 8.310 nan 0.000 0.499 3236 E N 0.019 120.042 120.200 -0.296 0.000 2.398 3236 E HA 0.400 4.750 4.350 -0.001 0.000 0.263 3236 E C 0.511 177.098 176.600 -0.020 0.000 1.046 3236 E CA -0.840 55.508 56.400 -0.087 0.000 0.908 3236 E CB 0.106 29.869 29.700 0.104 0.000 0.963 3236 E HN 0.830 nan 8.360 nan 0.000 0.431 3237 c N 1.668 120.264 118.600 -0.008 0.000 2.480 3237 c HA 0.744 5.314 4.570 -0.001 0.000 0.344 3237 c C 0.208 174.338 174.090 0.067 0.000 1.380 3237 c CA -0.909 55.433 56.329 0.021 0.000 2.386 3237 c CB 0.107 42.625 42.510 0.012 0.000 2.210 3237 c HN 0.596 nan 8.230 nan 0.000 0.640 3238 V N -0.123 119.809 119.914 0.030 0.000 2.789 3238 V HA 0.552 4.672 4.120 -0.001 0.000 0.311 3238 V C -0.215 175.859 176.094 -0.034 0.000 1.073 3238 V CA -0.221 62.064 62.300 -0.025 0.000 0.921 3238 V CB 1.386 33.165 31.823 -0.073 0.000 1.009 3238 V HN 1.206 nan 8.190 nan 0.000 0.426 3239 c N 3.060 121.619 118.600 -0.068 0.000 2.529 3239 c HA 0.716 5.286 4.570 -0.001 0.000 0.329 3239 c C -0.363 173.720 174.090 -0.011 0.000 1.194 3239 c CA -0.591 55.735 56.329 -0.005 0.000 1.779 3239 c CB 1.104 43.652 42.510 0.063 0.000 2.322 3239 c HN 1.004 nan 8.230 nan 0.000 0.500 3240 H N 1.293 120.313 119.070 -0.082 0.000 3.108 3240 H HA 0.231 4.787 4.556 -0.000 0.000 0.329 3240 H C -0.497 174.783 175.328 -0.080 0.000 0.978 3240 H CA -0.189 55.820 56.048 -0.065 0.000 1.413 3240 H CB 0.556 30.290 29.762 -0.045 0.000 1.670 3240 H HN 0.900 nan 8.280 nan 0.000 0.512 3241 K N 3.409 123.532 120.400 -0.461 0.000 3.071 3241 K HA -0.229 4.091 4.320 -0.001 0.000 0.265 3241 K C 0.907 177.144 176.600 -0.606 0.000 1.060 3241 K CA 0.894 56.966 56.287 -0.358 0.000 0.767 3241 K CB -1.484 30.835 32.500 -0.302 0.000 1.241 3241 K HN 1.070 nan 8.250 nan 0.000 0.486 3242 G N -1.414 106.886 108.800 -0.833 0.000 2.184 3242 G HA2 -0.333 3.627 3.960 -0.001 0.000 0.264 3242 G HA3 -0.333 3.627 3.960 -0.001 0.000 0.264 3242 G C 0.179 174.820 174.900 -0.433 0.000 0.975 3242 G CA 0.214 44.643 45.100 -1.118 0.000 0.642 3242 G HN 0.282 nan 8.290 nan 0.000 0.536 3243 V N 0.967 120.752 119.914 -0.215 0.000 2.383 3243 V HA 0.474 4.593 4.120 -0.001 0.000 0.275 3243 V C 0.481 176.600 176.094 0.042 0.000 1.036 3243 V CA -0.416 61.862 62.300 -0.035 0.000 0.889 3243 V CB 1.440 33.285 31.823 0.037 0.000 0.985 3243 V HN 0.391 nan 8.190 nan 0.000 0.459 3244 c N 7.886 126.535 118.600 0.081 0.000 2.301 3244 c HA 0.470 5.040 4.570 -0.001 0.000 0.313 3244 c C -2.327 171.814 174.090 0.085 0.000 1.121 3244 c CA -1.463 54.922 56.329 0.093 0.000 1.507 3244 c CB 0.448 43.030 42.510 0.121 0.000 1.975 3244 c HN 0.624 nan 8.230 nan 0.000 0.425 3245 P HA 0.453 nan 4.420 nan 0.000 0.277 3245 P C -0.765 176.458 177.300 -0.127 0.000 1.240 3245 P CA -0.126 62.818 63.100 -0.259 0.000 0.798 3245 P CB 0.872 32.303 31.700 -0.447 0.000 0.979 3246 V N 2.739 122.567 119.914 -0.143 0.000 2.638 3246 V HA 0.244 4.364 4.120 -0.001 0.000 0.306 3246 V C -0.212 175.827 176.094 -0.092 0.000 1.052 3246 V CA -0.790 61.496 62.300 -0.024 0.000 0.885 3246 V CB 2.384 34.317 31.823 0.183 0.000 0.999 3246 V HN 0.204 nan 8.190 nan 0.000 0.424 3247 V N 6.132 125.999 119.914 -0.077 0.000 2.406 3247 V HA 0.524 4.644 4.120 -0.001 0.000 0.272 3247 V C 0.065 176.168 176.094 0.015 0.000 1.043 3247 V CA -0.080 62.178 62.300 -0.069 0.000 0.915 3247 V CB 1.009 32.774 31.823 -0.096 0.000 0.988 3247 V HN 0.828 nan 8.190 nan 0.000 0.466 3248 M N 3.660 123.308 119.600 0.080 0.000 2.518 3248 M HA 0.605 5.085 4.480 -0.001 0.000 0.300 3248 M C -0.594 175.849 176.300 0.237 0.000 1.175 3248 M CA -0.348 55.059 55.300 0.179 0.000 0.890 3248 M CB 2.744 35.554 32.600 0.351 0.000 1.710 3248 M HN 0.516 nan 8.290 nan 0.000 0.453 3249 T N 0.374 115.019 114.554 0.151 0.000 2.900 3249 T HA 0.553 4.902 4.350 -0.001 0.000 0.295 3249 T C -1.691 173.002 174.700 -0.011 0.000 1.044 3249 T CA -0.554 61.621 62.100 0.126 0.000 0.995 3249 T CB 2.040 70.905 68.868 -0.006 0.000 1.072 3249 T HN 0.608 nan 8.240 nan 0.000 0.473 3250 D N 0.067 120.453 120.400 -0.022 0.000 2.970 3250 D HA 0.627 5.267 4.640 -0.001 0.000 0.230 3250 D C -0.156 176.109 176.300 -0.058 0.000 1.276 3250 D CA 0.442 54.292 54.000 -0.249 0.000 0.910 3250 D CB 1.524 41.760 40.800 -0.941 0.000 1.590 3250 D HN 1.001 nan 8.370 nan 0.000 0.551 3251 G N 2.635 111.400 108.800 -0.057 0.000 2.353 3251 G HA2 0.071 4.030 3.960 -0.001 0.000 0.424 3251 G HA3 0.071 4.030 3.960 -0.001 0.000 0.424 3251 G C -2.932 171.963 174.900 -0.007 0.000 1.320 3251 G CA -1.054 44.036 45.100 -0.018 0.000 0.995 3251 G HN 0.405 nan 8.290 nan 0.000 0.580 3252 P HA 0.327 nan 4.420 nan 0.000 0.264 3252 P C 0.990 178.327 177.300 0.062 0.000 1.179 3252 P CA 0.942 64.026 63.100 -0.028 0.000 0.763 3252 P CB 0.784 32.413 31.700 -0.118 0.000 0.806 3253 A N 3.538 126.377 122.820 0.031 0.000 2.014 3253 A HA -0.143 4.176 4.320 -0.001 0.000 0.218 3253 A C 1.259 178.791 177.584 -0.086 0.000 1.163 3253 A CA 1.476 53.545 52.037 0.053 0.000 0.652 3253 A CB -0.793 18.225 19.000 0.029 0.000 0.808 3253 A HN 0.694 nan 8.150 nan 0.000 0.449 3254 N N -0.987 117.637 118.700 -0.125 0.000 2.282 3254 N HA 0.133 4.873 4.740 -0.001 0.000 0.240 3254 N C -0.459 174.847 175.510 -0.340 0.000 1.182 3254 N CA -0.232 52.746 53.050 -0.121 0.000 0.874 3254 N CB -0.101 38.372 38.487 -0.023 0.000 1.126 3254 N HN 0.331 nan 8.380 nan 0.000 0.516 3255 N N 0.261 118.510 118.700 -0.751 0.000 3.261 3255 N HA 0.173 4.913 4.740 -0.001 0.000 0.248 3255 N C -1.426 173.316 175.510 -1.280 0.000 1.498 3255 N CA -0.530 51.671 53.050 -1.415 0.000 0.884 3255 N CB 1.849 39.955 38.487 -0.635 0.000 1.428 3255 N HN 0.030 nan 8.380 nan 0.000 0.517 3256 R N 0.682 120.315 120.500 -1.446 0.000 2.504 3256 R HA 0.275 4.615 4.340 -0.001 0.000 0.291 3256 R C -0.310 175.870 176.300 -0.200 0.000 0.974 3256 R CA 0.521 56.263 56.100 -0.596 0.000 1.077 3256 R CB -0.066 30.029 30.300 -0.342 0.000 0.926 3256 R HN 0.507 nan 8.270 nan 0.000 0.407 3257 A N 3.009 125.811 122.820 -0.030 0.000 2.389 3257 A HA 0.748 5.068 4.320 -0.001 0.000 0.293 3257 A C -1.113 176.493 177.584 0.037 0.000 1.186 3257 A CA -0.476 51.557 52.037 -0.006 0.000 0.828 3257 A CB 1.678 20.663 19.000 -0.025 0.000 1.369 3257 A HN 0.760 nan 8.150 nan 0.000 0.446 3258 A N 0.870 123.760 122.820 0.117 0.000 2.444 3258 A HA 0.584 4.904 4.320 -0.001 0.000 0.332 3258 A C 0.130 177.896 177.584 0.304 0.000 1.430 3258 A CA -0.196 51.962 52.037 0.202 0.000 0.975 3258 A CB -0.769 18.411 19.000 0.301 0.000 1.147 3258 A HN 0.665 nan 8.150 nan 0.000 0.524 3259 T N 2.922 117.546 114.554 0.117 0.000 2.897 3259 T HA 0.373 4.723 4.350 -0.001 0.000 0.294 3259 T C 0.097 174.777 174.700 -0.033 0.000 1.004 3259 T CA 0.091 62.240 62.100 0.081 0.000 1.106 3259 T CB 0.561 69.418 68.868 -0.018 0.000 0.949 3259 T HN 0.631 nan 8.240 nan 0.000 0.520 3260 K N 2.214 122.580 120.400 -0.055 0.000 2.385 3260 K HA 0.579 4.899 4.320 -0.001 0.000 0.248 3260 K C -0.809 175.665 176.600 -0.210 0.000 0.955 3260 K CA -0.886 55.257 56.287 -0.240 0.000 0.816 3260 K CB 2.299 34.471 32.500 -0.546 0.000 1.250 3260 K HN 0.440 nan 8.250 nan 0.000 0.434 3261 I N 3.777 124.180 120.570 -0.277 0.000 2.330 3261 I HA 0.328 4.498 4.170 -0.001 0.000 0.289 3261 I C -0.195 175.686 176.117 -0.394 0.000 1.001 3261 I CA -0.675 60.405 61.300 -0.367 0.000 1.193 3261 I CB 0.776 38.491 38.000 -0.475 0.000 1.345 3261 I HN 0.390 nan 8.210 nan 0.000 0.461 3262 I N 6.439 126.755 120.570 -0.423 0.000 2.336 3262 I HA 0.247 4.417 4.170 -0.001 0.000 0.292 3262 I C -0.901 174.781 176.117 -0.726 0.000 0.991 3262 I CA -0.711 60.288 61.300 -0.502 0.000 1.227 3262 I CB 0.963 38.690 38.000 -0.456 0.000 1.366 3262 I HN 0.388 nan 8.210 nan 0.000 0.466 3263 Y N 5.949 125.966 120.300 -0.472 0.000 2.385 3263 Y HA 0.431 4.981 4.550 -0.001 0.000 0.341 3263 Y C -0.235 175.399 175.900 -0.443 0.000 0.965 3263 Y CA -0.452 57.449 58.100 -0.331 0.000 1.180 3263 Y CB 0.593 38.939 38.460 -0.190 0.000 1.139 3263 Y HN 0.323 nan 8.280 nan 0.000 0.502 3264 F N 2.605 122.572 119.950 0.029 0.000 2.425 3264 F HA 0.566 5.093 4.527 -0.000 0.000 0.331 3264 F C 0.137 175.896 175.800 -0.068 0.000 1.085 3264 F CA -1.009 56.978 58.000 -0.022 0.000 1.028 3264 F CB 1.668 40.648 39.000 -0.033 0.000 1.177 3264 F HN 0.197 nan 8.300 nan 0.000 0.487 3265 K N 2.259 122.711 120.400 0.086 0.000 2.695 3265 K HA 0.214 4.534 4.320 -0.001 0.000 0.255 3265 K C -0.922 175.545 176.600 -0.222 0.000 1.016 3265 K CA -0.318 55.908 56.287 -0.100 0.000 0.928 3265 K CB 0.726 33.156 32.500 -0.117 0.000 1.235 3265 K HN 0.810 nan 8.250 nan 0.000 0.467 3266 E N 2.122 121.993 120.200 -0.549 0.000 2.694 3266 E HA -0.243 4.107 4.350 -0.001 0.000 0.272 3266 E C 0.534 176.745 176.600 -0.648 0.000 1.040 3266 E CA 0.773 56.445 56.400 -1.214 0.000 0.809 3266 E CB -1.391 27.939 29.700 -0.617 0.000 1.389 3266 E HN 1.169 nan 8.360 nan 0.000 0.413 3267 G N -0.292 108.316 108.800 -0.320 0.000 2.225 3267 G HA2 -0.368 3.592 3.960 -0.001 0.000 0.254 3267 G HA3 -0.368 3.592 3.960 -0.001 0.000 0.254 3267 G C 0.236 175.195 174.900 0.099 0.000 0.988 3267 G CA 0.660 45.715 45.100 -0.074 0.000 0.625 3267 G HN 0.236 nan 8.290 nan 0.000 0.527 3268 K N 0.264 120.719 120.400 0.093 0.000 2.143 3268 K HA 0.644 4.964 4.320 -0.001 0.000 0.272 3268 K C 0.285 176.985 176.600 0.167 0.000 1.001 3268 K CA -0.735 55.624 56.287 0.121 0.000 0.915 3268 K CB 1.612 34.127 32.500 0.025 0.000 1.047 3268 K HN 0.229 nan 8.250 nan 0.000 0.458 3269 I N 3.404 124.022 120.570 0.080 0.000 2.416 3269 I HA -0.059 4.110 4.170 -0.001 0.000 0.288 3269 I C 1.212 177.276 176.117 -0.087 0.000 1.051 3269 I CA -0.063 61.169 61.300 -0.113 0.000 1.375 3269 I CB 1.002 38.932 38.000 -0.116 0.000 1.407 3269 I HN 0.543 nan 8.210 nan 0.000 0.516 3270 Q N 4.933 124.667 119.800 -0.111 0.000 2.324 3270 Q HA 0.237 4.577 4.340 -0.001 0.000 0.207 3270 Q C 0.349 176.297 176.000 -0.087 0.000 0.928 3270 Q CA 0.787 56.545 55.803 -0.075 0.000 0.890 3270 Q CB 0.617 29.320 28.738 -0.059 0.000 1.001 3270 Q HN 0.568 nan 8.270 nan 0.000 0.517 3271 K N -0.254 120.101 120.400 -0.075 0.000 2.575 3271 K HA 0.512 4.832 4.320 -0.001 0.000 0.279 3271 K C -1.658 174.941 176.600 -0.002 0.000 0.969 3271 K CA -0.438 55.812 56.287 -0.061 0.000 0.868 3271 K CB 1.639 34.047 32.500 -0.153 0.000 1.457 3271 K HN -0.067 nan 8.250 nan 0.000 0.426 3272 I N 2.302 122.850 120.570 -0.037 0.000 2.498 3272 I HA 0.327 4.496 4.170 -0.001 0.000 0.290 3272 I C -0.803 175.291 176.117 -0.039 0.000 1.032 3272 I CA -0.658 60.596 61.300 -0.076 0.000 1.073 3272 I CB 2.174 40.074 38.000 -0.167 0.000 1.251 3272 I HN 0.519 nan 8.210 nan 0.000 0.426 3273 E N 4.987 125.183 120.200 -0.008 0.000 2.238 3273 E HA 0.421 4.771 4.350 -0.001 0.000 0.267 3273 E C -1.183 175.379 176.600 -0.064 0.000 0.887 3273 E CA -0.881 55.533 56.400 0.023 0.000 0.769 3273 E CB 2.493 32.311 29.700 0.197 0.000 1.187 3273 E HN 0.490 nan 8.360 nan 0.000 0.416 3274 E N 1.172 121.344 120.200 -0.047 0.000 2.349 3274 E HA 0.146 4.496 4.350 -0.001 0.000 0.265 3274 E C -0.458 176.165 176.600 0.038 0.000 1.064 3274 E CA -0.633 55.723 56.400 -0.073 0.000 0.886 3274 E CB 0.942 30.601 29.700 -0.069 0.000 1.036 3274 E HN 0.217 nan 8.360 nan 0.000 0.413 3275 L N 2.118 123.340 121.223 -0.002 0.000 2.499 3275 L HA 0.215 4.555 4.340 -0.001 0.000 0.273 3275 L C -0.585 176.402 176.870 0.195 0.000 1.195 3275 L CA 0.605 55.501 54.840 0.093 0.000 0.882 3275 L CB 0.214 42.276 42.059 0.006 0.000 1.133 3275 L HN 0.581 nan 8.230 nan 0.000 0.483 3276 A N 3.429 126.467 122.820 0.365 0.000 2.387 3276 A HA 0.942 5.262 4.320 -0.001 0.000 0.303 3276 A C 0.359 177.980 177.584 0.062 0.000 1.145 3276 A CA -0.053 52.043 52.037 0.098 0.000 0.801 3276 A CB 0.722 19.683 19.000 -0.063 0.000 1.342 3276 A HN 1.730 nan 8.150 nan 0.000 0.440 3277 G N 0.262 109.071 108.800 0.015 0.000 2.542 3277 G HA2 -0.198 3.762 3.960 -0.001 0.000 0.235 3277 G HA3 -0.198 3.762 3.960 -0.001 0.000 0.235 3277 G C 0.161 175.090 174.900 0.049 0.000 1.286 3277 G CA 0.338 45.449 45.100 0.018 0.000 0.904 3277 G HN 0.901 nan 8.290 nan 0.000 0.577 3278 N N 1.110 119.841 118.700 0.051 0.000 2.373 3278 N HA 0.368 5.108 4.740 -0.001 0.000 0.181 3278 N C 1.170 176.761 175.510 0.134 0.000 1.082 3278 N CA 0.991 54.101 53.050 0.101 0.000 0.885 3278 N CB 0.090 38.648 38.487 0.119 0.000 0.977 3278 N HN 1.114 nan 8.380 nan 0.000 0.462 3279 A N 0.911 123.713 122.820 -0.029 0.000 2.492 3279 A HA 0.065 4.385 4.320 -0.001 0.000 0.254 3279 A C 1.063 178.704 177.584 0.095 0.000 1.091 3279 A CA -0.011 51.916 52.037 -0.183 0.000 0.768 3279 A CB 0.290 19.131 19.000 -0.266 0.000 1.028 3279 A HN 0.218 nan 8.150 nan 0.000 0.498 3280 Q N 0.140 120.106 119.800 0.277 0.000 2.354 3280 Q HA 0.043 4.383 4.340 -0.001 0.000 0.203 3280 Q C -0.197 176.122 176.000 0.532 0.000 0.933 3280 Q CA 0.844 56.885 55.803 0.397 0.000 0.901 3280 Q CB 0.241 29.188 28.738 0.348 0.000 1.007 3280 Q HN 0.906 nan 8.270 nan 0.000 0.495 3281 H N -0.947 118.295 119.070 0.288 0.000 3.085 3281 H HA 0.383 4.939 4.556 -0.001 0.000 0.356 3281 H C -1.789 173.610 175.328 0.119 0.000 1.178 3281 H CA -0.620 55.573 56.048 0.241 0.000 1.214 3281 H CB 1.171 31.154 29.762 0.367 0.000 1.881 3281 H HN -0.125 nan 8.280 nan 0.000 0.538 3282 I N 3.844 124.278 120.570 -0.227 0.000 2.534 3282 I HA 0.330 4.500 4.170 -0.001 0.000 0.288 3282 I C -0.718 175.302 176.117 -0.161 0.000 1.077 3282 I CA -0.382 60.845 61.300 -0.122 0.000 1.051 3282 I CB 1.766 39.705 38.000 -0.101 0.000 1.234 3282 I HN 0.728 nan 8.210 nan 0.000 0.425 3283 E N 4.035 124.214 120.200 -0.035 0.000 2.413 3283 E HA 0.351 4.700 4.350 -0.001 0.000 0.277 3283 E C -0.937 175.661 176.600 -0.003 0.000 0.958 3283 E CA -0.809 55.587 56.400 -0.006 0.000 0.779 3283 E CB 2.166 31.907 29.700 0.068 0.000 1.278 3283 E HN 0.450 nan 8.360 nan 0.000 0.456 3284 E N 0.067 120.268 120.200 0.002 0.000 2.228 3284 E HA -0.224 4.126 4.350 -0.001 0.000 0.213 3284 E C -0.908 175.670 176.600 -0.036 0.000 1.282 3284 E CA 0.021 56.411 56.400 -0.016 0.000 0.707 3284 E CB -1.548 28.118 29.700 -0.057 0.000 1.150 3284 E HN 0.335 nan 8.360 nan 0.000 0.362 3285 c N 1.462 120.043 118.600 -0.033 0.000 2.648 3285 c HA 0.162 4.731 4.570 -0.001 0.000 0.415 3285 c C 1.122 175.200 174.090 -0.020 0.000 1.366 3285 c CA -0.287 56.022 56.329 -0.033 0.000 1.756 3285 c CB 0.214 42.695 42.510 -0.049 0.000 2.549 3285 c HN 0.343 nan 8.230 nan 0.000 0.597 3286 S N 2.560 118.265 115.700 0.008 0.000 2.422 3286 S HA 0.433 4.903 4.470 -0.001 0.000 0.308 3286 S C -0.303 174.330 174.600 0.055 0.000 1.097 3286 S CA -0.499 57.729 58.200 0.047 0.000 1.099 3286 S CB 0.326 63.582 63.200 0.094 0.000 0.976 3286 S HN 0.836 nan 8.310 nan 0.000 0.471 3287 c N 3.571 122.211 118.600 0.067 0.000 2.561 3287 c HA 0.866 5.436 4.570 -0.001 0.000 0.319 3287 c C -0.496 173.696 174.090 0.170 0.000 1.198 3287 c CA -1.062 55.289 56.329 0.037 0.000 1.665 3287 c CB -0.058 42.440 42.510 -0.020 0.000 2.258 3287 c HN 0.957 nan 8.230 nan 0.000 0.493 3288 Y N -0.427 119.941 120.300 0.113 0.000 2.588 3288 Y HA 0.820 5.370 4.550 -0.001 0.000 0.343 3288 Y C -0.252 175.780 175.900 0.221 0.000 1.065 3288 Y CA -0.883 57.369 58.100 0.254 0.000 1.038 3288 Y CB 1.072 39.761 38.460 0.381 0.000 1.297 3288 Y HN 0.826 nan 8.280 nan 0.000 0.467 3289 G N 0.575 109.571 108.800 0.326 0.000 2.448 3289 G HA2 0.790 4.749 3.960 -0.001 0.000 0.324 3289 G HA3 0.790 4.749 3.960 -0.001 0.000 0.324 3289 G C -1.728 173.461 174.900 0.481 0.000 1.203 3289 G CA -0.651 44.555 45.100 0.177 0.000 0.954 3289 G HN 1.304 nan 8.290 nan 0.000 0.480 3290 A N 0.259 123.329 122.820 0.417 0.000 2.547 3290 A HA 0.756 5.076 4.320 -0.001 0.000 0.297 3290 A C 0.566 178.325 177.584 0.292 0.000 1.056 3290 A CA 0.247 52.595 52.037 0.518 0.000 0.688 3290 A CB 1.096 20.410 19.000 0.523 0.000 1.282 3290 A HN 2.543 nan 8.150 nan 0.000 0.400 3291 G N 0.667 109.610 108.800 0.238 0.000 2.395 3291 G HA2 0.187 4.146 3.960 -0.001 0.000 0.292 3291 G HA3 0.187 4.146 3.960 -0.001 0.000 0.292 3291 G C 1.726 176.671 174.900 0.076 0.000 0.953 3291 G CA 1.690 46.866 45.100 0.126 0.000 1.207 3291 G HN 2.901 nan 8.290 nan 0.000 0.503 3292 G N -3.119 105.714 108.800 0.055 0.000 2.168 3292 G HA2 -0.033 3.926 3.960 -0.001 0.000 0.263 3292 G HA3 -0.033 3.926 3.960 -0.001 0.000 0.263 3292 G C 0.357 175.157 174.900 -0.166 0.000 0.977 3292 G CA 0.788 45.813 45.100 -0.126 0.000 0.659 3292 G HN 1.782 nan 8.290 nan 0.000 0.533 3293 V N 0.857 120.734 119.914 -0.063 0.000 2.735 3293 V HA 0.691 4.811 4.120 -0.001 0.000 0.310 3293 V C 0.291 176.342 176.094 -0.071 0.000 1.061 3293 V CA -0.985 61.279 62.300 -0.061 0.000 0.913 3293 V CB 2.131 33.943 31.823 -0.018 0.000 1.005 3293 V HN 0.265 nan 8.190 nan 0.000 0.428 3294 I N 3.663 124.172 120.570 -0.103 0.000 2.354 3294 I HA 0.480 4.650 4.170 -0.001 0.000 0.292 3294 I C -0.073 175.917 176.117 -0.211 0.000 0.989 3294 I CA -0.546 60.657 61.300 -0.161 0.000 1.188 3294 I CB 1.527 39.461 38.000 -0.109 0.000 1.342 3294 I HN 0.481 nan 8.210 nan 0.000 0.457 3295 K N 5.321 125.473 120.400 -0.413 0.000 2.244 3295 K HA 0.564 4.883 4.320 -0.001 0.000 0.260 3295 K C -1.412 175.020 176.600 -0.280 0.000 0.951 3295 K CA -0.579 55.501 56.287 -0.345 0.000 0.826 