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 3myr_1_F DATA FIRST_RESID 1001 DATA SEQUENCE MSERIVVDPI TRIEGHLRIE AQMDGATIAQ AYSSGTMVRG IETILKGRDP DATA SEQUENCE RDAWAFVQRI CGVCTLVHGI ASVRAVEDAL RIELPLNAQL IRNLMIGAQY DATA SEQUENCE IHDHVMHFYH LHALDWVDVV SALSADPRAT SELAQSISAW PKSSPGYFAD DATA SEQUENCE TQKRIKTFVE SGQLGIFANG YWGHPAYRLP PEANLMAVAH YLEALAWQRD DATA SEQUENCE TAKFHAIFGG KNPHPNFVVG GVPSPIDLDS DSALNAKRLA EVRNLIQSMR DATA SEQUENCE TFVDQVYVPD TLAIAGFYKD WGERGEGLGN FLCYGDLPTG ASLDPATFLF DATA SEQUENCE PRGAILDRDL STIHEVDLEA TGEIQEFVNH SWYEYSVGND RGLHPYEGQT DATA SEQUENCE NLEYDRRGGV APPYKQLDVS DGYSWLKAPR WKGRSVEVGP LARVLMLYAT DATA SEQUENCE GHDQARELVD STLSRLDLPV DALYSTLGRT AARALESKIL VDAMQGWYDG DATA SEQUENCE LIANVKSGDT KTFNETLWEP SSWPSRAQGV GIMEAPRGAL GHWIVIEDGR DATA SEQUENCE IANYQAVVPS TWNAGPRDGR GQAGAYEAAL QDNHQLVDVK QPIEILRTIH DATA SEQUENCE SFDPCIACAV H 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 1001 M HA 0.000 nan 4.480 nan 0.000 0.227 1001 M C 0.000 176.255 176.300 -0.076 0.000 1.140 1001 M CA 0.000 55.232 55.300 -0.114 0.000 0.988 1001 M CB 0.000 32.488 32.600 -0.186 0.000 1.302 1002 S N 0.465 116.117 115.700 -0.081 0.000 2.680 1002 S HA 0.450 4.920 4.470 -0.000 0.000 0.262 1002 S C -0.874 173.702 174.600 -0.039 0.000 1.138 1002 S CA -0.596 57.575 58.200 -0.048 0.000 1.072 1002 S CB 1.657 64.832 63.200 -0.041 0.000 1.097 1002 S HN 0.562 nan 8.310 nan 0.000 0.468 1003 E N 0.526 120.713 120.200 -0.022 0.000 2.539 1003 E HA -0.238 4.112 4.350 -0.000 0.000 0.253 1003 E C -0.074 176.519 176.600 -0.011 0.000 1.145 1003 E CA 0.697 57.090 56.400 -0.012 0.000 0.738 1003 E CB -0.940 28.755 29.700 -0.008 0.000 1.308 1003 E HN 0.545 nan 8.360 nan 0.000 0.409 1004 R N 0.252 120.740 120.500 -0.019 0.000 2.582 1004 R HA 0.258 4.598 4.340 -0.000 0.000 0.271 1004 R C 0.637 176.942 176.300 0.009 0.000 1.078 1004 R CA -0.775 55.322 56.100 -0.006 0.000 1.127 1004 R CB 0.557 30.845 30.300 -0.021 0.000 1.038 1004 R HN 0.016 nan 8.270 nan 0.000 0.500 1005 I N 2.238 122.818 120.570 0.017 0.000 2.648 1005 I HA 0.018 4.188 4.170 -0.000 0.000 0.284 1005 I C 0.146 176.282 176.117 0.031 0.000 1.153 1005 I CA 0.162 61.474 61.300 0.020 0.000 1.426 1005 I CB 0.905 38.914 38.000 0.015 0.000 1.381 1005 I HN 0.247 nan 8.210 nan 0.000 0.571 1006 V N 7.157 127.093 119.914 0.036 0.000 2.487 1006 V HA 0.384 4.504 4.120 -0.000 0.000 0.298 1006 V C -0.185 175.940 176.094 0.052 0.000 1.028 1006 V CA -0.712 61.621 62.300 0.055 0.000 0.860 1006 V CB 2.165 34.027 31.823 0.064 0.000 0.991 1006 V HN 0.395 nan 8.190 nan 0.000 0.427 1007 V N 3.763 123.714 119.914 0.062 0.000 2.304 1007 V HA 0.583 4.703 4.120 -0.000 0.000 0.278 1007 V C -0.777 175.369 176.094 0.087 0.000 1.018 1007 V CA -0.250 62.088 62.300 0.063 0.000 0.814 1007 V CB 1.306 33.156 31.823 0.044 0.000 1.021 1007 V HN 0.924 nan 8.190 nan 0.000 0.440 1008 D N 5.516 125.970 120.400 0.090 0.000 2.613 1008 D HA 0.436 5.076 4.640 -0.000 0.000 0.230 1008 D C -2.445 173.909 176.300 0.091 0.000 1.365 1008 D CA -0.709 53.355 54.000 0.107 0.000 0.976 1008 D CB 2.625 43.494 40.800 0.115 0.000 1.415 1008 D HN 0.418 nan 8.370 nan 0.000 0.589 1009 P HA 0.411 nan 4.420 nan 0.000 0.282 1009 P C -0.036 177.337 177.300 0.121 0.000 1.249 1009 P CA -0.639 62.542 63.100 0.135 0.000 0.806 1009 P CB 1.114 32.903 31.700 0.149 0.000 0.984 1010 I N 2.875 123.521 120.570 0.127 0.000 2.517 1010 I HA 0.033 4.203 4.170 -0.000 0.000 0.285 1010 I C 1.386 177.589 176.117 0.143 0.000 1.106 1010 I CA 0.431 61.800 61.300 0.115 0.000 1.402 1010 I CB 0.158 38.218 38.000 0.099 0.000 1.399 1010 I HN 0.533 nan 8.210 nan 0.000 0.535 1011 T N 3.441 118.090 114.554 0.158 0.000 2.923 1011 T HA 0.497 4.847 4.350 -0.000 0.000 0.281 1011 T C 0.644 175.475 174.700 0.218 0.000 0.995 1011 T CA -0.835 61.355 62.100 0.150 0.000 0.985 1011 T CB 1.291 70.225 68.868 0.109 0.000 1.114 1011 T HN 0.627 nan 8.240 nan 0.000 0.548 1012 R N -0.112 120.455 120.500 0.112 0.000 3.423 1012 R HA -0.131 4.209 4.340 -0.000 0.000 0.271 1012 R C -0.125 176.178 176.300 0.004 0.000 1.093 1012 R CA 0.858 56.954 56.100 -0.007 0.000 0.730 1012 R CB -2.218 27.969 30.300 -0.189 0.000 1.190 1012 R HN 0.810 nan 8.270 nan 0.000 0.437 1013 I N -4.831 115.810 120.570 0.119 0.000 3.343 1013 I HA 0.548 4.718 4.170 -0.000 0.000 0.315 1013 I C -0.123 176.063 176.117 0.114 0.000 1.153 1013 I CA -1.230 60.164 61.300 0.157 0.000 0.952 1013 I CB 1.823 39.948 38.000 0.208 0.000 1.287 1013 I HN -0.232 nan 8.210 nan 0.000 0.472 1014 E N 1.567 121.843 120.200 0.126 0.000 2.259 1014 E HA 0.542 4.892 4.350 -0.000 0.000 0.281 1014 E C 0.170 176.801 176.600 0.052 0.000 1.027 1014 E CA 1.069 57.522 56.400 0.088 0.000 0.838 1014 E CB 1.162 30.935 29.700 0.123 0.000 1.066 1014 E HN 1.005 nan 8.360 nan 0.000 0.401 1015 G N 3.975 112.733 108.800 -0.071 0.000 2.615 1015 G HA2 -0.222 3.738 3.960 -0.000 0.000 0.218 1015 G HA3 -0.222 3.738 3.960 -0.000 0.000 0.218 1015 G C -0.984 173.762 174.900 -0.258 0.000 1.339 1015 G CA -0.303 44.687 45.100 -0.183 0.000 0.884 1015 G HN 0.735 nan 8.290 nan 0.000 0.559 1016 H N -0.682 118.485 119.070 0.162 0.000 2.725 1016 H HA 0.597 5.153 4.556 -0.000 0.000 0.283 1016 H C -0.131 175.317 175.328 0.199 0.000 1.110 1016 H CA -0.470 55.679 56.048 0.168 0.000 1.289 1016 H CB 1.332 31.190 29.762 0.160 0.000 1.400 1016 H HN 0.558 nan 8.280 nan 0.000 0.493 1017 L N 2.679 124.064 121.223 0.269 0.000 2.346 1017 L HA 0.521 4.861 4.340 -0.000 0.000 0.276 1017 L C -0.693 176.312 176.870 0.226 0.000 1.006 1017 L CA -0.676 54.313 54.840 0.249 0.000 0.817 1017 L CB 1.447 43.644 42.059 0.229 0.000 1.272 1017 L HN 0.530 nan 8.230 nan 0.000 0.421 1018 R N 5.588 126.228 120.500 0.232 0.000 2.480 1018 R HA 0.641 4.981 4.340 -0.000 0.000 0.306 1018 R C -1.613 174.797 176.300 0.183 0.000 0.958 1018 R CA -0.682 55.543 56.100 0.208 0.000 0.861 1018 R CB 1.124 31.577 30.300 0.255 0.000 1.171 1018 R HN 0.625 nan 8.270 nan 0.000 0.445 1019 I N 3.532 124.186 120.570 0.140 0.000 2.404 1019 I HA 0.337 4.507 4.170 -0.000 0.000 0.293 1019 I C -0.177 176.003 176.117 0.105 0.000 0.992 1019 I CA -0.564 60.807 61.300 0.118 0.000 1.149 1019 I CB 1.861 39.904 38.000 0.072 0.000 1.315 1019 I HN 0.698 nan 8.210 nan 0.000 0.446 1020 E N 4.196 124.465 120.200 0.116 0.000 2.199 1020 E HA 0.740 5.089 4.350 -0.000 0.000 0.269 1020 E C -0.929 175.754 176.600 0.137 0.000 0.899 1020 E CA -0.845 55.613 56.400 0.098 0.000 0.772 1020 E CB 2.811 32.532 29.700 0.036 0.000 1.155 1020 E HN 0.693 nan 8.360 nan 0.000 0.408 1021 A N 2.587 125.459 122.820 0.088 0.000 2.343 1021 A HA 0.329 4.649 4.320 -0.000 0.000 0.308 1021 A C -0.893 176.732 177.584 0.068 0.000 1.092 1021 A CA -0.722 51.360 52.037 0.074 0.000 0.751 1021 A CB 1.530 20.547 19.000 0.027 0.000 1.203 1021 A HN 0.445 nan 8.150 nan 0.000 0.452 1022 Q N 2.768 122.621 119.800 0.089 0.000 2.337 1022 Q HA 0.463 4.803 