3295 K CB 2.042 34.322 32.500 -0.368 0.000 1.108 3295 K HN 0.563 nan 8.250 nan 0.000 0.433 3296 c N 3.881 122.399 118.600 -0.138 0.000 2.322 3296 c HA 0.487 5.057 4.570 -0.001 0.000 0.324 3296 c C -0.222 173.837 174.090 -0.052 0.000 1.284 3296 c CA -0.931 55.347 56.329 -0.084 0.000 1.606 3296 c CB -0.467 41.994 42.510 -0.083 0.000 2.251 3296 c HN 0.649 nan 8.230 nan 0.000 0.502 3297 I N 3.392 123.951 120.570 -0.019 0.000 2.330 3297 I HA 0.431 4.601 4.170 -0.001 0.000 0.289 3297 I C 0.296 176.405 176.117 -0.014 0.000 1.001 3297 I CA 0.500 61.793 61.300 -0.012 0.000 1.193 3297 I CB 0.481 38.483 38.000 0.004 0.000 1.345 3297 I HN 0.708 nan 8.210 nan 0.000 0.461 3298 c N 4.457 123.039 118.600 -0.029 0.000 2.967 3298 c HA 0.678 5.248 4.570 -0.001 0.000 0.372 3298 c C 0.209 174.295 174.090 -0.007 0.000 1.455 3298 c CA -1.051 55.262 56.329 -0.027 0.000 1.638 3298 c CB 2.003 44.486 42.510 -0.045 0.000 2.096 3298 c HN 0.712 nan 8.230 nan 0.000 0.466 3299 R N 1.288 121.794 120.500 0.011 0.000 2.387 3299 R HA 0.381 4.721 4.340 -0.001 0.000 0.314 3299 R C -1.575 174.812 176.300 0.146 0.000 0.958 3299 R CA -0.039 56.093 56.100 0.054 0.000 0.846 3299 R CB 0.923 31.234 30.300 0.018 0.000 1.147 3299 R HN 0.854 nan 8.270 nan 0.000 0.447 3300 D N 3.199 123.714 120.400 0.192 0.000 2.359 3300 D HA 0.071 4.711 4.640 -0.001 0.000 0.230 3300 D C -0.135 176.317 176.300 0.254 0.000 1.118 3300 D CA -0.242 53.947 54.000 0.314 0.000 0.844 3300 D CB 1.311 42.314 40.800 0.338 0.000 1.059 3300 D HN 0.645 nan 8.370 nan 0.000 0.493 3301 N N 3.098 121.963 118.700 0.275 0.000 2.299 3301 N HA 0.045 4.784 4.740 -0.001 0.000 0.187 3301 N C 0.717 176.206 175.510 -0.034 0.000 1.099 3301 N CA -0.022 53.072 53.050 0.073 0.000 0.867 3301 N CB 0.171 38.722 38.487 0.108 0.000 0.974 3301 N HN 0.485 nan 8.380 nan 0.000 0.477 3302 W N 0.651 121.740 121.300 -0.351 0.000 2.633 3302 W HA 0.312 4.972 4.660 -0.000 0.000 0.295 3302 W C 1.293 177.753 176.519 -0.098 0.000 1.133 3302 W CA 1.206 58.374 57.345 -0.295 0.000 1.490 3302 W CB -0.020 29.239 29.460 -0.335 0.000 1.127 3302 W HN -0.171 nan 8.180 nan 0.000 0.538 3303 K N -1.108 119.252 120.400 -0.066 0.000 2.431 3303 K HA 0.285 4.605 4.320 -0.001 0.000 0.213 3303 K C 1.053 177.593 176.600 -0.100 0.000 1.258 3303 K CA 0.490 56.639 56.287 -0.229 0.000 0.845 3303 K CB -0.456 31.764 32.500 -0.467 0.000 1.498 3303 K HN -0.104 nan 8.250 nan 0.000 0.451 3304 G N 0.578 109.362 108.800 -0.026 0.000 2.406 3304 G HA2 0.298 4.258 3.960 -0.001 0.000 0.251 3304 G HA3 0.298 4.258 3.960 -0.001 0.000 0.251 3304 G C 0.521 175.431 174.900 0.016 0.000 1.271 3304 G CA 0.102 45.174 45.100 -0.046 0.000 0.859 3304 G HN 0.334 nan 8.290 nan 0.000 0.540 3305 A N 2.655 125.461 122.820 -0.023 0.000 2.208 3305 A HA 0.086 4.405 4.320 -0.001 0.000 0.209 3305 A C 1.336 178.926 177.584 0.009 0.000 1.161 3305 A CA 0.152 52.188 52.037 -0.002 0.000 0.782 3305 A CB -0.409 18.579 19.000 -0.019 0.000 0.816 3305 A HN 0.742 nan 8.150 nan 0.000 0.477 3306 N N 0.470 119.174 118.700 0.006 0.000 2.483 3306 N HA 0.227 4.967 4.740 -0.001 0.000 0.269 3306 N C -0.519 175.105 175.510 0.189 0.000 1.209 3306 N CA -0.317 52.773 53.050 0.067 0.000 0.969 3306 N CB 0.386 38.897 38.487 0.040 0.000 1.173 3306 N HN 0.196 nan 8.380 nan 0.000 0.475 3307 R N 0.293 120.885 120.500 0.153 0.000 2.349 3307 R HA 0.387 4.726 4.340 -0.001 0.000 0.299 3307 R C -2.199 174.161 176.300 0.099 0.000 1.027 3307 R CA -1.628 54.545 56.100 0.122 0.000 0.958 3307 R CB 0.838 31.157 30.300 0.030 0.000 1.047 3307 R HN 0.502 nan 8.270 nan 0.000 0.468 3308 P HA 0.035 nan 4.420 nan 0.000 0.269 3308 P C -0.709 176.495 177.300 -0.159 0.000 1.215 3308 P CA -0.154 62.737 63.100 -0.347 0.000 0.780 3308 P CB 0.699 32.145 31.700 -0.423 0.000 0.898 3309 V N 3.964 123.784 119.914 -0.156 0.000 2.483 3309 V HA 0.366 4.486 4.120 -0.001 0.000 0.297 3309 V C 0.243 176.295 176.094 -0.070 0.000 1.027 3309 V CA -0.477 61.777 62.300 -0.077 0.000 0.855 3309 V CB 1.507 33.312 31.823 -0.029 0.000 0.995 3309 V HN 0.378 nan 8.190 nan 0.000 0.424 3310 I N 3.645 124.181 120.570 -0.056 0.000 2.336 3310 I HA 0.420 4.589 4.170 -0.001 0.000 0.292 3310 I C 0.127 176.234 176.117 -0.017 0.000 0.991 3310 I CA -0.111 61.176 61.300 -0.021 0.000 1.227 3310 I CB 1.906 39.877 38.000 -0.049 0.000 1.366 3310 I HN 0.514 nan 8.210 nan 0.000 0.466 3311 T N 7.305 121.870 114.554 0.019 0.000 2.758 3311 T HA 0.581 4.931 4.350 -0.001 0.000 0.285 3311 T C -0.107 174.621 174.700 0.046 0.000 0.981 3311 T CA -0.306 61.797 62.100 0.005 0.000 0.965 3311 T CB 0.852 69.721 68.868 0.000 0.000 0.927 3311 T HN 0.275 nan 8.240 nan 0.000 0.448 3312 I N 2.658 123.240 120.570 0.020 0.000 2.404 3312 I HA 0.299 4.468 4.170 -0.001 0.000 0.293 3312 I C -0.049 176.085 176.117 0.029 0.000 0.992 3312 I CA -0.894 60.446 61.300 0.067 0.000 1.149 3312 I CB 1.602 39.634 38.000 0.054 0.000 1.315 3312 I HN 0.470 nan 8.210 nan 0.000 0.446 3313 D N 8.981 129.409 120.400 0.046 0.000 2.380 3313 D HA 0.180 4.819 4.640 -0.001 0.000 0.230 3313 D C -1.690 174.622 176.300 0.019 0.000 1.154 3313 D CA -2.047 51.950 54.000 -0.006 0.000 0.859 3313 D CB 1.558 42.345 40.800 -0.022 0.000 1.045 3313 D HN 0.266 nan 8.370 nan 0.000 0.495 3314 P HA 0.020 nan 4.420 nan 0.000 0.241 3314 P C 0.676 177.999 177.300 0.038 0.000 1.191 3314 P CA 0.506 63.651 63.100 0.074 0.000 0.771 3314 P CB 0.864 32.589 31.700 0.040 0.000 0.929 3315 E N -0.566 119.623 120.200 -0.018 0.000 2.065 3315 E HA 0.066 4.416 4.350 -0.001 0.000 0.191 3315 E C 1.985 178.546 176.600 -0.065 0.000 0.960 3315 E CA 0.668 57.068 56.400 -0.001 0.000 0.824 3315 E CB -0.286 29.425 29.700 0.019 0.000 0.793 3315 E HN 0.018 nan 8.360 nan 0.000 0.459 3316 M N -0.023 119.529 119.600 -0.080 0.000 2.358 3316 M HA -0.022 4.458 4.480 -0.001 0.000 0.264 3316 M C 0.731 176.904 176.300 -0.211 0.000 1.064 3316 M CA 1.048 56.280 55.300 -0.113 0.000 1.093 3316 M CB -0.641 31.909 32.600 -0.084 0.000 1.401 3316 M HN 0.257 nan 8.290 nan 0.000 0.440 3317 M N 1.261 120.689 119.600 -0.287 0.000 2.347 3317 M HA -0.169 4.311 4.480 -0.001 0.000 0.198 3317 M C -0.204 175.841 176.300 -0.426 0.000 0.549 3317 M CA 0.647 55.523 55.300 -0.706 0.000 0.481 3317 M CB -2.481 29.416 32.600 -1.172 0.000 1.393 3317 M HN 0.399 nan 8.290 nan 0.000 0.905 3318 T N -2.577 111.919 114.554 -0.096 0.000 2.901 3318 T HA 0.914 5.264 4.350 -0.001 0.000 0.293 3318 T C -0.559 174.229 174.700 0.146 0.000 1.084 3318 T CA -0.791 61.323 62.100 0.023 0.000 1.008 3318 T CB 2.769 71.599 68.868 -0.063 0.000 1.170 3318 T HN 0.514 nan 8.240 nan 0.000 0.509 3319 H N -0.798 118.291 119.070 0.033 0.000 2.985 3319 H HA 0.772 5.328 4.556 -0.000 0.000 0.360 3319 H C -1.165 174.161 175.328 -0.004 0.000 1.221 3319 H CA -0.764 55.296 56.048 0.021 0.000 1.121 3319 H CB 1.535 31.315 29.762 0.030 0.000 1.854 3319 H HN 0.984 nan 8.280 nan 0.000 0.551 3320 T N -1.023 113.488 114.554 -0.071 0.000 2.907 3320 T HA 0.640 4.990 4.350 -0.001 0.000 0.290 3320 T C -0.404 174.332 174.700 0.061 0.000 1.066 3320 T CA -0.595 61.454 62.100 -0.085 0.000 1.012 3320 T CB 1.637 70.471 68.868 -0.055 0.000 1.184 3320 T HN 0.960 nan 8.240 nan 0.000 0.522 3321 S N 0.002 115.723 115.700 0.034 0.000 2.541 3321 S HA 0.815 5.285 4.470 -0.001 0.000 0.271 3321 S C -0.941 173.648 174.600 -0.019 0.000 1.133 3321 S CA -0.897 57.312 58.200 0.015 0.000 0.876 3321 S CB 2.053 65.272 63.200 0.031 0.000 1.105 3321 S HN 1.288 nan 8.310 nan 0.000 0.470 3322 K N 0.740 121.108 120.400 -0.054 0.000 2.007 3322 K HA 0.534 4.853 4.320 -0.001 0.000 0.251 3322 K C -1.556 174.965 176.600 -0.131 0.000 0.799 3322 K CA -0.965 55.310 56.287 -0.020 0.000 0.656 3322 K CB 0.311 32.841 32.500 0.051 0.000 1.646 3322 K HN 0.527 nan 8.250 nan 0.000 0.479 3323 Y N 0.576 120.885 120.300 0.014 0.000 2.528 3323 Y HA 0.397 4.946 4.550 -0.000 0.000 0.335 3323 Y C 0.191 176.094 175.900 0.004 0.000 1.093 3323 Y CA -1.062 57.043 58.100 0.009 0.000 1.134 3323 Y CB 1.466 39.927 38.460 0.001 0.000 1.253 3323 Y HN 0.280 nan 8.280 nan 0.000 0.478 3324 L N 1.985 123.302 121.223 0.157 0.000 2.584 3324 L HA -0.145 4.194 4.340 -0.001 0.000 0.272 3324 L C 0.516 177.439 176.870 0.088 0.000 1.195 3324 L CA 0.006 54.900 54.840 0.090 0.000 0.920 3324 L CB 0.349 42.444 42.059 0.061 0.000 1.173 3324 L HN 0.977 nan 8.230 nan 0.000 0.489 3325 c N 1.695 120.329 118.600 0.056 0.000 2.446 3325 c HA -0.076 4.494 4.570 -0.001 0.000 0.279 3325 c C 1.831 175.928 174.090 0.012 0.000 1.366 3325 c CA 0.026 56.376 56.329 0.036 0.000 1.763 3325 c CB -0.582 41.944 42.510 0.026 0.000 1.929 3325 c HN 0.874 nan 8.230 