4.340 -0.000 0.000 0.255 1022 Q C -0.568 175.449 176.000 0.030 0.000 0.997 1022 Q CA 0.043 55.882 55.803 0.060 0.000 0.925 1022 Q CB 0.283 29.077 28.738 0.093 0.000 1.212 1022 Q HN 0.634 nan 8.270 nan 0.000 0.436 1023 M N 2.400 122.012 119.600 0.020 0.000 2.314 1023 M HA 0.302 4.782 4.480 -0.000 0.000 0.342 1023 M C -0.570 175.736 176.300 0.009 0.000 1.171 1023 M CA -0.485 54.823 55.300 0.013 0.000 1.098 1023 M CB 1.130 33.736 32.600 0.011 0.000 1.559 1023 M HN 0.574 nan 8.290 nan 0.000 0.459 1024 D N 1.292 121.696 120.400 0.008 0.000 2.440 1024 D HA 0.510 5.150 4.640 -0.000 0.000 0.252 1024 D C 0.773 177.075 176.300 0.004 0.000 1.180 1024 D CA 0.632 54.635 54.000 0.004 0.000 0.894 1024 D CB 0.729 41.531 40.800 0.003 0.000 1.111 1024 D HN 0.838 nan 8.370 nan 0.000 0.544 1025 G N 3.613 112.414 108.800 0.003 0.000 2.634 1025 G HA2 -0.338 3.622 3.960 -0.000 0.000 0.318 1025 G HA3 -0.338 3.622 3.960 -0.000 0.000 0.318 1025 G C 1.036 175.940 174.900 0.005 0.000 1.207 1025 G CA 0.984 46.086 45.100 0.003 0.000 0.987 1025 G HN 1.085 nan 8.290 nan 0.000 0.547 1026 A N -0.710 122.114 122.820 0.006 0.000 2.267 1026 A HA 0.573 4.893 4.320 -0.000 0.000 0.213 1026 A C 1.262 178.856 177.584 0.017 0.000 1.192 1026 A CA 1.742 53.785 52.037 0.011 0.000 0.851 1026 A CB 0.011 19.017 19.000 0.010 0.000 0.881 1026 A HN 0.982 nan 8.150 nan 0.000 0.494 1027 T N 1.062 115.625 114.554 0.014 0.000 2.856 1027 T HA 0.406 4.756 4.350 -0.000 0.000 0.292 1027 T C 0.134 174.847 174.700 0.022 0.000 0.980 1027 T CA 0.014 62.125 62.100 0.020 0.000 1.091 1027 T CB 0.678 69.552 68.868 0.011 0.000 0.936 1027 T HN 0.228 nan 8.240 nan 0.000 0.503 1028 I N 3.333 123.923 120.570 0.034 0.000 2.483 1028 I HA 0.121 4.291 4.170 -0.000 0.000 0.291 1028 I C 1.329 177.445 176.117 -0.001 0.000 1.112 1028 I CA -0.262 61.048 61.300 0.016 0.000 1.350 1028 I CB 0.634 38.639 38.000 0.009 0.000 1.419 1028 I HN 0.800 nan 8.210 nan 0.000 0.523 1029 A N 6.448 129.264 122.820 -0.007 0.000 1.887 1029 A HA 0.115 4.435 4.320 -0.000 0.000 0.212 1029 A C 0.896 178.452 177.584 -0.046 0.000 1.198 1029 A CA 0.845 52.872 52.037 -0.016 0.000 0.628 1029 A CB 0.281 19.278 19.000 -0.004 0.000 0.847 1029 A HN 0.638 nan 8.150 nan 0.000 0.449 1030 Q N -1.440 118.326 119.800 -0.056 0.000 2.359 1030 Q HA 0.692 5.032 4.340 -0.000 0.000 0.274 1030 Q C -1.274 174.601 176.000 -0.208 0.000 1.074 1030 Q CA -0.256 55.450 55.803 -0.161 0.000 0.810 1030 Q CB 2.033 30.710 28.738 -0.101 0.000 1.342 1030 Q HN 0.404 nan 8.270 nan 0.000 0.427 1031 A N 2.006 124.580 122.820 -0.411 0.000 2.435 1031 A HA 0.859 5.179 4.320 -0.000 0.000 0.304 1031 A C -1.771 175.456 177.584 -0.596 0.000 1.064 1031 A CA -0.481 51.380 52.037 -0.295 0.000 0.727 1031 A CB 1.216 20.119 19.000 -0.162 0.000 1.284 1031 A HN 0.603 nan 8.150 nan 0.000 0.415 1032 Y N 0.336 120.570 120.300 -0.110 0.000 2.406 1032 Y HA 0.594 5.144 4.550 -0.000 0.000 0.340 1032 Y C 0.487 176.393 175.900 0.009 0.000 0.975 1032 Y CA -0.434 57.576 58.100 -0.150 0.000 1.056 1032 Y CB 2.557 40.745 38.460 -0.453 0.000 1.210 1032 Y HN 0.608 nan 8.280 nan 0.000 0.448 1033 S N 2.419 118.272 115.700 0.255 0.000 2.449 1033 S HA 0.655 5.125 4.470 -0.000 0.000 0.310 1033 S C -0.843 173.902 174.600 0.243 0.000 1.096 1033 S CA -0.366 57.960 58.200 0.211 0.000 1.095 1033 S CB 0.924 64.191 63.200 0.111 0.000 1.007 1033 S HN 0.602 nan 8.310 nan 0.000 0.474 1034 S N 3.665 119.494 115.700 0.216 0.000 2.672 1034 S HA 0.680 5.150 4.470 -0.000 0.000 0.291 1034 S C -0.117 174.612 174.600 0.215 0.000 1.145 1034 S CA -0.460 57.854 58.200 0.190 0.000 1.013 1034 S CB 0.832 64.187 63.200 0.258 0.000 1.017 1034 S HN 1.002 nan 8.310 nan 0.000 0.487 1035 G N 2.004 110.921 108.800 0.195 0.000 2.338 1035 G HA2 0.460 4.420 3.960 -0.000 0.000 0.298 1035 G HA3 0.460 4.420 3.960 -0.000 0.000 0.298 1035 G C 0.565 175.777 174.900 0.520 0.000 1.140 1035 G CA -0.348 44.942 45.100 0.317 0.000 0.860 1035 G HN 0.881 nan 8.290 nan 0.000 0.470 1036 T N 0.148 115.019 114.554 0.529 0.000 3.266 1036 T HA 0.463 4.813 4.350 -0.000 0.000 0.278 1036 T C 0.312 175.270 174.700 0.431 0.000 1.010 1036 T CA -0.475 61.995 62.100 0.617 0.000 0.909 1036 T CB -0.005 69.136 68.868 0.455 0.000 1.122 1036 T HN 0.415 nan 8.240 nan 0.000 0.536 1037 M N 1.818 121.620 119.600 0.337 0.000 2.371 1037 M HA 0.652 5.132 4.480 -0.000 0.000 0.287 1037 M C -2.144 174.052 176.300 -0.172 0.000 1.149 1037 M CA -0.867 54.440 55.300 0.013 0.000 0.929 1037 M CB 2.268 34.918 32.600 0.085 0.000 1.683 1037 M HN 0.102 nan 8.290 nan 0.000 0.470 1038 V N 6.002 125.597 119.914 -0.532 0.000 3.040 1038 V HA 0.650 4.770 4.120 -0.000 0.000 0.312 1038 V C -0.143 175.753 176.094 -0.330 0.000 1.115 1038 V CA -0.247 61.738 62.300 -0.525 0.000 0.998 1038 V CB 2.680 33.823 31.823 -1.134 0.000 1.042 1038 V HN 1.076 nan 8.190 nan 0.000 0.433 1039 R N 2.774 123.162 120.500 -0.187 0.000 2.470 1039 R HA 0.411 4.750 4.340 -0.000 0.000 0.210 1039 R C 1.084 177.336 176.300 -0.081 0.000 0.873 1039 R CA 0.567 56.600 56.100 -0.113 0.000 1.015 1039 R CB 0.931 31.208 30.300 -0.039 0.000 1.348 1039 R HN 1.328 nan 8.270 nan 0.000 0.650 1040 G N 1.749 110.520 108.800 -0.050 0.000 2.248 1040 G HA2 -0.233 3.727 3.960 -0.000 0.000 0.263 1040 G HA3 -0.233 3.727 3.960 -0.000 0.000 0.263 1040 G C 0.535 175.446 174.900 0.019 0.000 1.082 1040 G CA 0.162 45.262 45.100 0.001 0.000 0.863 1040 G HN 0.225 nan 8.290 nan 0.000 0.495 1041 I N -0.263 120.328 120.570 0.035 0.000 2.361 1041 I HA -0.146 4.024 4.170 -0.000 0.000 0.251 1041 I C 2.588 178.692 176.117 -0.023 0.000 1.133 1041 I CA 1.867 63.177 61.300 0.016 0.000 1.413 1041 I CB -0.188 37.822 38.000 0.016 0.000 1.073 1041 I HN 0.449 nan 8.210 nan 0.000 0.424 1042 E N 0.206 120.426 120.200 0.033 0.000 2.085 1042 E HA -0.207 4.143 4.350 -0.000 0.000 0.194 1042 E C 2.125 178.726 176.600 0.001 0.000 0.994 1042 E CA 1.940 58.356 56.400 0.028 0.000 0.801 1042 E CB -0.168 29.596 29.700 0.107 0.000 0.743 1042 E HN 0.457 nan 8.360 nan 0.000 0.453 1043 T N 0.977 115.540 114.554 0.014 0.000 2.777 1043 T HA -0.085 4.265 4.350 -0.000 0.000 0.266 1043 T C 1.931 176.611 174.700 -0.033 0.000 1.040 1043 T CA 0.818 62.921 62.100 0.006 0.000 1.141 1043 T CB -0.171 68.713 68.868 0.027 0.000 0.868 1043 T HN 0.111 nan 8.240 nan 0.000 0.444 1044 I N 0.891 121.434 120.570 -0.045 0.000 2.335 1044 I HA -0.144 4.026 4.170 -0.000 0.000 0.251 1044 I C 2.076 178.069 176.117 -0.206 0.000 1.129 1044 I CA 1.168 62.423 61.300 -0.074 0.000 1.402 1044 I CB -0.405 37.592 38.000 -0.004 0.000 1.069 1044 I HN 0.204 nan 8.210 nan 0.000 0.424 1045 L N 0.176 121.241 121.223 -0.262 0.000 2.275 1045 L HA -0.109 4.230 4.340 -0.000 0.000 0.215 1045 L C 0.973 177.696 176.870 -0.245 0.000 1.119 1045 L CA 0.502 55.101 54.840 -0.401 0.000 0.790 1045 L CB -0.386 41.420 42.059 -0.422 0.000 0.919 1045 L HN 0.040 nan 8.230 nan 0.000 0.443 1046 K N 0.385 120.707 120.400 -0.129 0.000 2.472 1046 K HA 0.194 4.514 4.320 -0.000 0.000 0.280 1046 K C 0.996 177.554 176.600 -0.071 0.000 1.028 1046 K CA 1.047 57.297 56.287 -0.062 0.000 1.045 1046 K CB 0.214 32.696 32.500 -0.029 0.000 0.902 1046 K HN 0.228 nan 8.250 nan 0.000 0.478 1047 G N 2.539 111.313 108.800 -0.043 0.000 2.176 1047 G HA2 -0.304 3.656 3.960 -0.000 0.000 0.253 1047 G HA3 -0.304 3.656 3.960 -0.000 0.000 0.253 1047 G C 0.168 175.038 174.900 -0.050 0.000 0.979 1047 G CA 0.142 45.222 45.100 -0.033 0.000 0.641 1047 G HN 0.545 nan 8.290 nan 0.000 0.530 1048 R N 0.225 120.666 120.500 -0.098 0.000 2.549 1048 R HA 0.453 4.793 4.340 -0.000 0.000 0.259 1048 R C -0.318 175.956 176.300 -0.042 0.000 1.095 1048 R CA -0.611 55.416 56.100 -0.121 0.000 1.148 1048 R CB 0.425 30.539 30.300 -0.311 0.000 1.181 1048 R HN 0.182 nan 8.270 nan 0.000 0.571 1049 D N 0.905 121.296 120.400 -0.014 0.000 2.348 1049 D HA 0.051 4.691 4.640 -0.000 0.000 0.253 1049 D C -1.720 174.641 176.300 0.103 0.000 1.161 1049 D CA -1.837 52.206 54.000 0.071 0.000 0.876 1049 D CB 1.438 42.273 40.800 0.058 0.000 1.160 1049 D HN 0.120 nan 8.370 nan 0.000 0.459 1050 P HA -0.088 nan 4.420 nan 0.000 0.218 1050 P C 1.053 178.467 177.300 0.190 0.000 1.148 1050 P CA 1.090 64.281 63.100 0.152 0.000 0.822 1050 P CB 0.246 31.976 31.700 0.049 0.000 0.784 1051 R N -0.753 119.884 120.500 0.228 0.000 2.193 1051 R HA -0.106 4.234 4.340 -0.000 0.000 0.229 1051 R C 1.206 177.710 176.300 0.340 0.000 1.110 1051 R CA 1.190 57.459 56.100 0.283 0.000 0.988 1051 R CB -0.576 29.782 30.300 0.097 0.000 0.871 1051 R HN 0.235 nan 8.270 nan 0.000 0.458 1052 D N 0.111 120.619 120.400 0.180 0.000 2.333 1052 D HA 0.060 4.700 4.640 -0.000 0.000 0.208 1052 D C 1.643 177.932 176.300 -0.019 0.000 0.984 1052 D CA 0.667 54.713 54.000 0.077 0.000 0.873 1052 D CB 0.047 40.923 40.800 0.127 0.000 0.935 1052 D HN 0.168 nan 8.370 nan 0.000 0.521 1053 A N 1.778 124.629 122.820 0.052 0.000 1.917 1053 A HA -0.189 4.131 4.320 -0.000 0.000 0.219 1053 A C 2.108 179.706 177.584 0.024 0.000 1.182 1053 A CA 1.595 53.623 52.037 -0.016 0.000 0.633 1053 A CB -1.329 17.717 19.000 0.075 0.000 0.819 1053 A HN 0.589 nan 8.150 nan 0.000 0.448 1054 W N -0.476 120.948 121.300 0.206 0.000 2.342 1054 W HA -0.098 4.562 4.660 -0.000 0.000 0.297 1054 W C 1.897 178.519 176.519 0.172 0.000 1.213 1054 W CA 1.364 58.822 57.345 0.188 0.000 1.251 1054 W CB -1.164 28.409 29.460 0.189 0.000 1.136 1054 W HN 0.399 nan 8.180 nan 0.000 0.526 1055 A N 0.766 122.871 122.820 -1.190 0.000 1.930 1055 A HA -0.071 4.249 4.320 -0.000 0.000 0.217 1055 A C 1.844 179.123 177.584 -0.509 0.000 1.175 1055 A CA 1.444 52.773 52.037 -1.180 0.000 0.627 1055 A CB -1.241 16.948 19.000 -1.351 0.000 0.815 1055 A HN 0.250 nan 8.150 nan 0.000 0.443 1056 F N 0.006 119.717 119.950 -0.398 0.000 2.074 1056 F HA -0.116 4.411 4.527 -0.000 0.000 0.293 1056 F C 2.572 178.238 175.800 -0.223 0.000 1.116 1056 F CA 1.848 59.683 58.000 -0.274 0.000 1.212 1056 F CB -0.685 38.155 39.000 -0.266 0.000 0.998 1056 F HN 0.137 nan 8.300 nan 0.000 0.471 1057 V N -1.477 118.446 119.914 0.015 0.000 2.809 1057 V HA -0.221 3.899 4.120 -0.000 0.000 0.256 1057 V C 1.967 178.084 176.094 0.038 0.000 1.080 1057 V CA 1.665 63.944 62.300 -0.034 0.000 1.102 1057 V CB -1.210 30.594 31.823 -0.031 0.000 0.705 1057 V HN 0.494 nan 8.190 nan 0.000 0.475 1058 Q N 0.568 120.424 119.800 0.094 0.000 2.181 1058 Q HA -0.225 4.115 4.340 -0.000 0.000 0.205 1058 Q C 2.038 177.996 176.000 -0.069 0.000 0.980 1058 Q CA 1.823 57.697 55.803 0.118 0.000 0.862 1058 Q CB -0.032 28.811 28.738 0.176 0.000 0.905 1058 Q HN 0.528 nan 8.270 nan 0.000 0.429 1059 R N -0.047 120.334 120.500 -0.198 0.000 2.319 1059 R HA 0.157 4.497 4.340 -0.000 0.000 0.204 1059 R C 1.561 177.857 176.300 -0.007 0.000 0.954 1059 R CA 0.184 56.189 56.100 -0.157 0.000 1.066 1059 R CB -0.207 29.980 30.300 -0.188 0.000 0.991 1059 R HN 0.394 nan 8.270 nan 0.000 0.486 1060 I N -1.250 119.292 120.570 -0.046 0.000 2.248 1060 I HA -0.306 3.864 4.170 -0.000 0.000 0.248 1060 I C 0.625 176.799 176.117 0.095 0.000 1.107 1060 I CA 0.988 62.254 61.300 -0.056 0.000 1.373 1060 I CB 0.006 37.767 38.000 -0.397 0.000 1.055 1060 I HN 0.152 nan 8.210 nan 0.000 0.418 1061 C N -0.372 119.055 119.300 0.211 0.000 3.046 1061 C HA 0.494 4.953 4.460 -0.000 0.000 0.388 1061 C C 1.011 176.228 174.990 0.378 0.000 1.041 1061 C CA -0.553 58.633 59.018 0.281 0.000 1.241 1061 C CB 0.925 28.846 27.740 0.300 0.000 1.638 1061 C HN 0.495 nan 8.230 nan 0.000 0.539 1062 G N 2.779 111.741 108.800 0.270 0.000 3.126 1062 G HA2 0.241 4.201 3.960 -0.000 0.000 0.224 1062 G HA3 0.241 4.201 3.960 -0.000 0.000 0.224 1062 G C 0.932 175.874 174.900 0.071 0.000 1.142 1062 G CA 0.959 46.116 45.100 0.096 0.000 0.759 1062 G HN 0.701 nan 8.290 nan 0.000 0.550 1063 V N 1.370 121.366 119.914 0.137 0.000 2.249 1063 V HA -0.102 4.018 4.120 -0.000 0.000 0.239 1063 V C 2.468 178.656 176.094 0.156 0.000 1.038 1063 V CA 1.570 63.956 62.300 0.144 0.000 1.005 1063 V CB -0.709 31.205 31.823 0.153 0.000 0.646 1063 V HN 0.585 nan 8.190 nan 0.000 0.455 1064 C N 1.342 120.740 119.300 0.163 0.000 3.297 1064 C HA 0.343 4.803 4.460 -0.000 0.000 0.533 1064 C C 1.262 176.367 174.990 0.192 0.000 1.228 1064 C CA -0.943 58.158 59.018 0.137 0.000 1.402 1064 C CB -2.626 25.165 27.740 0.085 0.000 1.728 1064 C HN 0.496 nan 8.230 nan 0.000 0.637 1065 T N 0.292 114.975 114.554 0.214 0.000 2.716 1065 T HA 0.179 4.529 4.350 -0.000 0.000 0.335 1065 T C 1.107 175.969 174.700 0.270 0.000 1.081 1065 T CA 1.337 63.622 62.100 0.309 0.000 1.073 1065 T CB 0.191 69.192 68.868 0.221 0.000 0.993 1065 T HN 1.505 nan 8.240 nan 0.000 0.547 1066 L N 1.447 122.862 121.223 0.320 0.000 3.417 1066 L HA -0.289 4.051 4.340 -0.000 0.000 0.368 1066 L C 1.874 178.715 176.870 -0.048 0.000 0.810 1066 L CA 2.388 57.356 54.840 0.214 0.000 3.108 1066 L CB -1.984 40.187 42.059 0.187 0.000 0.687 1066 L HN 0.656 nan 8.230 nan 0.000 0.756 1067 V N -2.846 117.054 119.914 -0.024 0.000 2.407 1067 V HA -0.226 3.894 4.120 -0.000 0.000 0.248 1067 V C 2.304 178.233 176.094 -0.275 0.000 1.055 1067 V CA 2.128 64.322 62.300 -0.177 0.000 1.049 1067 V CB -1.082 30.617 31.823 -0.207 0.000 0.662 1067 V HN 0.708 nan 8.190 nan 0.000 0.455 1068 H N 1.008 120.065 119.070 -0.021 0.000 2.470 1068 H HA 0.142 4.698 4.556 -0.000 0.000 0.289 1068 H C 2.421 177.741 175.328 -0.013 0.000 1.033 1068 H CA 1.333 57.399 56.048 0.029 0.000 1.331 1068 H CB -0.388 29.505 29.762 0.220 0.000 1.414 1068 H HN 0.585 nan 8.280 nan 0.000 0.545 1069 G N 1.779 110.566 108.800 -0.022 0.000 2.480 1069 G HA2 -0.195 3.765 3.960 -0.000 0.000 0.216 1069 G HA3 -0.195 3.765 3.960 -0.000 0.000 0.216 1069 G C 1.742 176.299 174.900 -0.572 0.000 1.200 1069 G CA 0.548 45.481 45.100 -0.278 0.000 0.782 1069 G HN 0.196 nan 8.290 nan 0.000 0.554 1070 I N 1.833 121.949 120.570 -0.757 0.000 2.179 1070 I HA -0.170 4.000 4.170 -0.000 0.000 0.242 1070 I C 3.308 179.252 176.117 -0.288 0.000 1.088 1070 I CA 1.411 62.416 61.300 -0.492 0.000 1.357 1070 I CB -1.209 36.573 38.000 -0.364 0.000 1.051 1070 I HN 0.276 nan 8.210 nan 0.000 0.409 1071 A N -0.083 122.538 122.820 -0.331 0.000 1.933 1071 A HA -0.219 4.101 4.320 -0.000 0.000 0.218 1071 A C 2.615 180.042 177.584 -0.261 0.000 1.175 1071 A CA 2.184 53.970 52.037 -0.419 0.000 0.628 1071 A CB -0.686 17.830 19.000 -0.805 0.000 0.814 1071 A HN 0.434 nan 8.150 nan 0.000 0.444 1072 S N -0.422 115.256 115.700 -0.036 0.000 2.345 1072 S HA -0.136 4.334 4.470 -0.000 0.000 0.219 1072 S C 2.099 176.825 174.600 0.211 0.000 1.031 1072 S CA 1.951 60.343 58.200 0.320 0.000 0.984 1072 S CB -0.810 62.700 63.200 0.516 0.000 0.874 1072 S HN 0.960 nan 8.310 nan 0.000 0.451 1073 V N 0.751 120.756 119.914 0.151 0.000 2.407 1073 V HA -0.083 4.037 4.120 -0.000 0.000 0.248 1073 V C 2.329 178.450 176.094 0.045 0.000 1.055 1073 V CA 1.825 64.202 62.300 0.128 0.000 1.049 1073 V CB -1.101 30.777 31.823 0.092 0.000 0.662 1073 V HN 0.374 nan 8.190 nan 0.000 0.455 1074 R N 0.959 121.447 120.500 -0.021 0.000 2.105 1074 R HA -0.043 4.297 4.340 -0.000 0.000 0.239 1074 R C 2.547 178.811 176.300 -0.060 0.000 1.135 1074 R CA 1.620 57.689 56.100 -0.051 0.000 0.967 1074 R CB -0.690 29.554 30.300 -0.094 0.000 0.861 1074 R HN 0.654 nan 8.270 nan 0.000 0.442 1075 A N 0.479 123.265 122.820 -0.056 0.000 1.897 1075 A HA -0.078 4.241 4.320 -0.000 0.000 0.215 1075 A C 2.320 179.868 177.584 -0.059 0.000 1.181 1075 A CA 1.170 53.155 52.037 -0.087 0.000 0.620 1075 A CB -0.348 18.590 19.000 -0.104 0.000 0.821 1075 A HN 0.107 nan 8.150 nan 0.000 0.443 1076 V N 0.122 120.028 119.914 -0.014 0.000 2.358 1076 V HA -0.247 3.872 4.120 -0.000 0.000 0.246 1076 V C 2.328 178.363 176.094 -0.098 0.000 1.047 1076 V CA 2.213 64.474 62.300 -0.064 0.000 1.035 1076 V CB -0.952 30.863 31.823 -0.014 0.000 0.658 1076 V HN 0.622 nan 8.190 nan 0.000 0.452 1077 E N 0.100 120.275 120.200 -0.042 0.000 2.110 1077 E HA -0.269 4.081 4.350 -0.000 0.000 0.193 1077 E C 1.950 178.514 176.600 -0.059 0.000 0.988 1077 E CA 1.574 57.948 56.400 -0.043 0.000 0.804 1077 E CB -0.185 29.508 29.700 -0.013 0.000 0.745 1077 E HN 0.674 nan 8.360 nan 0.000 0.458 1078 D N 0.147 120.512 120.400 -0.058 0.000 2.097 1078 D HA -0.108 4.532 4.640 -0.000 0.000 0.197 1078 D C 1.907 178.174 176.300 -0.055 0.000 0.984 1078 D CA 1.437 55.407 54.000 -0.051 0.000 0.826 1078 D CB -0.059 40.706 40.800 -0.057 0.000 0.973 1078 D HN 0.145 nan 8.370 nan 0.000 0.460 1079 A N -0.228 122.547 122.820 -0.074 0.000 1.940 1079 A HA -0.097 4.223 4.320 -0.000 0.000 0.219 1079 A C 1.798 179.309 177.584 -0.122 0.000 1.176 1079 A CA 1.058 53.042 52.037 -0.089 0.000 0.631 1079 A CB -0.408 18.523 19.000 -0.116 0.000 0.814 1079 A HN 0.346 nan 8.150 nan 0.000 0.446 1080 L N -1.495 119.631 121.223 -0.162 0.000 2.640 1080 L HA 0.240 4.580 4.340 -0.000 0.000 0.230 1080 L C 0.596 177.413 176.870 -0.088 0.000 1.123 1080 L CA 0.460 55.194 54.840 -0.178 0.000 0.900 1080 L CB -0.767 41.102 42.059 -0.316 0.000 1.146 1080 L HN 0.433 nan 8.230 nan 0.000 0.484 1081 R N 0.141 120.603 120.500 -0.064 0.000 3.267 1081 R HA -0.180 4.160 4.340 -0.000 0.000 0.254 1081 R C -0.251 176.032 176.300 -0.028 0.000 0.993 1081 R CA 0.310 56.388 56.100 -0.036 0.000 0.670 1081 R CB -2.381 27.905 30.300 -0.023 0.000 1.125 1081 R HN 0.221 nan 8.270 nan 0.000 0.434 1082 I N 1.214 121.764 120.570 -0.033 0.000 2.312 1082 I HA 0.068 4.238 4.170 -0.000 0.000 0.291 1082 I C 0.824 176.927 176.117 -0.024 0.000 1.031 1082 I CA -0.434 60.852 61.300 -0.023 0.000 1.293 1082 I CB 1.090 39.081 38.000 -0.015 0.000 1.403 1082 I HN 0.081 nan 8.210 nan 0.000 0.484 1083 E N 6.258 126.443 120.200 -0.025 0.000 2.289 1083 E HA 0.284 4.634 4.350 -0.000 0.000 0.278 1083 E C -1.036 175.544 176.600 -0.032 0.000 1.032 1083 E CA -0.517 55.869 56.400 -0.024 0.000 0.854 1083 E CB 0.909 30.597 29.700 -0.021 0.000 1.046 1083 E HN 0.320 nan 8.360 nan 0.000 0.409 1084 L N 6.993 128.201 121.223 -0.024 0.000 2.380 1084 L HA 0.351 4.691 4.340 -0.000 0.000 0.273 1084 L C -2.102 174.753 176.870 -0.026 0.000 1.138 1084 L CA -1.779 53.046 54.840 -0.025 0.000 0.832 1084 L CB 0.578 42.627 42.059 -0.017 0.000 1.124 1084 L HN 0.637 nan 8.230 nan 0.000 0.454 1085 P HA -0.007 nan 4.420 nan 0.000 0.266 1085 P C 1.096 178.386 177.300 -0.017 0.000 1.195 1085 P CA -0.113 62.976 63.100 -0.019 0.000 0.768 1085 P CB 0.539 32.232 31.700 -0.011 0.000 0.838 1086 L N 2.401 123.616 121.223 -0.013 0.000 2.051 1086 L HA -0.285 4.055 4.340 -0.000 0.000 0.214 1086 L C 1.646 178.503 176.870 -0.022 0.000 1.076 1086 L CA 1.904 56.736 54.840 -0.013 0.000 0.758 1086 L CB -0.337 41.719 42.059 -0.004 0.000 0.890 1086 L HN 0.405 nan 8.230 nan 0.000 0.433 1087 N N 0.026 118.715 118.700 -0.017 0.000 2.223 1087 N HA -0.142 4.598 4.740 -0.000 0.000 0.185 1087 N C 1.736 177.217 175.510 -0.047 0.000 1.016 1087 N CA 1.410 54.446 53.050 -0.024 0.000 0.863 1087 N CB -0.254 38.228 38.487 -0.008 0.000 0.983 1087 N HN 0.435 nan 8.380 nan 0.000 0.429 1088 A N 0.631 123.429 122.820 -0.036 0.000 1.930 1088 A HA -0.152 4.168 4.320 -0.000 0.000 0.217 1088 A C 2.246 179.783 177.584 -0.078 0.000 1.175 1088 A CA 1.352 53.362 52.037 -0.045 0.000 0.627 1088 A CB -0.508 18.489 19.000 -0.005 0.000 0.815 1088 A HN 0.220 nan 8.150 nan 0.000 0.443 1089 Q N -0.830 118.926 119.800 -0.074 0.000 2.079 1089 Q HA -0.074 4.266 4.340 -0.000 0.000 0.200 1089 Q C 1.784 177.677 176.000 -0.178 0.000 0.974 1089 Q CA 1.233 56.972 55.803 -0.106 0.000 0.840 1089 Q CB -0.291 28.404 28.738 -0.073 0.000 0.898 1089 Q HN 0.424 nan 8.270 nan 0.000 0.430 1090 L N 0.042 121.178 121.223 -0.144 0.000 2.056 1090 L HA -0.081 4.259 4.340 -0.000 0.000 0.207 1090 L C 2.156 178.900 176.870 -0.210 0.000 1.078 1090 L CA 1.520 56.261 54.840 -0.166 0.000 0.749 1090 L CB -0.979 41.056 42.059 -0.040 0.000 0.901 1090 L HN 0.350 nan 8.230 nan 0.000 0.433 1091 I N -1.003 119.430 120.570 -0.228 0.000 2.286 1091 I HA -0.312 3.858 4.170 -0.000 0.000 0.248 1091 I C 2.628 178.549 176.117 -0.325 0.000 1.115 1091 I CA 0.939 61.993 61.300 -0.411 0.000 1.392 1091 I CB -0.214 37.505 38.000 -0.469 0.000 1.065 1091 I HN 0.254 nan 8.210 nan 0.000 0.418 1092 R N 0.656 121.023 120.500 -0.220 0.000 2.081 1092 R HA -0.143 4.197 4.340 -0.000 0.000 0.235 1092 R C 2.070 178.242 176.300 -0.213 0.000 1.131 1092 R CA 1.742 57.754 56.100 -0.147 0.000 0.960 1092 R CB -0.501 29.735 30.300 -0.107 0.000 0.856 1092 R HN 0.508 nan 8.270 nan 0.000 0.436 1093 N N 0.524 118.983 118.700 -0.402 0.000 2.069 1093 N HA -0.176 4.564 4.740 -0.000 0.000 0.191 1093 N C 1.882 177.083 175.510 -0.514 0.000 1.031 1093 N CA 0.993 53.588 53.050 -0.759 0.000 0.852 1093 N CB -0.137 37.420 38.487 -1.551 0.000 1.018 1093 N HN 0.116 nan 8.380 nan 0.000 