nan 0.000 0.509 3326 S N 1.231 116.934 115.700 0.005 0.000 2.563 3326 S HA 0.005 4.475 4.470 -0.001 0.000 0.284 3326 S C 1.515 176.103 174.600 -0.020 0.000 1.331 3326 S CA -0.161 58.032 58.200 -0.013 0.000 1.047 3326 S CB 0.416 63.603 63.200 -0.022 0.000 0.859 3326 S HN 0.683 nan 8.310 nan 0.000 0.514 3327 K N 2.911 123.294 120.400 -0.028 0.000 2.362 3327 K HA -0.006 4.313 4.320 -0.001 0.000 0.200 3327 K C 0.059 176.637 176.600 -0.038 0.000 1.046 3327 K CA 0.767 57.034 56.287 -0.033 0.000 0.952 3327 K CB -0.252 32.228 32.500 -0.033 0.000 0.753 3327 K HN 0.428 nan 8.250 nan 0.000 0.466 3328 V N 3.748 123.637 119.914 -0.041 0.000 2.381 3328 V HA 0.112 4.232 4.120 -0.001 0.000 0.257 3328 V C 0.294 176.358 176.094 -0.050 0.000 1.057 3328 V CA -0.146 62.124 62.300 -0.049 0.000 1.013 3328 V CB 0.123 31.911 31.823 -0.058 0.000 1.069 3328 V HN 0.196 nan 8.190 nan 0.000 0.484 3329 L N 5.185 126.380 121.223 -0.047 0.000 2.331 3329 L HA 0.335 4.675 4.340 -0.001 0.000 0.278 3329 L C 1.313 178.151 176.870 -0.053 0.000 1.106 3329 L CA -0.013 54.803 54.840 -0.041 0.000 0.824 3329 L CB 1.389 43.426 42.059 -0.037 0.000 1.142 3329 L HN 0.786 nan 8.230 nan 0.000 0.443 3330 T N -3.559 110.964 114.554 -0.051 0.000 3.040 3330 T HA 0.126 4.476 4.350 -0.001 0.000 0.266 3330 T C 0.268 174.939 174.700 -0.048 0.000 1.005 3330 T CA -0.482 61.571 62.100 -0.078 0.000 0.906 3330 T CB 0.155 68.949 68.868 -0.124 0.000 1.082 3330 T HN 0.399 nan 8.240 nan 0.000 0.531 3331 D N 1.452 121.844 120.400 -0.014 0.000 2.432 3331 D HA 0.527 5.166 4.640 -0.001 0.000 0.258 3331 D C -0.512 175.799 176.300 0.019 0.000 1.146 3331 D CA 0.019 54.026 54.000 0.012 0.000 1.015 3331 D CB 1.911 42.730 40.800 0.032 0.000 1.107 3331 D HN 0.119 nan 8.370 nan 0.000 0.529 3332 T N 0.223 114.803 114.554 0.044 0.000 2.900 3332 T HA 0.400 4.749 4.350 -0.001 0.000 0.295 3332 T C -1.010 173.727 174.700 0.062 0.000 1.044 3332 T CA -0.549 61.585 62.100 0.057 0.000 0.995 3332 T CB 1.131 70.053 68.868 0.090 0.000 1.072 3332 T HN 0.400 nan 8.240 nan 0.000 0.473 3333 S N 2.258 117.992 115.700 0.057 0.000 4.483 3333 S HA -0.178 4.292 4.470 -0.001 0.000 0.553 3333 S C 0.084 174.697 174.600 0.023 0.000 0.944 3333 S CA 0.674 58.897 58.200 0.039 0.000 1.234 3333 S CB -0.640 62.584 63.200 0.040 0.000 2.206 3333 S HN 0.901 nan 8.310 nan 0.000 0.355 3334 R N 2.228 122.735 120.500 0.012 0.000 2.680 3334 R HA 0.773 5.113 4.340 -0.001 0.000 0.269 3334 R C -3.457 172.837 176.300 -0.009 0.000 1.026 3334 R CA -2.183 53.914 56.100 -0.004 0.000 0.889 3334 R CB 1.530 31.825 30.300 -0.009 0.000 1.241 3334 R HN 0.327 nan 8.270 nan 0.000 0.463 3335 P HA 0.154 nan 4.420 nan 0.000 0.297 3335 P C -0.859 176.427 177.300 -0.022 0.000 1.307 3335 P CA -0.628 62.460 63.100 -0.020 0.000 0.773 3335 P CB 0.442 32.126 31.700 -0.027 0.000 1.265 3336 N N 0.376 119.064 118.700 -0.021 0.000 2.329 3336 N HA -0.020 4.720 4.740 -0.001 0.000 0.237 3336 N C -0.048 175.445 175.510 -0.029 0.000 1.258 3336 N CA 0.595 53.631 53.050 -0.023 0.000 0.866 3336 N CB -0.543 37.931 38.487 -0.021 0.000 1.102 3336 N HN 0.342 nan 8.380 nan 0.000 0.440 3337 D N 1.761 122.143 120.400 -0.030 0.000 2.450 3337 D HA 0.104 4.743 4.640 -0.001 0.000 0.247 3337 D C -1.540 174.740 176.300 -0.033 0.000 1.162 3337 D CA -0.411 53.569 54.000 -0.034 0.000 0.879 3337 D CB 0.291 41.070 40.800 -0.035 0.000 1.163 3337 D HN 0.350 nan 8.370 nan 0.000 0.472 3338 P HA 0.146 nan 4.420 nan 0.000 0.282 3338 P C 0.578 177.859 177.300 -0.032 0.000 1.287 3338 P CA -0.430 62.649 63.100 -0.035 0.000 0.792 3338 P CB 0.772 32.447 31.700 -0.042 0.000 1.163 3339 T N -0.894 113.642 114.554 -0.030 0.000 2.708 3339 T HA -0.069 4.281 4.350 -0.001 0.000 0.266 3339 T C 0.703 175.387 174.700 -0.028 0.000 1.037 3339 T CA 1.415 63.499 62.100 -0.027 0.000 1.146 3339 T CB -0.569 68.284 68.868 -0.024 0.000 0.865 3339 T HN 0.520 nan 8.240 nan 0.000 0.435 3340 N N -0.094 118.587 118.700 -0.030 0.000 2.272 3340 N HA 0.539 5.279 4.740 -0.001 0.000 0.305 3340 N C 0.096 175.584 175.510 -0.036 0.000 1.103 3340 N CA -0.793 52.239 53.050 -0.030 0.000 0.791 3340 N CB 1.975 40.445 38.487 -0.029 0.000 1.356 3340 N HN 0.224 nan 8.380 nan 0.000 0.486 3341 G N 0.092 108.873 108.800 -0.033 0.000 2.516 3341 G HA2 0.179 4.139 3.960 -0.001 0.000 0.276 3341 G HA3 0.179 4.139 3.960 -0.001 0.000 0.276 3341 G C -0.671 174.205 174.900 -0.041 0.000 1.390 3341 G CA -0.210 44.868 45.100 -0.037 0.000 1.050 3341 G HN 0.663 nan 8.290 nan 0.000 0.519 3342 N N -2.406 116.268 118.700 -0.044 0.000 2.519 3342 N HA 0.194 4.933 4.740 -0.001 0.000 0.291 3342 N C 0.529 176.038 175.510 -0.002 0.000 1.107 3342 N CA -0.814 52.208 53.050 -0.045 0.000 0.904 3342 N CB 1.182 39.608 38.487 -0.101 0.000 1.500 3342 N HN 0.310 nan 8.380 nan 0.000 0.510 3343 c N 1.132 119.749 118.600 0.029 0.000 2.432 3343 c HA 0.022 4.591 4.570 -0.001 0.000 0.280 3343 c C 1.002 175.174 174.090 0.136 0.000 1.353 3343 c CA 0.467 56.843 56.329 0.078 0.000 1.766 3343 c CB -0.537 42.004 42.510 0.050 0.000 1.924 3343 c HN 0.731 nan 8.230 nan 0.000 0.509 3344 D N -0.347 120.110 120.400 0.094 0.000 2.503 3344 D HA 0.396 5.036 4.640 -0.001 0.000 0.218 3344 D C 0.218 176.586 176.300 0.114 0.000 1.183 3344 D CA 0.445 54.521 54.000 0.126 0.000 0.827 3344 D CB 0.770 41.609 40.800 0.066 0.000 1.034 3344 D HN 0.470 nan 8.370 nan 0.000 0.510 3345 A N 1.611 124.413 122.820 -0.029 0.000 2.612 3345 A HA 0.575 4.894 4.320 -0.001 0.000 0.293 3345 A C -2.897 174.270 177.584 -0.695 0.000 1.075 3345 A CA -1.164 50.738 52.037 -0.226 0.000 0.680 3345 A CB 1.913 20.830 19.000 -0.139 0.000 1.279 3345 A HN -0.248 nan 8.150 nan 0.000 0.411 3346 P HA 0.422 nan 4.420 nan 0.000 0.275 3346 P C -0.787 176.254 177.300 -0.431 0.000 1.227 3346 P CA 0.105 62.693 63.100 -0.853 0.000 0.781 3346 P CB 0.624 32.001 31.700 -0.539 0.000 0.906 3347 I N 2.627 122.997 120.570 -0.333 0.000 2.301 3347 I HA 0.151 4.321 4.170 -0.001 0.000 0.292 3347 I C 1.469 177.494 176.117 -0.153 0.000 1.046 3347 I CA 0.022 61.205 61.300 -0.195 0.000 1.282 3347 I CB 0.812 38.728 38.000 -0.139 0.000 1.409 3347 I HN 0.369 nan 8.210 nan 0.000 0.484 3348 T N 2.571 117.041 114.554 -0.141 0.000 2.881 3348 T HA 0.899 5.248 4.350 -0.001 0.000 0.278 3348 T C 0.312 174.965 174.700 -0.079 0.000 0.982 3348 T CA 0.038 62.069 62.100 -0.116 0.000 0.989 3348 T CB 1.806 70.592 68.868 -0.137 0.000 1.058 3348 T HN 1.016 nan 8.240 nan 0.000 0.529 3349 G N -1.109 107.654 108.800 -0.061 0.000 2.373 3349 G HA2 0.501 4.461 3.960 -0.001 0.000 0.634 3349 G HA3 0.501 4.461 3.960 -0.001 0.000 0.634 3349 G C 0.086 174.971 174.900 -0.026 0.000 1.267 3349 G CA -0.009 45.067 45.100 -0.041 0.000 1.008 3349 G HN 2.689 nan 8.290 nan 0.000 0.497 3350 G N -2.060 106.730 108.800 -0.016 0.000 2.690 3350 G HA2 0.520 4.479 3.960 -0.001 0.000 0.686 3350 G HA3 0.520 4.479 3.960 -0.001 0.000 0.686 3350 G C 0.014 174.916 174.900 0.004 0.000 1.277 3350 G CA 1.067 46.164 45.100 -0.004 0.000 0.799 3350 G HN 2.869 nan 8.290 nan 0.000 0.613 3351 S N 0.865 116.572 115.700 0.012 0.000 2.547 3351 S HA 0.855 5.324 4.470 -0.001 0.000 0.270 3351 S C -2.491 172.125 174.600 0.028 0.000 1.150 3351 S CA -0.015 58.196 58.200 0.018 0.000 0.850 3351 S CB 2.569 65.777 63.200 0.012 0.000 1.118 3351 S HN 0.770 nan 8.310 nan 0.000 0.461 3352 P HA 0.385 nan 4.420 nan 0.000 0.267 3352 P C -0.820 176.498 177.300 0.031 0.000 1.289 3352 P CA 0.252 63.368 63.100 0.027 0.000 0.866 3352 P CB 0.016 31.731 31.700 0.025 0.000 1.309 3353 D N 0.870 121.293 120.400 0.039 0.000 2.185 3353 D HA 0.204 4.843 4.640 -0.001 0.000 0.247 3353 D C -1.671 174.658 176.300 0.049 0.000 1.027 3353 D CA -1.682 52.346 54.000 0.047 0.000 0.861 3353 D CB 1.938 42.774 40.800 0.060 0.000 1.202 3353 D HN -0.037 nan 8.370 nan 0.000 0.453 3354 P HA 0.048 nan 4.420 nan 0.000 0.223 3354 P C 0.354 177.693 177.300 0.065 0.000 1.151 3354 P CA 0.564 63.696 63.100 0.054 0.000 0.787 3354 P CB 0.655 32.386 31.700 0.053 0.000 0.788 3355 G N -1.983 106.864 108.800 0.078 0.000 2.411 3355 G HA2 0.424 4.383 3.960 -0.001 0.000 0.295 3355 G HA3 0.424 4.383 3.960 -0.001 0.000 0.295 3355 G C -2.363 172.594 174.900 0.096 0.000 1.542 3355 G CA -0.300 44.849 45.100 0.082 0.000 0.814 3355 G HN 0.043 nan 8.290 nan 0.000 0.557 3356 V N 0.223 120.173 119.914 0.059 0.000 3.049 3356 V HA 0.781 4.900 4.120 -0.001 0.000 0.309 3356 V C -0.104 175.876 176.094 -0.190 0.000 1.148 3356 V CA -1.075 61.236 62.300 0.018 0.000 0.990 3356 V CB 1.951 33.862 31.823 0.147 0.000 1.039 3356 V HN 1.031 nan 8.190 nan 0.000 0.430 3357 K N 3.057 123.060 120.400 -0.663 0.000 2.382 