0.423 1094 L N 0.697 121.796 121.223 -0.206 0.000 2.012 1094 L HA -0.195 4.145 4.340 -0.000 0.000 0.210 1094 L C 2.444 179.469 176.870 0.258 0.000 1.073 1094 L CA 1.301 56.265 54.840 0.207 0.000 0.748 1094 L CB -0.306 41.976 42.059 0.372 0.000 0.891 1094 L HN 0.255 nan 8.230 nan 0.000 0.431 1095 M N -0.936 118.807 119.600 0.238 0.000 2.175 1095 M HA -0.193 4.287 4.480 -0.000 0.000 0.264 1095 M C 2.264 178.770 176.300 0.344 0.000 1.063 1095 M CA 1.709 57.251 55.300 0.403 0.000 1.119 1095 M CB -0.261 32.444 32.600 0.174 0.000 1.377 1095 M HN 0.181 nan 8.290 nan 0.000 0.415 1096 I N -0.177 120.482 120.570 0.150 0.000 2.179 1096 I HA -0.198 3.972 4.170 -0.000 0.000 0.242 1096 I C 2.597 178.853 176.117 0.231 0.000 1.088 1096 I CA 1.477 62.876 61.300 0.166 0.000 1.357 1096 I CB -0.888 37.126 38.000 0.022 0.000 1.051 1096 I HN 0.356 nan 8.210 nan 0.000 0.409 1097 G N 0.433 109.311 108.800 0.130 0.000 2.446 1097 G HA2 -0.283 3.677 3.960 -0.000 0.000 0.217 1097 G HA3 -0.283 3.677 3.960 -0.000 0.000 0.217 1097 G C 1.866 176.846 174.900 0.135 0.000 1.168 1097 G CA 0.880 46.080 45.100 0.167 0.000 0.771 1097 G HN 0.495 nan 8.290 nan 0.000 0.551 1098 A N 0.272 123.088 122.820 -0.005 0.000 1.917 1098 A HA -0.185 4.135 4.320 -0.000 0.000 0.219 1098 A C 2.329 179.918 177.584 0.008 0.000 1.182 1098 A CA 2.486 54.416 52.037 -0.179 0.000 0.633 1098 A CB -0.519 18.166 19.000 -0.525 0.000 0.819 1098 A HN 0.452 nan 8.150 nan 0.000 0.448 1099 Q N -1.274 118.639 119.800 0.187 0.000 2.050 1099 Q HA -0.178 4.162 4.340 -0.000 0.000 0.202 1099 Q C 1.770 177.886 176.000 0.194 0.000 0.980 1099 Q CA 2.111 58.046 55.803 0.220 0.000 0.840 1099 Q CB -0.664 28.277 28.738 0.339 0.000 0.898 1099 Q HN 0.669 nan 8.270 nan 0.000 0.424 1100 Y N 0.114 120.428 120.300 0.022 0.000 2.114 1100 Y HA -0.236 4.314 4.550 -0.000 0.000 0.282 1100 Y C 2.102 177.946 175.900 -0.092 0.000 1.165 1100 Y CA 1.827 59.840 58.100 -0.144 0.000 1.148 1100 Y CB -0.283 38.131 38.460 -0.076 0.000 0.972 1100 Y HN 0.153 nan 8.280 nan 0.000 0.504 1101 I N -1.396 119.342 120.570 0.280 0.000 2.142 1101 I HA -0.359 3.811 4.170 -0.000 0.000 0.240 1101 I C 2.638 179.006 176.117 0.417 0.000 1.078 1101 I CA 1.701 63.204 61.300 0.339 0.000 1.343 1101 I CB -0.630 37.563 38.000 0.322 0.000 1.046 1101 I HN 0.333 nan 8.210 nan 0.000 0.405 1102 H N 0.901 120.120 119.070 0.249 0.000 2.319 1102 H HA -0.256 4.299 4.556 -0.000 0.000 0.297 1102 H C 1.832 177.287 175.328 0.211 0.000 1.097 1102 H CA 2.328 58.494 56.048 0.196 0.000 1.285 1102 H CB -0.159 29.576 29.762 -0.045 0.000 1.368 1102 H HN 0.307 nan 8.280 nan 0.000 0.495 1103 D N -0.423 120.152 120.400 0.291 0.000 2.084 1103 D HA -0.142 4.498 4.640 -0.000 0.000 0.196 1103 D C 2.167 178.636 176.300 0.283 0.000 0.985 1103 D CA 1.012 55.158 54.000 0.243 0.000 0.826 1103 D CB -0.243 40.627 40.800 0.117 0.000 0.978 1103 D HN 0.447 nan 8.370 nan 0.000 0.456 1104 H N -0.190 118.971 119.070 0.151 0.000 2.353 1104 H HA -0.034 4.522 4.556 -0.000 0.000 0.300 1104 H C 2.350 177.634 175.328 -0.073 0.000 1.090 1104 H CA 0.661 56.792 56.048 0.138 0.000 1.327 1104 H CB -0.544 29.371 29.762 0.255 0.000 1.383 1104 H HN 0.051 nan 8.280 nan 0.000 0.508 1105 V N 0.680 120.577 119.914 -0.027 0.000 2.307 1105 V HA -0.240 3.880 4.120 -0.000 0.000 0.245 1105 V C 2.553 178.595 176.094 -0.087 0.000 1.045 1105 V CA 1.622 63.734 62.300 -0.314 0.000 1.024 1105 V CB -0.462 31.229 31.823 -0.221 0.000 0.651 1105 V HN 0.337 nan 8.190 nan 0.000 0.449 1106 M N -1.038 118.567 119.600 0.008 0.000 2.175 1106 M HA -0.159 4.321 4.480 -0.000 0.000 0.264 1106 M C 2.297 178.593 176.300 -0.006 0.000 1.063 1106 M CA 1.731 57.042 55.300 0.019 0.000 1.119 1106 M CB -0.737 31.924 32.600 0.101 0.000 1.377 1106 M HN 0.502 nan 8.290 nan 0.000 0.415 1107 H N 0.083 119.167 119.070 0.024 0.000 2.290 1107 H HA -0.234 4.322 4.556 -0.000 0.000 0.298 1107 H C 2.047 177.367 175.328 -0.013 0.000 1.087 1107 H CA 2.240 58.306 56.048 0.030 0.000 1.291 1107 H CB -0.412 29.400 29.762 0.084 0.000 1.369 1107 H HN 0.352 nan 8.280 nan 0.000 0.492 1108 F N 0.655 120.462 119.950 -0.238 0.000 2.069 1108 F HA -0.295 4.232 4.527 -0.000 0.000 0.298 1108 F C 2.053 177.567 175.800 -0.477 0.000 1.113 1108 F CA 1.912 59.709 58.000 -0.338 0.000 1.214 1108 F CB -0.601 38.147 39.000 -0.419 0.000 0.978 1108 F HN 0.114 nan 8.300 nan 0.000 0.474 1109 Y N -0.823 119.260 120.300 -0.361 0.000 2.176 1109 Y HA -0.113 4.437 4.550 -0.000 0.000 0.291 1109 Y C 2.583 178.180 175.900 -0.504 0.000 1.122 1109 Y CA 2.145 59.950 58.100 -0.491 0.000 1.128 1109 Y CB -1.004 37.061 38.460 -0.659 0.000 1.005 1109 Y HN 0.141 nan 8.280 nan 0.000 0.509 1110 H N -1.330 117.653 119.070 -0.144 0.000 2.482 1110 H HA 0.085 4.641 4.556 -0.000 0.000 0.286 1110 H C 1.655 176.938 175.328 -0.074 0.000 1.017 1110 H CA 1.039 56.962 56.048 -0.208 0.000 1.322 1110 H CB 0.170 29.766 29.762 -0.277 0.000 1.426 1110 H HN 0.219 nan 8.280 nan 0.000 0.546 1111 L N -1.185 119.945 121.223 -0.154 0.000 2.362 1111 L HA 0.046 4.386 4.340 -0.000 0.000 0.204 1111 L C 2.119 178.718 176.870 -0.452 0.000 1.060 1111 L CA 0.473 55.140 54.840 -0.289 0.000 0.827 1111 L CB -0.015 41.861 42.059 -0.305 0.000 1.027 1111 L HN 0.274 nan 8.230 nan 0.000 0.474 1112 H N 0.605 119.296 119.070 -0.632 0.000 2.418 1112 H HA 0.204 4.760 4.556 -0.000 0.000 0.300 1112 H C 2.074 177.233 175.328 -0.282 0.000 1.041 1112 H CA 0.929 56.689 56.048 -0.479 0.000 1.364 1112 H CB 0.283 29.777 29.762 -0.445 0.000 1.439 1112 H HN 0.160 nan 8.280 nan 0.000 0.540 1113 A N 0.858 123.498 122.820 -0.300 0.000 2.024 1113 A HA -0.080 4.240 4.320 -0.000 0.000 0.220 1113 A C 2.366 179.960 177.584 0.017 0.000 1.164 1113 A CA 1.106 52.990 52.037 -0.256 0.000 0.643 1113 A CB -0.883 17.880 19.000 -0.395 0.000 0.806 1113 A HN 0.433 nan 8.150 nan 0.000 0.451 1114 L N -0.373 120.881 121.223 0.052 0.000 2.551 1114 L HA -0.102 4.238 4.340 -0.000 0.000 0.228 1114 L C 1.122 178.047 176.870 0.091 0.000 1.153 1114 L CA 0.522 55.448 54.840 0.143 0.000 0.851 1114 L CB -0.397 41.782 42.059 0.201 0.000 0.959 1114 L HN 0.291 nan 8.230 nan 0.000 0.451 1115 D N -0.870 119.428 120.400 -0.169 0.000 2.317 1115 D HA -0.129 4.511 4.640 -0.000 0.000 0.211 1115 D C 1.480 177.293 176.300 -0.811 0.000 0.966 1115 D CA 1.124 54.785 54.000 -0.565 0.000 0.876 1115 D CB 0.060 40.309 40.800 -0.919 0.000 0.927 1115 D HN 0.443 nan 8.370 nan 0.000 0.519 1116 W N -0.046 121.160 121.300 -0.157 0.000 2.865 1116 W HA 0.237 4.897 4.660 -0.000 0.000 0.300 1116 W C 0.129 176.791 176.519 0.238 0.000 1.096 1116 W CA -0.195 57.018 57.345 -0.220 0.000 1.524 1116 W CB 0.655 29.848 29.460 -0.445 0.000 0.991 1116 W HN -0.364 nan 8.180 nan 0.000 0.571 1117 V N 2.152 122.321 119.914 0.426 0.000 2.435 1117 V HA 0.236 4.356 4.120 -0.000 0.000 0.290 1117 V C -0.765 175.307 176.094 -0.037 0.000 1.030 1117 V CA -0.532 61.884 62.300 0.193 0.000 0.881 1117 V CB 1.644 33.519 31.823 0.088 0.000 0.983 1117 V HN -0.163 nan 8.190 nan 0.000 0.445 1118 D N 3.841 124.054 120.400 -0.312 0.000 2.427 1118 D HA 0.280 4.920 4.640 -0.000 0.000 0.226 1118 D C 0.694 176.680 176.300 -0.524 0.000 1.076 1118 D CA -0.274 53.388 54.000 -0.562 0.000 0.849 1118 D CB 2.003 42.394 40.800 -0.682 0.000 1.052 1118 D HN 0.199 nan 8.370 nan 0.000 0.515 1119 V N 3.621 122.990 119.914 -0.910 0.000 2.515 1119 V HA -0.182 3.938 4.120 -0.000 0.000 0.250 1119 V C 2.385 177.997 176.094 -0.803 0.000 1.058 1119 V CA 1.080 62.784 62.300 -0.993 0.000 1.064 1119 V CB -0.139 30.692 31.823 -1.654 0.000 0.675 1119 V HN 0.516 nan 8.190 nan 0.000 0.461 1120 V N -0.367 119.028 119.914 -0.866 0.000 2.427 1120 V HA -0.228 3.892 4.120 -0.000 0.000 0.248 1120 V C 2.638 178.559 176.094 -0.289 0.000 1.051 1120 V CA 2.216 64.221 62.300 -0.492 0.000 1.048 1120 V CB -0.615 30.994 31.823 -0.357 0.000 0.666 1120 V HN 0.639 nan 8.190 nan 0.000 0.456 1121 S N 0.280 115.822 115.700 -0.264 0.000 2.399 1121 S HA -0.182 4.288 4.470 -0.000 0.000 0.231 1121 S C 2.123 176.613 174.600 -0.184 0.000 1.022 1121 S CA 1.484 59.577 58.200 -0.178 0.000 0.983 1121 S CB -0.324 62.783 63.200 -0.154 0.000 0.803 1121 S HN 0.612 nan 8.310 nan 0.000 0.480 1122 A N 1.429 124.107 122.820 -0.236 0.000 1.978 1122 A HA 0.017 4.337 4.320 -0.000 0.000 0.220 1122 A C 2.060 179.549 177.584 -0.159 0.000 1.170 1122 A CA 1.437 53.354 52.037 -0.201 0.000 0.636 1122 A CB -0.765 18.095 19.000 -0.235 0.000 0.810 1122 A HN 0.626 nan 8.150 nan 0.000 0.448 1123 L N -0.661 120.465 121.223 -0.162 0.000 2.362 1123 L HA -0.071 4.268 4.340 -0.000 0.000 0.219 1123 L C 2.201 179.019 176.870 -0.086 0.000 1.134 1123 L CA 1.018 55.790 54.840 -0.113 0.000 0.807 1123 L CB -0.225 41.769 42.059 -0.108 0.000 0.927 1123 L HN 0.256 nan 8.230 nan 0.000 0.447 1124 S N -0.433 115.213 115.700 -0.090 0.000 2.524 1124 S HA 0.244 4.714 4.470 -0.000 0.000 0.216 1124 S C 1.125 175.684 174.600 -0.068 0.000 0.987 1124 S CA 0.010 58.169 58.200 -0.069 0.000 0.909 1124 S CB 0.044 63.205 63.200 -0.065 0.000 0.781 1124 S HN 0.372 nan 8.310 nan 0.000 0.521 1125 A N 2.153 124.921 122.820 -0.086 0.000 2.531 1125 A HA 0.154 4.474 4.320 -0.000 0.000 0.236 1125 A C 0.016 177.560 177.584 -0.066 0.000 1.062 1125 A CA -0.129 51.853 52.037 -0.091 0.000 0.760 1125 A CB -0.038 18.887 19.000 -0.125 0.000 0.995 1125 A HN 0.273 nan 8.150 nan 0.000 0.501 1126 D N 2.276 122.639 120.400 -0.061 0.000 2.343 1126 D HA 0.342 4.982 4.640 -0.000 0.000 0.255 1126 D C -1.705 174.570 176.300 -0.042 0.000 1.187 1126 D CA -1.576 52.400 54.000 -0.040 0.000 0.875 1126 D CB 1.043 41.825 40.800 -0.031 0.000 1.136 1126 D HN 0.124 nan 8.370 nan 0.000 0.469 1127 P HA -0.115 nan 4.420 nan 0.000 0.216 1127 P C 1.210 178.545 177.300 0.058 0.000 1.153 1127 P CA 0.999 64.127 63.100 0.047 0.000 0.848 1127 P CB 0.169 31.925 31.700 0.094 0.000 0.787 1128 R N 0.042 120.570 120.500 0.047 0.000 2.075 1128 R HA -0.063 4.277 4.340 -0.000 0.000 0.232 1128 R C 2.052 178.362 176.300 0.016 0.000 1.126 1128 R CA 1.641 57.773 56.100 0.053 0.000 0.963 1128 R CB -0.886 29.438 30.300 0.040 0.000 0.858 1128 R HN 0.038 nan 8.270 nan 0.000 0.435 1129 A N -0.327 122.481 122.820 -0.021 0.000 2.015 1129 A HA -0.079 4.241 4.320 -0.000 0.000 0.219 1129 A C 2.011 179.533 177.584 -0.103 0.000 1.163 1129 A CA 1.754 53.765 52.037 -0.044 0.000 0.646 1129 A CB -0.533 18.439 19.000 -0.046 0.000 0.806 1129 A HN 0.459 nan 8.150 nan 0.000 0.448 1130 T N -0.808 113.636 114.554 -0.183 0.000 2.812 1130 T HA -0.099 4.251 4.350 -0.000 0.000 0.264 1130 T C 2.274 176.706 174.700 -0.447 0.000 1.042 1130 T CA 1.504 63.344 62.100 -0.433 0.000 1.140 1130 T CB -0.275 68.161 68.868 -0.720 0.000 0.870 1130 T HN 0.543 nan 8.240 nan 0.000 0.445 1131 S N 0.968 116.592 115.700 -0.126 0.000 2.359 1131 S HA -0.183 4.287 4.470 -0.000 0.000 0.224 1131 S C 2.077 176.741 174.600 0.106 0.000 1.035 1131 S CA 1.212 59.531 58.200 0.198 0.000 1.018 1131 S CB -0.350 63.034 63.200 0.306 0.000 0.876 1131 S HN 0.379 nan 8.310 nan 0.000 0.448 1132 E N 1.189 121.416 120.200 0.045 0.000 2.058 1132 E HA -0.142 4.208 4.350 -0.000 0.000 0.194 1132 E C 2.141 178.759 176.600 0.030 0.000 0.997 1132 E CA 1.046 57.469 56.400 0.038 0.000 0.801 1132 E CB -0.727 28.986 29.700 0.021 0.000 0.746 1132 E HN 0.516 nan 8.360 nan 0.000 0.450 1133 L N 0.563 121.781 121.223 -0.008 0.000 1.976 1133 L HA -0.185 4.155 4.340 -0.000 0.000 0.209 1133 L C 2.410 179.299 176.870 0.032 0.000 1.071 1133 L CA 1.714 56.550 54.840 -0.007 0.000 0.746 1133 L CB -0.534 41.487 42.059 -0.062 0.000 0.890 1133 L HN 0.075 nan 8.230 nan 0.000 0.432 1134 A N -0.444 122.397 122.820 0.035 0.000 1.917 1134 A HA -0.312 4.008 4.320 -0.000 0.000 0.219 1134 A C 2.019 179.714 177.584 0.185 0.000 1.182 1134 A CA 2.139 54.278 52.037 0.169 0.000 0.633 1134 A CB -0.645 18.568 19.000 0.354 0.000 0.819 1134 A HN 0.696 nan 8.150 nan 0.000 0.448 1135 Q N -0.196 119.698 119.800 0.155 0.000 2.297 1135 Q HA -0.071 4.269 4.340 -0.000 0.000 0.204 1135 Q C 2.213 178.263 176.000 0.084 0.000 0.962 1135 Q CA 1.277 57.155 55.803 0.125 0.000 0.879 1135 Q CB -0.133 28.669 28.738 0.105 0.000 0.947 1135 Q HN 0.865 nan 8.270 nan 0.000 0.462 1136 S N 0.319 116.060 115.700 0.069 0.000 2.489 1136 S HA -0.044 4.426 4.470 -0.000 0.000 0.228 1136 S C 1.781 176.409 174.600 0.047 0.000 0.995 1136 S CA 0.545 58.773 58.200 0.048 0.000 0.934 1136 S CB -0.275 62.947 63.200 0.037 0.000 0.771 1136 S HN 0.560 nan 8.310 nan 0.000 0.522 1137 I N -2.292 118.316 120.570 0.064 0.000 4.070 1137 I HA 0.481 4.651 4.170 -0.000 0.000 0.328 1137 I C 0.351 176.499 176.117 0.051 0.000 1.298 1137 I CA -0.454 60.877 61.300 0.051 0.000 1.173 1137 I CB 0.634 38.665 38.000 0.052 0.000 1.051 1137 I HN 0.240 nan 8.210 nan 0.000 0.409 1138 S N 0.137 115.886 115.700 0.082 0.000 2.570 1138 S HA 0.727 5.197 4.470 -0.000 0.000 0.270 1138 S C 0.295 174.959 174.600 0.106 0.000 1.149 1138 S CA -0.034 58.217 58.200 0.085 0.000 0.837 1138 S CB 1.900 65.168 63.200 0.113 0.000 1.124 1138 S HN 0.247 nan 8.310 nan 0.000 0.465 1139 A N 2.429 125.305 122.820 0.093 0.000 2.251 1139 A HA 0.213 4.533 4.320 -0.000 0.000 0.209 1139 A C 0.742 178.396 177.584 0.115 0.000 1.187 1139 A CA -0.422 51.663 52.037 0.080 0.000 0.823 1139 A CB -0.372 18.656 19.000 0.046 0.000 0.846 1139 A HN 0.815 nan 8.150 nan 0.000 0.486 1140 W N 1.456 122.722 121.300 -0.057 0.000 2.409 1140 W HA 0.010 4.670 4.660 -0.000 0.000 0.338 1140 W C -2.241 174.241 176.519 -0.062 0.000 1.273 1140 W CA -0.905 56.387 57.345 -0.088 0.000 1.299 1140 W CB 0.565 29.938 29.460 -0.145 0.000 1.192 1140 W HN 0.152 nan 8.180 nan 0.000 0.565 1141 P HA -0.094 nan 4.420 nan 0.000 0.219 1141 P C -0.297 176.659 177.300 -0.574 0.000 1.150 1141 P CA 1.731 64.496 63.100 -0.559 0.000 0.814 1141 P CB 0.148 31.489 31.700 -0.598 0.000 0.787 1142 K