3357 K HA 0.604 4.923 4.320 -0.001 0.000 0.275 3357 K C 0.053 176.531 176.600 -0.203 0.000 1.009 3357 K CA 0.868 56.816 56.287 -0.566 0.000 0.970 3357 K CB 0.791 32.677 32.500 -1.024 0.000 0.934 3357 K HN 1.046 nan 8.250 nan 0.000 0.479 3358 G N 2.166 110.938 108.800 -0.048 0.000 2.706 3358 G HA2 0.645 4.604 3.960 -0.001 0.000 0.307 3358 G HA3 0.645 4.604 3.960 -0.001 0.000 0.307 3358 G C -1.645 173.338 174.900 0.138 0.000 1.307 3358 G CA -0.703 44.454 45.100 0.095 0.000 0.790 3358 G HN 0.673 nan 8.290 nan 0.000 0.503 3359 F N -2.290 117.617 119.950 -0.072 0.000 2.807 3359 F HA 0.901 5.428 4.527 -0.000 0.000 0.316 3359 F C -0.797 174.924 175.800 -0.131 0.000 1.162 3359 F CA -1.006 56.916 58.000 -0.128 0.000 0.910 3359 F CB 1.243 40.126 39.000 -0.195 0.000 1.314 3359 F HN 1.464 nan 8.300 nan 0.000 0.454 3360 A N 1.018 123.659 122.820 -0.298 0.000 2.604 3360 A HA 0.751 5.070 4.320 -0.001 0.000 0.295 3360 A C -2.383 175.103 177.584 -0.163 0.000 1.067 3360 A CA -0.675 51.171 52.037 -0.318 0.000 0.683 3360 A CB 0.956 19.858 19.000 -0.163 0.000 1.281 3360 A HN 0.722 nan 8.150 nan 0.000 0.407 3361 F N 0.676 120.749 119.950 0.205 0.000 2.420 3361 F HA 0.636 5.162 4.527 -0.001 0.000 0.342 3361 F C 0.035 175.962 175.800 0.212 0.000 1.113 3361 F CA -0.315 57.752 58.000 0.113 0.000 1.059 3361 F CB 1.689 40.716 39.000 0.044 0.000 1.128 3361 F HN 0.331 nan 8.300 nan 0.000 0.475 3362 L N 3.620 125.095 121.223 0.420 0.000 2.377 3362 L HA 0.406 4.746 4.340 -0.001 0.000 0.270 3362 L C -0.984 176.062 176.870 0.293 0.000 0.991 3362 L CA -0.313 54.709 54.840 0.303 0.000 0.851 3362 L CB 1.501 43.700 42.059 0.234 0.000 1.218 3362 L HN 0.535 nan 8.230 nan 0.000 0.420 3363 D N 2.791 123.321 120.400 0.217 0.000 3.407 3363 D HA 0.372 5.012 4.640 -0.001 0.000 0.291 3363 D C 0.634 177.004 176.300 0.117 0.000 1.309 3363 D CA 0.660 54.770 54.000 0.184 0.000 0.747 3363 D CB 0.571 41.499 40.800 0.213 0.000 1.343 3363 D HN 0.654 nan 8.370 nan 0.000 0.631 3364 G N 1.482 110.334 108.800 0.087 0.000 2.611 3364 G HA2 -0.436 3.524 3.960 -0.001 0.000 0.301 3364 G HA3 -0.436 3.524 3.960 -0.001 0.000 0.301 3364 G C 1.053 175.971 174.900 0.030 0.000 1.233 3364 G CA 0.506 45.636 45.100 0.051 0.000 0.993 3364 G HN 0.417 nan 8.290 nan 0.000 0.553 3365 E N 0.163 120.372 120.200 0.015 0.000 2.187 3365 E HA -0.156 4.194 4.350 -0.001 0.000 0.199 3365 E C 1.754 178.342 176.600 -0.020 0.000 1.004 3365 E CA 1.278 57.671 56.400 -0.012 0.000 0.813 3365 E CB -0.113 29.581 29.700 -0.010 0.000 0.736 3365 E HN 0.368 nan 8.360 nan 0.000 0.468 3366 N N 0.342 119.065 118.700 0.038 0.000 2.878 3366 N HA 0.029 4.769 4.740 -0.001 0.000 0.282 3366 N C -1.606 174.005 175.510 0.169 0.000 1.284 3366 N CA 0.013 53.123 53.050 0.100 0.000 1.053 3366 N CB 0.222 38.786 38.487 0.127 0.000 1.382 3366 N HN -0.141 nan 8.380 nan 0.000 0.529 3367 S N 0.337 116.055 115.700 0.031 0.000 2.454 3367 S HA 0.497 4.967 4.470 -0.001 0.000 0.306 3367 S C -1.159 173.419 174.600 -0.035 0.000 1.100 3367 S CA -0.561 57.700 58.200 0.102 0.000 1.087 3367 S CB 0.816 64.049 63.200 0.056 0.000 1.019 3367 S HN 0.304 nan 8.310 nan 0.000 0.480 3368 W N 2.725 124.137 121.300 0.187 0.000 2.781 3368 W HA 0.565 5.225 4.660 -0.000 0.000 0.333 3368 W C -1.096 175.428 176.519 0.008 0.000 1.047 3368 W CA -0.574 56.882 57.345 0.185 0.000 1.236 3368 W CB 0.960 30.691 29.460 0.451 0.000 1.394 3368 W HN 0.291 nan 8.180 nan 0.000 0.466 3369 L N 3.836 125.120 121.223 0.102 0.000 2.298 3369 L HA 0.673 5.013 4.340 -0.001 0.000 0.284 3369 L C 0.778 177.471 176.870 -0.296 0.000 1.013 3369 L CA -0.717 54.023 54.840 -0.166 0.000 0.824 3369 L CB 0.905 42.885 42.059 -0.133 0.000 1.221 3369 L HN 0.601 nan 8.230 nan 0.000 0.418 3370 G N 3.303 111.703 108.800 -0.666 0.000 2.476 3370 G HA2 0.717 4.677 3.960 -0.001 0.000 0.286 3370 G HA3 0.717 4.677 3.960 -0.001 0.000 0.286 3370 G C -0.544 174.032 174.900 -0.540 0.000 1.177 3370 G CA -0.397 44.354 45.100 -0.583 0.000 0.870 3370 G HN 0.792 nan 8.290 nan 0.000 0.528 3371 R N -1.230 118.764 120.500 -0.844 0.000 2.728 3371 R HA 0.532 4.872 4.340 -0.001 0.000 0.274 3371 R C -0.514 175.293 176.300 -0.822 0.000 1.030 3371 R CA -0.763 54.983 56.100 -0.590 0.000 0.876 3371 R CB 0.263 30.382 30.300 -0.300 0.000 1.259 3371 R HN 0.643 nan 8.270 nan 0.000 0.468 3372 T N -0.684 113.698 114.554 -0.287 0.000 2.918 3372 T HA 0.247 4.597 4.350 -0.001 0.000 0.302 3372 T C 1.594 176.228 174.700 -0.109 0.000 1.045 3372 T CA -0.678 61.370 62.100 -0.087 0.000 1.114 3372 T CB 0.525 69.457 68.868 0.106 0.000 0.965 3372 T HN 0.533 nan 8.240 nan 0.000 0.540 3373 I N 1.139 121.680 120.570 -0.049 0.000 2.163 3373 I HA -0.093 4.077 4.170 -0.001 0.000 0.240 3373 I C 2.057 178.162 176.117 -0.019 0.000 1.081 3373 I CA 0.864 62.139 61.300 -0.041 0.000 1.353 3373 I CB -0.513 37.482 38.000 -0.008 0.000 1.054 3373 I HN 0.746 nan 8.210 nan 0.000 0.407 3374 S N 1.673 117.380 115.700 0.012 0.000 2.546 3374 S HA -0.053 4.417 4.470 -0.001 0.000 0.290 3374 S C 1.251 175.867 174.600 0.026 0.000 1.290 3374 S CA -0.330 57.885 58.200 0.025 0.000 1.069 3374 S CB 0.551 63.785 63.200 0.057 0.000 0.846 3374 S HN 0.383 nan 8.310 nan 0.000 0.495 3375 K N 3.109 123.519 120.400 0.017 0.000 2.365 3375 K HA 0.047 4.366 4.320 -0.001 0.000 0.197 3375 K C 0.275 176.895 176.600 0.032 0.000 1.042 3375 K CA 0.701 56.996 56.287 0.014 0.000 0.987 3375 K CB 0.037 32.537 32.500 0.000 0.000 0.779 3375 K HN 0.485 nan 8.250 nan 0.000 0.484 3376 D N 0.952 121.380 120.400 0.047 0.000 2.269 3376 D HA 0.052 4.692 4.640 -0.001 0.000 0.220 3376 D C 0.378 176.732 176.300 0.090 0.000 0.962 3376 D CA 0.520 54.555 54.000 0.059 0.000 0.884 3376 D CB 0.277 41.112 40.800 0.057 0.000 1.023 3376 D HN 0.052 nan 8.370 nan 0.000 0.484 3377 S N -0.438 115.336 115.700 0.123 0.000 2.704 3377 S HA 0.441 4.911 4.470 -0.001 0.000 0.305 3377 S C 0.273 175.007 174.600 0.224 0.000 1.107 3377 S CA -0.706 57.609 58.200 0.192 0.000 0.993 3377 S CB 2.140 65.520 63.200 0.300 0.000 1.110 3377 S HN -0.052 nan 8.310 nan 0.000 0.534 3378 R N 1.728 122.400 120.500 0.286 0.000 4.792 3378 R HA 0.207 4.547 4.340 -0.001 0.000 0.205 3378 R C -0.231 176.330 176.300 0.435 0.000 1.875 3378 R CA -0.171 56.118 56.100 0.315 0.000 1.588 3378 R CB -0.375 30.086 30.300 0.269 0.000 1.401 3378 R HN 0.585 nan 8.270 nan 0.000 0.834 3379 S N -1.141 114.757 115.700 0.330 0.000 2.566 3379 S HA 0.830 5.300 4.470 -0.001 0.000 0.298 3379 S C 0.303 174.987 174.600 0.141 0.000 1.083 3379 S CA -0.404 57.922 58.200 0.211 0.000 0.978 3379 S CB 2.253 65.421 63.200 -0.052 0.000 1.073 3379 S HN 0.480 nan 8.310 nan 0.000 0.491 3380 G N 0.157 109.027 108.800 0.118 0.000 2.880 3380 G HA2 -0.008 3.951 3.960 -0.001 0.000 0.617 3380 G HA3 -0.008 3.951 3.960 -0.001 0.000 0.617 3380 G C -1.190 173.873 174.900 0.271 0.000 1.493 3380 G CA -0.196 44.986 45.100 0.137 0.000 0.916 3380 G HN 1.506 nan 8.290 nan 0.000 0.553 3381 Y N 0.440 120.812 120.300 0.120 0.000 2.480 3381 Y HA 0.534 5.084 4.550 -0.000 0.000 0.329 3381 Y C -0.294 175.673 175.900 0.112 0.000 1.127 3381 Y CA -0.220 57.954 58.100 0.123 0.000 1.037 3381 Y CB 1.616 40.182 38.460 0.177 0.000 1.320 3381 Y HN 0.996 nan 8.280 nan 0.000 0.446 3382 E N 5.402 125.438 120.200 -0.275 0.000 2.317 3382 E HA 0.557 4.907 4.350 -0.001 0.000 0.270 3382 E C -1.553 174.962 176.600 -0.140 0.000 0.885 3382 E CA -1.223 55.131 56.400 -0.077 0.000 0.760 3382 E CB 2.354 32.011 29.700 -0.071 0.000 1.227 3382 E HN 0.374 nan 8.360 nan 0.000 0.434 3383 M N 3.019 122.655 119.600 0.060 0.000 2.238 3383 M HA 0.429 4.909 4.480 -0.001 0.000 0.350 3383 M C -0.830 175.662 176.300 0.319 0.000 1.138 3383 M CA -0.629 54.749 55.300 0.130 0.000 1.040 3383 M CB 0.901 33.544 32.600 0.072 0.000 1.639 3383 M HN 0.605 nan 8.290 nan 0.000 0.451 3384 L N 2.570 123.945 121.223 0.253 0.000 2.376 3384 L HA 0.491 4.831 4.340 -0.001 0.000 0.275 3384 L C 0.027 176.844 176.870 -0.088 0.000 0.987 3384 L CA -0.704 54.190 54.840 0.089 0.000 0.828 3384 L CB 2.138 44.182 42.059 -0.025 0.000 1.249 3384 L HN 0.643 nan 8.230 nan 0.000 0.409 3385 K N 3.055 123.139 120.400 -0.526 0.000 2.310 3385 K HA 0.355 4.674 4.320 -0.001 0.000 0.290 3385 K C -0.745 175.575 176.600 -0.466 0.000 1.077 3385 K CA -0.234 55.447 56.287 -1.011 0.000 0.922 3385 K CB 1.125 32.764 32.500 -1.436 0.000 1.057 3385 K HN 0.412 nan 8.250 nan 0.000 0.479 3386 V N 6.818 126.531 119.914 -0.334 0.000 2.340 3386 V HA 0.439 4.558 4.120 -0.001 0.000 0.277 3386 V C -2.671 173.336 176.094 -0.145 0.000 1.017 3386 V CA -2.588 59.601 62.300 -0.185 0.000 0.820 3386 V CB 1.100 32.852 31.823 -0.118 0.000 1.028 3386 V HN 0.652 nan 8.190 nan 0.000 0.436 3387 P HA 0.262 nan 4.420 nan 0.000 0.269 3387 P C 0.140 177.411 177.300 -0.048 0.000 1.209 3387 P CA 0.400 63.446 63.100 -0.090 0.000 0.776 3387 P CB 0.264 31.916 31.700 -0.080 0.000 0.876 3388 N N 0.297 118.986 118.700 -0.019 0.000 2.693 3388 N HA -0.263 4.477 4.740 -0.001 0.000 0.249 3388 N C 1.103 176.613 175.510 -0.001 0.000 1.119 3388 N CA 1.080 54.130 53.050 -0.001 0.000 0.717 3388 N CB -1.665 36.820 38.487 -0.003 0.000 1.071 3388 N HN 0.573 nan 8.380 nan 0.000 0.555 3389 A N 0.443 123.259 122.820 -0.007 0.000 1.958 3389 A HA -0.251 4.068 4.320 -0.001 0.000 0.221 3389 A C 2.107 179.700 177.584 0.014 0.000 1.178 3389 A CA 2.093 54.126 52.037 -0.006 0.000 0.642 3389 A CB -0.371 18.621 19.000 -0.012 0.000 0.816 3389 A HN 0.589 nan 8.150 nan 0.000 0.453 3390 E N -0.980 119.239 120.200 0.032 0.000 2.150 3390 E HA -0.144 4.205 4.350 -0.001 0.000 0.193 3390 E C 1.731 178.352 176.600 0.035 0.000 0.985 3390 E CA 1.669 58.095 56.400 0.043 0.000 0.814 3390 E CB 0.045 29.782 29.700 0.062 0.000 0.752 3390 E HN 0.780 nan 8.360 nan 0.000 0.466 3391 T N -3.117 111.452 114.554 0.026 0.000 2.969 3391 T HA 0.067 4.417 4.350 -0.001 0.000 0.258 3391 T C 0.140 174.848 174.700 0.013 0.000 0.962 3391 T CA -0.343 61.770 62.100 0.022 0.000 0.903 3391 T CB 0.444 69.324 68.868 0.021 0.000 1.177 3391 T HN -0.100 nan 8.240 nan 0.000 0.511 3392 D N 1.904 122.309 120.400 0.007 0.000 2.441 3392 D HA 0.298 4.938 4.640 -0.001 0.000 0.231 3392 D C 1.406 177.702 176.300 -0.006 0.000 1.073 3392 D CA -1.058 52.941 54.000 -0.001 0.000 0.850 3392 D CB 1.047 41.844 40.800 -0.006 0.000 1.062 3392 D HN 0.437 nan 8.370 nan 0.000 0.524 3393 I N 0.642 121.209 120.570 -0.006 0.000 2.657 3393 I HA -0.180 3.990 4.170 -0.001 0.000 0.261 3393 I C 1.057 177.163 176.117 -0.017 0.000 1.212 3393 I CA 1.072 62.365 61.300 -0.011 0.000 1.453 3393 I CB -0.027 37.965 38.000 -0.012 0.000 1.092 3393 I HN 0.271 nan 8.210 nan 0.000 0.452 3394 Q N 1.629 121.418 119.800 -0.017 0.000 2.282 3394 Q HA 0.161 4.500 4.340 -0.001 0.000 0.206 3394 Q C 0.673 176.658 176.000 -0.025 0.000 0.878 3394 Q CA 0.207 55.998 55.803 -0.021 0.000 0.944 3394 Q CB 0.447 29.173 28.738 -0.019 0.000 1.100 3394 Q HN 0.713 nan 8.270 nan 0.000 0.509 3395 S N 0.081 115.765 115.700 -0.026 0.000 2.533 3395 S HA 0.421 4.890 4.470 -0.001 0.000 0.282 3395 S C 0.356 174.931 174.600 -0.043 0.000 1.304 3395 S CA -0.217 57.962 58.200 -0.035 0.000 1.063 3395 S CB 1.354 64.533 63.200 -0.034 0.000 0.881 3395 S HN 0.236 nan 8.310 nan 0.000 0.493 3396 G N 1.859 110.630 108.800 -0.049 0.000 2.685 3396 G HA2 0.705 4.664 3.960 -0.001 0.000 0.298 3396 G HA3 0.705 4.664 3.960 -0.001 0.000 0.298 3396 G C -3.294 171.563 174.900 -0.072 0.000 1.277 3396 G CA -2.200 42.867 45.100 -0.054 0.000 0.986 3396 G HN 0.570 nan 8.290 nan 0.000 0.487 3397 P HA 0.237 nan 4.420 nan 0.000 0.275 3397 P C 0.757 178.004 177.300 -0.089 0.000 1.227 3397 P CA -0.276 62.768 63.100 -0.094 0.000 0.781 3397 P CB 0.981 32.642 31.700 -0.066 0.000 0.906 3398 I N -0.428 120.067 120.570 -0.125 0.000 4.035 3398 I HA 0.246 4.416 4.170 -0.001 0.000 0.321 3398 I C 0.130 176.200 176.117 -0.077 0.000 1.289 3398 I CA 0.020 61.262 61.300 -0.096 0.000 1.236 3398 I CB 0.245 38.184 38.000 -0.103 0.000 1.076 3398 I HN 0.250 nan 8.210 nan 0.000 0.418 3399 S N 1.181 116.820 115.700 -0.102 0.000 2.643 3399 S HA 0.628 5.097 4.470 -0.001 0.000 0.270 3399 S C -1.078 173.550 174.600 0.048 0.000 1.166 3399 S CA -0.715 57.482 58.200 -0.006 0.000 0.815 3399 S CB 1.623 64.856 63.200 0.055 0.000 1.139 3399 S HN 0.558 nan 8.310 nan 0.000 0.472 3400 N N -0.545 118.255 118.700 0.167 0.000 2.367 3400 N HA 0.479 5.219 4.740 -0.001 0.000 0.278 3400 N C -1.696 173.996 175.510 0.303 0.000 1.117 3400 N CA -0.654 52.536 53.050 0.233 0.000 0.867 3400 N CB 2.029 40.592 38.487 0.127 0.000 1.649 3400 N HN 0.822 nan 8.380 nan 0.000 0.479 3401 Q N 2.167 122.187 119.800 0.366 0.000 2.309 3401 Q HA 0.422 4.761 4.340 -0.001 0.000 0.270 3401 Q C -1.449 174.719 176.000 0.279 0.000 1.023 3401 Q CA -0.921 55.085 55.803 0.340 0.000 0.758 3401 Q CB 1.733 30.739 28.738 0.446 0.000 1.247 3401 Q HN 0.596 nan 8.270 nan 0.000 0.455 3402 V N 6.318 126.373 119.914 0.234 0.000 2.479 3402 V HA -0.014 4.106 4.120 -0.001 0.000 0.281 3402 V C 1.028 177.298 176.094 0.294 0.000 1.031 3402 V CA 0.299 62.729 62.300 0.216 0.000 1.038 3402 V CB 0.552 32.472 31.823 0.162 0.000 0.981 3402 V HN 0.840 nan 8.190 nan 0.000 0.478 3403 I N 4.956 125.735 120.570 0.348 0.000 2.729 3403 I HA 0.159 4.329 4.170 -0.001 0.000 0.256 3403 I C 0.545 176.905 176.117 0.406 0.000 1.115 3403 I CA 1.215 62.789 61.300 0.457 0.000 1.446 3403 I CB 0.223 38.557 38.000 0.556 0.000 1.176 3403 I HN 0.332 nan 8.210 nan 0.000 0.446 3404 V N 3.203 123.329 119.914 0.352 0.000 2.531 3404 V HA 0.258 4.377 4.120 -0.001 0.000 0.301 3404 V C -0.449 175.762 176.094 0.194 0.000 1.034 3404 V CA -1.111 61.362 62.300 0.288 0.000 0.865 3404 V CB 1.785 33.795 31.823 0.311 0.000 0.995 3404 V HN 0.416 nan 8.190 nan 0.000 0.424 3405 N N 2.676 121.449 118.700 0.121 0.000 2.399 3405 N HA 0.018 4.758 4.740 -0.001 0.000 0.250 3405 N C 0.562 176.062 175.510 -0.018 0.000 1.272 3405 N CA -0.152 52.920 53.050 0.036 0.000 0.928 3405 N CB 0.254 38.730 38.487 -0.017 0.000 1.158 3405 N HN 0.683 nan 8.380 nan 0.000 0.463 3406 N N -0.715 117.961 118.700 -0.041 0.000 2.449 3406 N HA -0.057 4.683 4.740 -0.001 0.000 0.191 3406 N C -0.052 175.358 175.510 -0.167 0.000 1.161 3406 N CA 0.021 53.027 53.050 -0.073 0.000 0.863 3406 N CB 0.147 38.605 38.487 -0.048 0.000 0.980 3406 N HN 0.513 nan 8.380 nan 0.000 0.458 3407 Q N -0.335 119.346 119.800 -0.199 0.000 2.319 3407 Q HA 0.252 4.592 4.340 -0.001 0.000 0.202 3407 Q C -0.630 175.131 176.000 -0.399 0.000 0.896 3407 Q CA 0.215 55.850 55.803 -0.280 0.000 0.942 3407 Q CB 0.546 29.149 28.738 -0.225 0.000 1.083 3407 Q HN 0.201 nan 8.270 nan 0.000 0.510 3408 N N -0.741 117.752 118.700 -0.345 0.000 2.265 3408 N HA 0.244 4.984 4.740 -0.001 0.000 0.300 3408 N C -1.223 174.151 175.510 -0.226 0.000 1.148 3408 N CA -0.567 52.295 53.050 -0.312 0.000 0.772 3408 N CB 1.064 39.486 38.487 -0.109 0.000 1.434 3408 N HN 0.070 nan 8.380 nan 0.000 0.481 3409 W N 1.313 122.666 121.300 0.089 0.000 2.216 3409 W HA 0.163 4.823 4.660 -0.001 0.000 0.326 3409 W C 1.493 178.100 176.519 0.146 0.000 1.319 3409 W CA -0.319 57.089 57.345 0.106 0.000 1.213 3409 W CB 0.538 30.048 29.460 0.084 0.000 1.171 3409 W HN 0.495 nan 8.180 nan 0.000 0.557 3410 S N 2.241 118.206 115.700 0.441 0.000 3.124 3410 S HA 0.977 5.447 4.470 -0.001 0.000 0.234 3410 S C 0.306 175.100 174.600 0.324 0.000 1.045 3410 S CA -0.062 58.350 58.200 0.354 0.000 1.200 3410 S CB 1.266 64.693 63.200 0.379 0.000 1.186 3410 S HN 0.911 nan 8.310 nan 0.000 0.617 3411 G N -0.848 108.144 108.800 0.321 0.000 2.455 3411 G HA2 0.313 4.273 3.960 -0.001 0.000 0.223 3411 G HA3 0.313 4.273 3.960 -0.001 0.000 0.223 3411 G C -1.639 173.516 174.900 0.426 0.000 1.226 3411 G CA -0.748 44.544 45.100 0.321 0.000 0.948 3411 G HN 0.555 nan 8.290 nan 0.000 0.478 3412 Y N 1.477 121.889 120.300 0.187 0.000 2.652 3412 Y HA 0.456 5.006 4.550 -0.000 0.000 0.344 3412 Y C 1.325 177.307 175.900 0.136 0.000 1.254 3412 Y CA -0.045 58.172 58.100 0.195 0.000 1.480 3412 Y CB 0.832 39.435 38.460 0.240 0.000 1.345 3412 Y HN 0.861 nan 8.280 nan 0.000 0.617 3413 S N 0.058 115.844 115.700 0.144 0.000 2.556 3413 S HA 0.948 5.417 4.470 -0.001 0.000 0.271 3413 S C -0.535 173.889 174.600 -0.293 0.000 1.135 3413 S CA -0.279 57.785 58.200 -0.228 0.000 0.858 3413 S CB 2.237 65.332 63.200 -0.175 0.000 1.114 3413 S HN 1.080 nan 8.310 nan 0.000 0.468 3414 G N -0.241 108.014 108.800 -0.907 0.000 2.623 3414 G HA2 0.776 4.736 3.960 -0.001 0.000 0.290 3414 G HA3 0.776 4.736 3.960 -0.001 0.000 0.290 3414 G C -1.234 173.375 174.900 -0.486 0.000 1.437 3414 G CA -0.332 44.490 45.100 -0.463 0.000 0.798 3414 G HN 1.308 nan 8.290 nan 0.000 0.488 3415 A N -0.444 122.320 122.820 -0.093 0.000 2.312 3415 A HA 0.975 5.295 4.320 -0.001 0.000 0.326 3415 A C -0.725 177.083 177.584 0.373 0.000 1.172 3415 A CA -0.550 51.491 52.037 0.007 0.000 0.821 3415 A CB 0.575 19.521 19.000 -0.090 0.000 1.166 3415 A HN 1.958 nan 8.150 nan 0.000 0.493 3416 F N -0.402 119.694 119.950 0.243 0.000 2.693 3416 F HA 0.837 5.364 4.527 -0.000 0.000 0.309 3416 F C -1.501 174.372 175.800 0.121 0.000 1.129 3416 F CA -1.348 56.779 58.000 0.210 0.000 0.948 3416 F CB 1.023 40.129 39.000 0.177 0.000 1.315 3416 F HN 0.425 nan 8.300 nan 0.000 0.447 3417 I N 1.338 