N 0.268 120.114 120.400 -0.922 0.000 2.184 1142 K HA 0.252 4.572 4.320 -0.000 0.000 0.259 1142 K C 0.319 176.673 176.600 -0.410 0.000 1.119 1142 K CA 0.129 55.977 56.287 -0.731 0.000 0.991 1142 K CB -0.044 31.972 32.500 -0.807 0.000 1.522 1142 K HN 0.042 nan 8.250 nan 0.000 0.405 1143 S N -1.008 114.546 115.700 -0.244 0.000 2.998 1143 S HA -0.006 4.464 4.470 -0.000 0.000 0.256 1143 S C 0.353 175.059 174.600 0.176 0.000 0.970 1143 S CA -0.695 57.587 58.200 0.136 0.000 1.238 1143 S CB 0.081 63.444 63.200 0.272 0.000 1.170 1143 S HN 0.324 nan 8.310 nan 0.000 0.663 1144 S N 1.711 117.413 115.700 0.004 0.000 2.585 1144 S HA 0.454 4.924 4.470 -0.000 0.000 0.273 1144 S C -1.778 172.959 174.600 0.228 0.000 1.339 1144 S CA -0.721 57.539 58.200 0.099 0.000 1.028 1144 S CB 0.700 63.919 63.200 0.033 0.000 0.906 1144 S HN 0.036 nan 8.310 nan 0.000 0.528 1145 P HA 0.011 nan 4.420 nan 0.000 0.215 1145 P C 1.745 179.159 177.300 0.189 0.000 1.153 1145 P CA 1.614 64.865 63.100 0.252 0.000 0.853 1145 P CB -0.454 31.335 31.700 0.149 0.000 0.788 1146 G N -1.171 107.703 108.800 0.124 0.000 2.422 1146 G HA2 -0.307 3.653 3.960 -0.000 0.000 0.218 1146 G HA3 -0.307 3.653 3.960 -0.000 0.000 0.218 1146 G C 1.587 176.543 174.900 0.093 0.000 1.146 1146 G CA 0.617 45.770 45.100 0.090 0.000 0.769 1146 G HN 0.236 nan 8.290 nan 0.000 0.547 1147 Y N 0.746 121.006 120.300 -0.066 0.000 2.181 1147 Y HA -0.050 4.500 4.550 -0.000 0.000 0.288 1147 Y C 2.336 178.139 175.900 -0.163 0.000 1.146 1147 Y CA 1.450 59.457 58.100 -0.156 0.000 1.164 1147 Y CB -0.400 37.885 38.460 -0.291 0.000 0.982 1147 Y HN 0.197 nan 8.280 nan 0.000 0.515 1148 F N -0.061 119.875 119.950 -0.024 0.000 2.146 1148 F HA -0.141 4.386 4.527 -0.000 0.000 0.298 1148 F C 2.634 178.349 175.800 -0.141 0.000 1.096 1148 F CA 0.930 58.830 58.000 -0.166 0.000 1.275 1148 F CB -0.712 38.279 39.000 -0.015 0.000 1.008 1148 F HN 0.171 nan 8.300 nan 0.000 0.480 1149 A N 0.019 122.897 122.820 0.096 0.000 1.940 1149 A HA -0.213 4.107 4.320 -0.000 0.000 0.219 1149 A C 1.826 179.402 177.584 -0.012 0.000 1.176 1149 A CA 2.161 54.222 52.037 0.040 0.000 0.631 1149 A CB -0.729 18.299 19.000 0.046 0.000 0.814 1149 A HN 0.266 nan 8.150 nan 0.000 0.446 1150 D N -0.814 119.560 120.400 -0.044 0.000 2.144 1150 D HA -0.063 4.577 4.640 -0.000 0.000 0.200 1150 D C 2.002 178.245 176.300 -0.095 0.000 0.978 1150 D CA 1.762 55.730 54.000 -0.053 0.000 0.833 1150 D CB -0.595 40.185 40.800 -0.033 0.000 0.961 1150 D HN 0.393 nan 8.370 nan 0.000 0.470 1151 T N 0.550 114.988 114.554 -0.193 0.000 2.812 1151 T HA -0.152 4.198 4.350 -0.000 0.000 0.264 1151 T C 1.872 176.513 174.700 -0.098 0.000 1.042 1151 T CA 1.049 63.033 62.100 -0.193 0.000 1.140 1151 T CB -0.112 68.555 68.868 -0.335 0.000 0.870 1151 T HN 0.196 nan 8.240 nan 0.000 0.445 1152 Q N 1.143 120.902 119.800 -0.068 0.000 2.061 1152 Q HA -0.189 4.151 4.340 -0.000 0.000 0.204 1152 Q C 2.261 178.240 176.000 -0.035 0.000 0.984 1152 Q CA 1.745 57.520 55.803 -0.047 0.000 0.846 1152 Q CB -0.131 28.589 28.738 -0.030 0.000 0.902 1152 Q HN 0.455 nan 8.270 nan 0.000 0.421 1153 K N -0.018 120.366 120.400 -0.026 0.000 2.147 1153 K HA -0.161 4.158 4.320 -0.000 0.000 0.205 1153 K C 2.013 178.614 176.600 0.002 0.000 1.049 1153 K CA 1.243 57.524 56.287 -0.010 0.000 0.936 1153 K CB 0.032 32.528 32.500 -0.006 0.000 0.722 1153 K HN 0.152 nan 8.250 nan 0.000 0.446 1154 R N -0.089 120.406 120.500 -0.008 0.000 2.073 1154 R HA -0.046 4.294 4.340 -0.000 0.000 0.229 1154 R C 2.217 178.539 176.300 0.036 0.000 1.120 1154 R CA 1.417 57.522 56.100 0.009 0.000 0.967 1154 R CB -0.283 30.006 30.300 -0.019 0.000 0.862 1154 R HN 0.171 nan 8.270 nan 0.000 0.436 1155 I N 1.146 121.719 120.570 0.004 0.000 2.315 1155 I HA -0.237 3.933 4.170 -0.000 0.000 0.248 1155 I C 2.394 178.568 176.117 0.094 0.000 1.117 1155 I CA 1.335 62.655 61.300 0.032 0.000 1.404 1155 I CB -0.198 37.777 38.000 -0.043 0.000 1.071 1155 I HN 0.034 nan 8.210 nan 0.000 0.419 1156 K N 0.067 120.489 120.400 0.036 0.000 2.026 1156 K HA -0.186 4.134 4.320 -0.000 0.000 0.208 1156 K C 2.050 178.684 176.600 0.056 0.000 1.048 1156 K CA 2.006 58.310 56.287 0.028 0.000 0.929 1156 K CB -0.202 32.299 32.500 0.001 0.000 0.713 1156 K HN 0.237 nan 8.250 nan 0.000 0.439 1157 T N 0.539 115.133 114.554 0.067 0.000 2.746 1157 T HA -0.139 4.211 4.350 -0.000 0.000 0.267 1157 T C 1.369 176.130 174.700 0.101 0.000 1.039 1157 T CA 1.387 63.526 62.100 0.065 0.000 1.142 1157 T CB -0.361 68.543 68.868 0.060 0.000 0.866 1157 T HN 0.300 nan 8.240 nan 0.000 0.444 1158 F N 1.719 121.660 119.950 -0.016 0.000 2.075 1158 F HA -0.144 4.383 4.527 -0.000 0.000 0.297 1158 F C 2.268 178.066 175.800 -0.003 0.000 1.113 1158 F CA 1.048 59.039 58.000 -0.015 0.000 1.218 1158 F CB -0.467 38.521 39.000 -0.019 0.000 0.984 1158 F HN -0.112 nan 8.300 nan 0.000 0.472 1159 V N 0.415 120.437 119.914 0.181 0.000 2.343 1159 V HA -0.299 3.821 4.120 -0.000 0.000 0.247 1159 V C 2.076 178.146 176.094 -0.039 0.000 1.051 1159 V CA 2.339 64.669 62.300 0.050 0.000 1.036 1159 V CB -0.688 31.178 31.823 0.072 0.000 0.654 1159 V HN 0.363 nan 8.190 nan 0.000 0.451 1160 E N 0.390 120.578 120.200 -0.020 0.000 2.347 1160 E HA -0.121 4.229 4.350 -0.000 0.000 0.196 1160 E C 2.195 178.760 176.600 -0.058 0.000 1.008 1160 E CA 1.031 57.412 56.400 -0.032 0.000 0.852 1160 E CB -0.134 29.558 29.700 -0.014 0.000 0.783 1160 E HN 0.756 nan 8.360 nan 0.000 0.505 1161 S N -0.509 115.131 115.700 -0.100 0.000 2.507 1161 S HA -0.041 4.429 4.470 -0.000 0.000 0.235 1161 S C 1.851 176.377 174.600 -0.124 0.000 0.988 1161 S CA 0.681 58.811 58.200 -0.116 0.000 0.944 1161 S CB -0.189 62.912 63.200 -0.166 0.000 0.762 1161 S HN 0.386 nan 8.310 nan 0.000 0.526 1162 G N 0.531 109.252 108.800 -0.131 0.000 2.189 1162 G HA2 -0.297 3.663 3.960 -0.000 0.000 0.267 1162 G HA3 -0.297 3.663 3.960 -0.000 0.000 0.267 1162 G C 0.040 174.852 174.900 -0.146 0.000 0.975 1162 G CA 0.473 45.509 45.100 -0.106 0.000 0.644 1162 G HN 0.635 nan 8.290 nan 0.000 0.537 1163 Q N -0.166 119.485 119.800 -0.249 0.000 2.655 1163 Q HA 0.566 4.906 4.340 -0.000 0.000 0.228 1163 Q C 1.064 176.763 176.000 -0.503 0.000 1.186 1163 Q CA -0.631 55.001 55.803 -0.285 0.000 1.004 1163 Q CB 0.601 29.196 28.738 -0.238 0.000 1.242 1163 Q HN 0.266 nan 8.270 nan 0.000 0.558 1164 L N 0.999 122.052 121.223 -0.284 0.000 2.610 1164 L HA 0.052 4.392 4.340 -0.000 0.000 0.232 1164 L C 1.375 178.265 176.870 0.034 0.000 1.149 1164 L CA 1.122 55.852 54.840 -0.184 0.000 0.872 1164 L CB -0.699 41.421 42.059 0.101 0.000 0.992 1164 L HN 0.815 nan 8.230 nan 0.000 0.447 1165 G N 1.265 110.064 108.800 -0.002 0.000 2.651 1165 G HA2 -0.426 3.534 3.960 -0.000 0.000 0.315 1165 G HA3 -0.426 3.534 3.960 -0.000 0.000 0.315 1165 G C 1.094 176.051 174.900 0.095 0.000 1.258 1165 G CA 0.618 45.772 45.100 0.090 0.000 1.002 1165 G HN 0.488 nan 8.290 nan 0.000 0.551 1166 