121.872 120.570 -0.060 0.000 2.686 3417 I HA 0.246 4.415 4.170 -0.001 0.000 0.295 3417 I C -1.416 174.508 176.117 -0.321 0.000 1.114 3417 I CA -0.802 60.200 61.300 -0.496 0.000 1.038 3417 I CB 2.100 39.503 38.000 -0.994 0.000 1.238 3417 I HN 0.639 nan 8.210 nan 0.000 0.420 3418 D N 4.239 124.548 120.400 -0.152 0.000 2.416 3418 D HA 0.091 4.731 4.640 -0.001 0.000 0.240 3418 D C 0.344 176.601 176.300 -0.071 0.000 1.250 3418 D CA 0.313 54.368 54.000 0.091 0.000 0.967 3418 D CB 0.241 41.138 40.800 0.162 0.000 1.059 3418 D HN 0.286 nan 8.370 nan 0.000 0.512 3419 Y N 1.411 121.616 120.300 -0.159 0.000 2.583 3419 Y HA 0.038 4.588 4.550 -0.001 0.000 0.293 3419 Y C 1.332 176.912 175.900 -0.533 0.000 1.157 3419 Y CA 0.201 57.880 58.100 -0.702 0.000 1.315 3419 Y CB 0.178 37.819 38.460 -1.365 0.000 1.021 3419 Y HN 0.567 nan 8.280 nan 0.000 0.536 3420 W N -0.358 121.064 121.300 0.204 0.000 3.127 3420 W HA 0.516 5.175 4.660 -0.000 0.000 0.344 3420 W C 0.683 177.276 176.519 0.123 0.000 1.151 3420 W CA -0.331 57.112 57.345 0.164 0.000 1.765 3420 W CB -0.283 29.239 29.460 0.104 0.000 1.085 3420 W HN -0.152 nan 8.180 nan 0.000 0.596 3421 A N 1.546 124.526 122.820 0.267 0.000 2.520 3421 A HA -0.076 4.244 4.320 -0.001 0.000 0.235 3421 A C 0.580 178.249 177.584 0.142 0.000 1.065 3421 A CA 0.139 52.279 52.037 0.172 0.000 0.764 3421 A CB -0.118 18.953 19.000 0.119 0.000 1.002 3421 A HN 0.351 nan 8.150 nan 0.000 0.502 3422 N N 1.671 120.434 118.700 0.104 0.000 2.971 3422 N HA 0.133 4.872 4.740 -0.001 0.000 0.294 3422 N C -0.511 175.025 175.510 0.044 0.000 1.210 3422 N CA 0.161 53.255 53.050 0.073 0.000 1.157 3422 N CB -0.253 38.270 38.487 0.060 0.000 1.450 3422 N HN 0.535 nan 8.380 nan 0.000 0.527 3423 K N 0.405 120.829 120.400 0.039 0.000 2.512 3423 K HA 0.126 4.446 4.320 -0.001 0.000 0.263 3423 K C 0.265 176.851 176.600 -0.023 0.000 0.966 3423 K CA -0.732 55.559 56.287 0.006 0.000 0.851 3423 K CB 1.383 33.887 32.500 0.007 0.000 1.395 3423 K HN 0.253 nan 8.250 nan 0.000 0.440 3424 E N -0.346 119.824 120.200 -0.050 0.000 2.474 3424 E HA 0.018 4.368 4.350 -0.001 0.000 0.194 3424 E C 0.492 177.001 176.600 -0.152 0.000 1.041 3424 E CA 0.066 56.416 56.400 -0.083 0.000 0.874 3424 E CB -0.190 29.475 29.700 -0.058 0.000 0.914 3424 E HN 0.575 nan 8.360 nan 0.000 0.498 3425 c N -0.351 118.161 118.600 -0.146 0.000 2.848 3425 c HA 0.766 5.335 4.570 -0.001 0.000 0.317 3425 c C -0.280 173.720 174.090 -0.149 0.000 1.260 3425 c CA -1.390 54.820 56.329 -0.198 0.000 1.656 3425 c CB 0.148 42.598 42.510 -0.100 0.000 2.174 3425 c HN 0.017 nan 8.230 nan 0.000 0.479 3426 F N 2.315 122.254 119.950 -0.017 0.000 2.438 3426 F HA 0.331 4.857 4.527 -0.001 0.000 0.360 3426 F C 0.973 176.679 175.800 -0.157 0.000 1.118 3426 F CA -0.447 57.510 58.000 -0.070 0.000 1.164 3426 F CB -0.207 38.807 39.000 0.023 0.000 1.131 3426 F HN 0.691 nan 8.300 nan 0.000 0.527 3427 N N 5.580 124.265 118.700 -0.025 0.000 2.406 3427 N HA 0.213 4.953 4.740 -0.001 0.000 0.251 3427 N C -2.594 172.711 175.510 -0.342 0.000 1.069 3427 N CA -1.635 51.311 53.050 -0.174 0.000 0.947 3427 N CB 0.927 39.335 38.487 -0.132 0.000 1.111 3427 N HN 0.117 nan 8.380 nan 0.000 0.497 3428 P HA -0.047 nan 4.420 nan 0.000 0.261 3428 P C -0.609 176.367 177.300 -0.539 0.000 1.173 3428 P CA -0.023 62.461 63.100 -1.027 0.000 0.760 3428 P CB 0.384 31.240 31.700 -1.407 0.000 0.783 3429 c N 3.582 121.843 118.600 -0.564 0.000 2.971 3429 c HA 0.858 5.428 4.570 -0.001 0.000 0.310 3429 c C -0.226 173.630 174.090 -0.390 0.000 1.285 3429 c CA -0.349 55.617 56.329 -0.604 0.000 1.593 3429 c CB 1.009 42.627 42.510 -1.487 0.000 2.076 3429 c HN 0.676 nan 8.230 nan 0.000 0.472 3430 F N -0.230 119.441 119.950 -0.465 0.000 2.685 3430 F HA 0.848 5.374 4.527 -0.000 0.000 0.315 3430 F C -1.178 174.570 175.800 -0.086 0.000 1.126 3430 F CA -1.209 56.511 58.000 -0.466 0.000 0.950 3430 F CB 0.932 39.212 39.000 -1.200 0.000 1.360 3430 F HN 0.713 nan 8.300 nan 0.000 0.469 3431 Y N -0.562 119.730 120.300 -0.013 0.000 2.605 3431 Y HA 0.883 5.433 4.550 -0.000 0.000 0.343 3431 Y C -1.895 174.002 175.900 -0.007 0.000 1.036 3431 Y CA -1.972 56.075 58.100 -0.088 0.000 1.065 3431 Y CB 1.520 39.962 38.460 -0.030 0.000 1.288 3431 Y HN 0.566 nan 8.280 nan 0.000 0.481 3432 V N 1.603 121.551 119.914 0.057 0.000 2.531 3432 V HA 0.298 4.417 4.120 -0.001 0.000 0.301 3432 V C -0.489 175.741 176.094 0.227 0.000 1.034 3432 V CA -1.009 61.289 62.300 -0.004 0.000 0.865 3432 V CB 1.463 33.205 31.823 -0.136 0.000 0.995 3432 V HN 0.885 nan 8.190 nan 0.000 0.424 3433 E N 4.629 125.008 120.200 0.298 0.000 2.259 3433 E HA 0.375 4.725 4.350 -0.001 0.000 0.281 3433 E C -1.199 175.531 176.600 0.216 0.000 1.037 3433 E CA -0.483 56.081 56.400 0.273 0.000 0.854 3433 E CB 0.923 30.804 29.700 0.301 0.000 1.051 3433 E HN 0.657 nan 8.360 nan 0.000 0.409 3434 L N 7.133 128.471 121.223 0.192 0.000 2.371 3434 L HA 0.369 4.708 4.340 -0.001 0.000 0.262 3434 L C -0.126 176.864 176.870 0.199 0.000 1.054 3434 L CA -0.515 54.452 54.840 0.212 0.000 0.924 3434 L CB 0.418 42.599 42.059 0.203 0.000 1.295 3434 L HN 0.532 nan 8.230 nan 0.000 0.441 3435 I N 3.294 123.980 120.570 0.194 0.000 2.533 3435 I HA 0.173 4.343 4.170 -0.001 0.000 0.284 3435 I C 0.274 176.467 176.117 0.126 0.000 1.109 3435 I CA -0.084 61.291 61.300 0.126 0.000 1.412 3435 I CB 0.316 38.350 38.000 0.057 0.000 1.396 3435 I HN 0.465 nan 8.210 nan 0.000 0.543 3436 R N 4.235 124.817 120.500 0.136 0.000 2.711 3436 R HA 0.760 5.100 4.340 -0.001 0.000 0.284 3436 R C 0.254 176.550 176.300 -0.007 0.000 0.968 3436 R CA -0.373 55.810 56.100 0.138 0.000 0.924 3436 R CB 1.526 32.000 30.300 0.290 0.000 1.162 3436 R HN 0.905 nan 8.270 nan 0.000 0.465 3437 G N 1.798 110.404 108.800 -0.324 0.000 2.508 3437 G HA2 -0.250 3.709 3.960 -0.001 0.000 0.220 3437 G HA3 -0.250 3.709 3.960 -0.001 0.000 0.220 3437 G C -0.818 173.839 174.900 -0.405 0.000 1.287 3437 G CA -0.658 44.068 45.100 -0.622 0.000 0.916 3437 G HN 0.537 nan 8.290 nan 0.000 0.574 3438 R N 1.435 121.737 120.500 -0.330 0.000 2.679 3438 R HA 0.239 4.579 4.340 -0.001 0.000 0.268 3438 R C -1.127 175.049 176.300 -0.207 0.000 1.044 3438 R CA -0.438 55.520 56.100 -0.237 0.000 1.105 3438 R CB 0.620 30.823 30.300 -0.162 0.000 0.989 3438 R HN 0.437 nan 8.270 nan 0.000 0.447 3439 P HA -0.077 nan 4.420 nan 0.000 0.224 3439 P C 0.325 177.470 177.300 -0.258 0.000 1.157 3439 P CA 0.943 63.927 63.100 -0.194 0.000 0.799 3439 P CB 0.307 31.922 31.700 -0.142 0.000 0.809 3440 K N 0.685 120.833 120.400 -0.420 0.000 2.097 3440 K HA -0.051 4.269 4.320 -0.001 0.000 0.206 3440 K C 0.803 177.178 176.600 -0.374 0.000 1.049 3440 K CA 0.979 56.923 56.287 -0.573 0.000 0.933 3440 K CB -0.280 31.356 32.500 -1.440 0.000 0.717 3440 K HN 0.420 nan 8.250 nan 0.000 0.442 3441 E N 0.933 120.910 120.200 -0.372 0.000 2.376 3441 E HA 0.097 4.446 4.350 -0.001 0.000 0.236 3441 E C -0.094 176.343 176.600 -0.272 0.000 0.962 3441 E CA -0.182 56.074 56.400 -0.240 0.000 0.768 3441 E CB 0.938 30.494 29.700 -0.239 0.000 1.236 3441 E HN 0.064 nan 8.360 nan 0.000 0.431 3442 S N 0.184 115.771 115.700 -0.189 0.000 2.605 3442 S HA -0.067 4.402 4.470 -0.001 0.000 0.217 3442 S C 1.651 176.157 174.600 -0.157 0.000 0.958 3442 S CA -0.003 58.090 58.200 -0.179 0.000 0.919 3442 S CB 0.008 63.133 63.200 -0.124 0.000 0.780 3442 S HN 0.326 nan 8.310 nan 0.000 0.507 3443 S N 1.102 116.711 115.700 -0.152 0.000 2.555 3443 S HA 0.132 4.602 4.470 -0.001 0.000 0.230 3443 S C 0.723 175.232 174.600 -0.151 0.000 0.978 3443 S CA 0.179 58.311 58.200 -0.112 0.000 0.934 3443 S CB -0.849 62.312 63.200 -0.066 0.000 0.766 3443 S HN 0.778 nan 8.310 nan 0.000 0.533 3444 V N -2.273 117.457 119.914 -0.306 0.000 3.019 3444 V HA 0.629 4.749 4.120 -0.001 0.000 0.317 3444 V C 0.668 176.519 176.094 -0.405 0.000 1.094 3444 V CA -1.072 60.959 62.300 -0.448 0.000 1.000 3444 V CB 1.265 32.438 31.823 -1.084 0.000 1.060 3444 V HN 0.064 nan 8.190 nan 0.000 0.443 3445 L N 1.689 122.744 121.223 -0.281 0.000 2.607 3445 L HA 0.344 4.684 4.340 -0.001 0.000 0.228 3445 L C 0.568 177.430 176.870 -0.013 0.000 1.123 3445 L CA 0.167 54.950 54.840 -0.095 0.000 0.890 3445 L CB -0.665 41.411 42.059 0.027 0.000 1.103 3445 L HN 0.865 nan 8.230 nan 0.000 0.468 3446 W N -1.585 119.679 121.300 -0.060 0.000 2.703 3446 W HA 0.685 5.345 4.660 -0.000 0.000 0.359 3446 W C -0.907 175.557 176.519 -0.092 0.000 1.168 3446 W CA -0.814 56.489 57.345 -0.069 0.000 1.177 3446 W CB 0.555 29.965 29.460 -0.083 0.000 1.434 3446 W HN -0.292 nan 8.180 nan 0.000 0.618 3447 T N 1.494 116.253 114.554 0.342 0.000 2.879 3447 T HA 0.440 4.789 4.350 -0.001 0.000 0.290 3447 T C -0.823 174.044 174.700 0.279 0.000 0.993 3447 T CA -0.216 62.034 62.100 0.250 0.000 0.975 3447 T CB 2.047 70.956 68.868 0.068 0.000 0.981 3447 T HN 0.503 nan 8.240 nan 0.000 0.439 3448 S N 2.028 117.907 115.700 0.298 0.000 2.880 3448 S HA 0.816 5.286 4.470 -0.001 0.000 0.308 3448 S C -1.571 173.088 174.600 0.098 0.000 1.195 3448 S CA -0.784 57.476 58.200 0.099 0.000 0.866 3448 S CB 1.320 64.460 63.200 -0.101 0.000 1.254 3448 S HN 1.002 nan 8.310 nan 0.000 0.571 3449 N N -0.910 117.820 118.700 0.049 0.000 2.825 3449 N HA 0.661 5.400 4.740 -0.001 0.000 0.253 3449 N C -1.108 174.445 175.510 0.071 0.000 1.426 3449 N CA -0.456 52.644 53.050 0.082 0.000 0.851 3449 N CB 1.523 40.059 38.487 0.081 0.000 1.470 3449 N HN 0.646 nan 8.380 nan 0.000 0.517 3450 S N -0.485 115.278 115.700 0.106 0.000 2.841 3450 S HA 0.756 5.226 4.470 -0.001 0.000 0.318 3450 S C -0.895 173.775 174.600 0.118 0.000 1.127 3450 S CA -0.860 57.401 58.200 0.101 0.000 0.883 3450 S CB 0.767 64.028 63.200 0.101 0.000 1.271 3450 S HN 0.572 nan 8.310 nan 0.000 0.567 3451 I N 0.590 121.222 120.570 0.104 0.000 2.582 3451 I HA 0.655 4.825 4.170 -0.001 0.000 0.292 3451 I C -1.246 174.898 176.117 0.046 0.000 1.066 3451 I CA -1.069 60.282 61.300 0.083 0.000 1.053 3451 I CB 2.115 40.137 38.000 0.036 0.000 1.241 3451 I HN 0.503 nan 8.210 nan 0.000 0.421 3452 V N 4.930 124.866 119.914 0.037 0.000 2.735 3452 V HA 0.905 5.025 4.120 -0.001 0.000 0.310 3452 V C -0.867 175.154 176.094 -0.121 0.000 1.061 3452 V CA -0.213 62.044 62.300 -0.072 0.000 0.913 3452 V CB 1.893 33.682 31.823 -0.056 0.000 1.005 3452 V HN 0.852 nan 8.190 nan 0.000 0.428 3453 A N 6.437 129.122 122.820 -0.224 0.000 2.393 3453 A HA 0.948 5.268 4.320 -0.001 0.000 0.306 3453 A C -1.701 175.628 177.584 -0.426 0.000 1.050 3453 A CA -0.488 51.410 52.037 -0.232 0.000 0.724 3453 A CB 1.494 20.494 19.000 -0.001 0.000 1.248 3453 A HN 0.773 nan 8.150 nan 0.000 0.424 3454 L N 0.712 121.505 121.223 -0.716 0.000 2.393 3454 L HA 0.725 5.064 4.340 -0.001 0.000 0.260 3454 L C -0.545 176.004 176.870 -0.534 0.000 1.002 3454 L CA -0.162 54.288 54.840 -0.649 0.000 0.818 3454 L CB 2.180 43.876 42.059 -0.605 0.000 1.369 3454 L HN 0.784 nan 8.230 nan 0.000 0.412 3455 c N 0.057 118.375 118.600 -0.469 0.000 2.779 3455 c HA 0.780 5.350 4.570 -0.001 0.000 0.314 3455 c C 0.743 174.757 174.090 -0.128 0.000 1.231 3455 c CA -1.160 55.028 56.329 -0.235 0.000 1.652 3455 c CB 1.564 43.900 42.510 -0.290 0.000 2.198 3455 c HN 0.964 nan 8.230 nan 0.000 0.483 3456 G N 1.517 110.116 108.800 -0.336 0.000 2.287 3456 G HA2 0.365 4.325 3.960 -0.001 0.000 0.235 3456 G HA3 0.365 4.325 3.960 -0.001 0.000 0.235 3456 G C -0.134 174.575 174.900 -0.318 0.000 1.258 3456 G CA 0.402 45.033 45.100 -0.782 0.000 0.884 3456 G HN 0.856 nan 8.290 nan 0.000 0.518 3457 S N 0.621 116.096 115.700 -0.375 0.000 2.500 3457 S HA 0.344 4.814 4.470 -0.001 0.000 0.301 3457 S C 1.055 175.538 174.600 -0.196 0.000 1.092 3457 S CA -0.801 57.297 58.200 -0.169 0.000 1.030 3457 S CB 1.663 64.833 63.200 -0.049 0.000 1.031 3457 S HN 0.673 nan 8.310 nan 0.000 0.483 3458 K N 2.406 122.733 120.400 -0.123 0.000 2.439 3458 K HA 0.060 4.380 4.320 -0.001 0.000 0.197 3458 K C 0.420 176.994 176.600 -0.043 0.000 1.041 3458 K CA 0.809 57.050 56.287 -0.077 0.000 0.970 3458 K CB 0.060 32.524 32.500 -0.060 0.000 0.773 3458 K HN 0.422 nan 8.250 nan 0.000 0.479 3459 K N 0.734 121.109 120.400 -0.042 0.000 2.179 3459 K HA 0.186 4.505 4.320 -0.001 0.000 0.238 3459 K C -0.101 176.503 176.600 0.006 0.000 1.033 3459 K CA -0.448 55.831 56.287 -0.015 0.000 0.926 3459 K CB 0.574 33.066 32.500 -0.014 0.000 1.151 3459 K HN -0.026 nan 8.250 nan 0.000 0.492 3460 R N 1.685 122.200 120.500 0.025 0.000 2.471 3460 R HA 0.335 4.675 4.340 -0.001 0.000 0.292 3460 R C -0.299 176.034 176.300 0.055 0.000 1.192 3460 R CA -0.334 55.797 56.100 0.050 0.000 1.257 3460 R CB -0.180 30.151 30.300 0.053 0.000 1.130 3460 R HN 0.401 nan 8.270 nan 0.000 0.558 3461 L N 1.088 122.354 121.223 0.071 0.000 2.334 3461 L HA 0.414 4.754 4.340 -0.001 0.000 0.277 3461 L C 1.343 178.272 176.870 0.098 0.000 1.075 3461 L CA -0.681 54.207 54.840 0.079 0.000 0.804 3461 L CB 1.217 43.339 42.059 0.106 0.000 1.174 3461 L HN 0.501 nan 8.230 nan 0.000 0.438 3462 G N 1.339 110.179 108.800 0.067 0.000 2.699 3462 G HA2 0.368 4.328 3.960 -0.001 0.000 0.246 3462 G HA3 0.368 4.328 3.960 -0.001 0.000 0.246 3462 G C -0.253 174.710 174.900 0.106 0.000 1.219 3462 G CA -0.120 45.018 45.100 0.063 0.000 0.866 3462 G HN 0.687 nan 8.290 nan 0.000 0.572 3463 S N -0.307 115.464 115.700 0.119 0.000 2.564 3463 S HA 0.793 5.263 4.470 -0.001 0.000 0.274 3463 S C -0.990 173.730 174.600 0.201 0.000 1.124 3463 S CA -0.817 57.510 58.200 0.213 0.000 0.869 3463 S CB 2.029 65.397 63.200 0.279 0.000 1.105 3463 S HN 1.301 nan 8.310 nan 0.000 0.472 3464 W N 0.213 121.466 121.300 -0.078 0.000 3.274 3464 W HA 0.797 5.457 4.660 -0.001 0.000 0.353 3464 W C -0.586 175.767 176.519 -0.278 0.000 1.147 3464 W CA -1.494 55.739 57.345 -0.186 0.000 1.054 3464 W CB 0.411 29.719 29.460 -0.253 0.000 1.510 3464 W HN 0.762 nan 8.180 nan 0.000 0.602 3465 S N -0.032 115.582 115.700 -0.144 0.000 2.523 3465 S HA 0.318 4.788 4.470 -0.001 0.000 0.275 3465 S C -1.141 173.167 174.600 -0.486 0.000 1.281 3465 S CA -0.307 57.825 58.200 -0.114 0.000 1.050 3465 S CB -0.036 63.243 63.200 0.132 0.000 0.937 3465 S HN 0.377 nan 8.310 nan 0.000 0.492 3466 W N 6.113 127.395 121.300 -0.029 0.000 2.102 3466 W HA 0.282 4.942 4.660 -0.001 0.000 0.357 3466 W C 0.960 177.408 176.519 -0.118 0.000 0.717 3466 W CA -0.911 56.339 57.345 -0.159 0.000 2.518 3466 W CB -0.039 29.410 29.460 -0.018 0.000 2.010 3466 W HN 0.711 nan 8.180 nan 0.000 0.672 3467 H N -1.473 117.651 119.070 0.090 0.000 2.660 3467 H HA 0.075 4.631 4.556 -0.000 0.000 0.374 3467 H C 0.883 176.278 175.328 0.110 0.000 1.291 3467 H CA 0.452 56.555 56.048 0.092 0.000 1.437 3467 H CB 0.655 30.426 29.762 0.016 0.000 1.509 3467 H HN 0.153 nan 8.280 nan 0.000 0.614 3468 D N 0.612 121.155 120.400 0.239 0.000 2.103 3468 D HA -0.109 4.531 4.640 -0.001 0.000 0.190 3468 D C 1.628 178.017 176.300 0.148 0.000 0.997 3468 D CA 3.334 57.447 54.000 0.187 0.000 0.833 3468 D CB -0.509 40.427 40.800 0.226 0.000 0.961 3468 D HN 0.965 nan 8.370 nan 0.000 0.447 3469 G N -1.106 107.820 108.800 0.210 0.000 2.175 3469 G HA2 -0.124 3.836 3.960 -0.001 0.000 0.244 3469 G HA3 -0.124 3.836 3.960 -0.001 0.000 0.244 3469 G C 0.324 175.334 174.900 0.183 0.000 0.982 3469 G CA 0.491 45.699 45.100 0.179 0.000 0.641 3469 G HN 0.765 nan 8.290 nan 0.000 0.527 3470 A N -0.208 122.748 122.820 0.226 0.000 2.340 3470 A HA 0.713 5.033 4.320 -0.001 0.000 0.268 3470 A C 0.237 177.972 177.584 0.253 0.000 1.100 3470 A CA 0.283 52.496 52.037 0.294 0.000 0.803 3470 A CB 0.850 20.107 19.000 0.428 0.000 1.043 3470 A HN 0.640 nan 8.150 nan 0.000 0.488 3471 E N 1.731 122.060 120.200 0.214 0.000 2.081 3471 E HA 0.327 4.677 4.350 -0.001 0.000 0.276 3471 E C 0.331 177.030 176.600 0.166 0.000 0.950 3471 E CA -0.483 55.922 56.400 0.008 0.000 0.776 3471 E CB 0.711 30.154 29.700 -0.429 0.000 1.094 3471 E HN 0.459 nan 8.360 nan 0.000 0.402 3472 I N 5.652 126.341 120.570 0.198 0.000 2.454 3472 I HA -0.172 3.998 4.170 -0.001 0.000 0.254 3472 I C 1.555 177.817 176.117 0.242 0.000 1.156 3472 I CA 0.875 62.349 61.300 0.290 0.000 1.433 3472 I CB -0.075 37.994 38.000 0.114 0.000 1.082 3472 I HN 0.770 nan 8.210 nan 0.000 0.432 3473 I N -0.534 120.066 120.570 0.049 0.000 2.614 3473 I HA -0.311 3.858 4.170 -0.001 0.000 0.258 3473 I C 1.941 178.130 176.117 0.121 0.000 1.189 3473 I CA 1.459 62.776 61.300 0.028 0.000 1.462 3473 I CB -0.445 37.516 38.000 -0.065 0.000 1.092 3473 I HN 0.322 nan 8.210 nan 0.000 0.442 3474 Y N -0.628 119.709 120.300 0.062 0.000 2.352 3474 Y HA -0.221 4.329 4.550 -0.000 0.000 0.292 3474 Y C 1.930 177.752 175.900 -0.131 0.000 1.136 3474 Y CA 0.632 58.676 58.100 -0.093 0.000 1.227 3474 Y CB -0.161 38.160 38.460 -0.232 0.000 0.991 3474 Y HN 0.077 nan 8.280 nan 0.000 0.545 3475 F N 0.065 120.182 119.950 0.279 0.000 2.765 3475 F HA 0.077 4.603 4.527 -0.001 0.000 0.302 3475 F C 0.893 176.801 175.800 0.180 0.000 1.111 3475 F CA 0.050 58.212 58.000 0.270 0.000 1.359 3475 F CB -0.064 39.194 39.000 0.430 0.000 1.097 3475 F HN -0.031 nan 8.300 nan 0.000 0.577 3476 E N 0.000 120.360 120.200 0.267 0.000 2.725 3476 E HA 0.000 4.350 4.350 -0.001 0.000 0.291 3476 E CA 0.000 56.494 56.400 0.157 0.000 0.976 3476 E CB 0.000 29.761 29.700 0.102 0.000 0.812 3476 E HN 0.000 nan 8.360 nan 0.000 0.440