I N -2.178 118.410 120.570 0.030 0.000 3.176 1166 I HA 0.254 4.424 4.170 -0.000 0.000 0.275 1166 I C 1.972 178.244 176.117 0.259 0.000 1.298 1166 I CA 1.352 62.688 61.300 0.061 0.000 1.445 1166 I CB -0.318 37.684 38.000 0.003 0.000 1.075 1166 I HN 0.180 nan 8.210 nan 0.000 0.482 1167 F N 2.294 122.414 119.950 0.283 0.000 2.776 1167 F HA 0.468 4.995 4.527 -0.000 0.000 0.300 1167 F C 1.784 177.822 175.800 0.397 0.000 1.116 1167 F CA -1.038 57.215 58.000 0.422 0.000 1.375 1167 F CB -0.992 38.228 39.000 0.368 0.000 1.109 1167 F HN 0.024 nan 8.300 nan 0.000 0.585 1168 A N 0.321 123.367 122.820 0.376 0.000 2.445 1168 A HA 0.202 4.522 4.320 -0.000 0.000 0.242 1168 A C 0.989 178.670 177.584 0.163 0.000 1.075 1168 A CA 0.131 52.313 52.037 0.242 0.000 0.777 1168 A CB -0.585 18.494 19.000 0.133 0.000 1.013 1168 A HN 0.627 nan 8.150 nan 0.000 0.493 1169 N N -0.291 118.489 118.700 0.133 0.000 2.681 1169 N HA -0.200 4.540 4.740 -0.000 0.000 0.250 1169 N C 0.642 176.093 175.510 -0.099 0.000 1.133 1169 N CA 0.340 53.424 53.050 0.058 0.000 0.732 1169 N CB -1.126 37.392 38.487 0.051 0.000 1.107 1169 N HN 1.053 nan 8.380 nan 0.000 0.559 1170 G N -0.750 107.915 108.800 -0.225 0.000 2.634 1170 G HA2 0.221 4.181 3.960 -0.000 0.000 0.255 1170 G HA3 0.221 4.181 3.960 -0.000 0.000 0.255 1170 G C 0.059 174.395 174.900 -0.940 0.000 1.205 1170 G CA -0.311 44.224 45.100 -0.942 0.000 0.884 1170 G HN 0.297 nan 8.290 nan 0.000 0.549 1171 Y N -1.071 118.699 120.300 -0.884 0.000 2.537 1171 Y HA 0.194 4.744 4.550 -0.000 0.000 0.303 1171 Y C 0.650 176.472 175.900 -0.129 0.000 1.176 1171 Y CA -2.092 55.794 58.100 -0.355 0.000 1.273 1171 Y CB -1.160 37.178 38.460 -0.203 0.000 1.110 1171 Y HN 0.433 nan 8.280 nan 0.000 0.518 1172 W N 0.586 122.016 121.300 0.216 0.000 2.480 1172 W HA 0.264 4.924 4.660 -0.000 0.000 0.337 1172 W C 1.432 178.031 176.519 0.134 0.000 1.201 1172 W CA 0.873 58.240 57.345 0.036 0.000 1.309 1172 W CB 0.227 29.636 29.460 -0.084 0.000 1.168 1172 W HN 0.444 nan 8.180 nan 0.000 0.566 1173 G N 0.033 109.038 108.800 0.341 0.000 2.205 1173 G HA2 -0.355 3.605 3.960 -0.000 0.000 0.261 1173 G HA3 -0.355 3.605 3.960 -0.000 0.000 0.261 1173 G C 0.409 175.496 174.900 0.313 0.000 0.980 1173 G CA 0.020 45.280 45.100 0.268 0.000 0.632 1173 G HN 0.813 nan 8.290 nan 0.000 0.533 1174 H N 2.761 122.028 119.070 0.329 0.000 2.972 1174 H HA 0.159 4.715 4.556 -0.000 0.000 0.343 1174 H C -0.665 174.779 175.328 0.193 0.000 1.054 1174 H CA -0.071 56.096 56.048 0.199 0.000 1.412 1174 H CB 1.432 31.262 29.762 0.113 0.000 1.385 1174 H HN 0.195 nan 8.280 nan 0.000 0.600 1175 P HA -0.060 nan 4.420 nan 0.000 0.234 1175 P C 0.854 178.350 177.300 0.327 0.000 1.167 1175 P CA 1.007 64.217 63.100 0.184 0.000 0.763 1175 P CB -0.014 31.709 31.700 0.039 0.000 0.835 1176 A N -1.118 122.026 122.820 0.539 0.000 2.066 1176 A HA -0.084 4.236 4.320 -0.000 0.000 0.218 1176 A C 0.829 178.541 177.584 0.213 0.000 1.157 1176 A CA 0.291 52.482 52.037 0.257 0.000 0.670 1176 A CB -1.257 17.682 19.000 -0.101 0.000 0.804 1176 A HN 0.167 nan 8.150 nan 0.000 0.453 1177 Y N -0.269 120.202 120.300 0.285 0.000 2.402 1177 Y HA 0.304 4.854 4.550 -0.000 0.000 0.333 1177 Y C 1.446 177.488 175.900 0.236 0.000 1.076 1177 Y CA -0.019 58.252 58.100 0.285 0.000 1.299 1177 Y CB 0.736 39.321 38.460 0.208 0.000 1.197 1177 Y HN 0.137 nan 8.280 nan 0.000 0.517 1178 R N 1.980 122.705 120.500 0.375 0.000 2.521 1178 R HA 0.242 4.582 4.340 -0.000 0.000 0.289 1178 R C -0.510 175.728 176.300 -0.104 0.000 0.936 1178 R CA -0.273 55.885 56.100 0.097 0.000 1.089 1178 R CB 0.519 30.789 30.300 -0.051 0.000 1.348 1178 R HN 0.548 nan 8.270 nan 0.000 0.536 1179 L N 3.932 125.076 121.223 -0.130 0.000 2.439 1179 L HA 0.206 4.546 4.340 -0.000 0.000 0.269 1179 L C -1.799 174.875 176.870 -0.327 0.000 1.179 1179 L CA -1.744 52.817 54.840 -0.465 0.000 0.828 1179 L CB 0.086 41.994 42.059 -0.251 0.000 1.106 1179 L HN -0.164 nan 8.230 nan 0.000 0.467 1180 P HA 0.142 nan 4.420 nan 0.000 0.272 1180 P C -2.337 174.856 177.300 -0.178 0.000 1.240 1180 P CA -1.490 61.487 63.100 -0.205 0.000 0.791 1180 P CB 0.144 31.746 31.700 -0.165 0.000 0.978 1181 P HA -0.203 nan 4.420 nan 0.000 0.216 1181 P C 1.345 178.549 177.300 -0.159 0.000 1.154 1181 P CA 1.734 64.754 63.100 -0.134 0.000 0.865 1181 P CB -0.032 31.605 31.700 -0.105 0.000 0.789 1182 E N -0.652 119.452 120.200 -0.160 0.000 2.077 1182 E HA -0.129 4.221 4.350 -0.000 0.000 0.193 1182 E C 2.113 178.579 176.600 -0.225 0.000 0.989 1182 E CA 1.593 57.874 56.400 -0.199 0.000 0.800 1182 E CB -1.149 28.450 29.700 -0.168 0.000 0.746 1182 E HN 0.172 nan 8.360 nan 0.000 0.452 1183 A N 0.892 123.594 122.820 -0.197 0.000 1.968 1183 A HA -0.127 4.193 4.320 -0.000 0.000 0.217 1183 A C 1.808 179.303 177.584 -0.148 0.000 1.169 1183 A CA 1.135 53.067 52.037 -0.175 0.000 0.638 1183 A CB -0.324 18.549 19.000 -0.212 0.000 0.812 1183 A HN 0.135 nan 8.150 nan 0.000 0.446 1184 N N -0.034 118.572 118.700 -0.157 0.000 2.142 1184 N HA -0.137 4.603 4.740 -0.000 0.000 0.186 1184 N C 1.641 177.061 175.510 -0.150 0.000 1.023 1184 N CA 1.479 54.445 53.050 -0.140 0.000 0.852 1184 N CB -0.456 37.928 38.487 -0.172 0.000 0.998 1184 N HN 0.408 nan 8.380 nan 0.000 0.424 1185 L N 1.427 122.545 121.223 -0.175 0.000 2.046 1185 L HA -0.023 4.317 4.340 -0.000 0.000 0.208 1185 L C 2.352 179.145 176.870 -0.128 0.000 1.077 1185 L CA 1.355 56.102 54.840 -0.155 0.000 0.747 1185 L CB -0.687 41.266 42.059 -0.176 0.000 0.896 1185 L HN 0.132 nan 8.230 nan 0.000 0.432 1186 M N -1.142 118.308 119.600 -0.251 0.000 2.080 1186 M HA -0.244 4.236 4.480 -0.000 0.000 0.260 1186 M C 2.130 178.277 176.300 -0.256 0.000 1.068 1186 M CA 2.235 57.374 55.300 -0.269 0.000 1.109 1186 M CB -0.191 32.220 32.600 -0.313 0.000 1.342 1186 M HN 0.380 nan 8.290 nan 0.000 0.405 1187 A N -0.702 122.059 122.820 -0.099 0.000 1.930 1187 A HA -0.096 4.224 4.320 -0.000 0.000 0.217 1187 A C 2.015 179.690 177.584 0.151 0.000 1.175 1187 A CA 1.651 53.742 52.037 0.090 0.000 0.627 1187 A CB -0.989 18.084 19.000 0.123 0.000 0.815 1187 A HN 0.428 nan 8.150 nan 0.000 0.443 1188 V N -0.130 119.804 119.914 0.033 0.000 2.343 1188 V HA -0.248 3.872 4.120 -0.000 0.000 0.247 1188 V C 3.061 179.229 176.094 0.124 0.000 1.051 1188 V CA 1.886 64.195 62.300 0.015 0.000 1.036 1188 V CB -1.198 30.558 31.823 -0.112 0.000 0.654 1188 V HN 0.613 nan 8.190 nan 0.000 0.451 1189 A N -0.735 122.161 122.820 0.126 0.000 1.908 1189 A HA -0.267 4.053 4.320 -0.000 0.000 0.218 1189 A C 2.067 179.875 177.584 0.372 0.000 1.181 1189 A CA 2.089 54.258 52.037 0.220 0.000 0.627 1189 A CB -0.763 18.431 19.000 0.322 0.000 0.818 1189 A HN 0.661 nan 8.150 nan 0.000 0.445 1190 H N -2.464 116.733 119.070 0.210 0.000 2.423 1190 H HA -0.093 4.463 4.556 -0.000 0.000 0.297 1190 H C 1.793 177.011 175.328 -0.183 0.000 1.075 1190 H CA 1.200 57.232 56.048 -0.027 0.000 1.342 1190 H CB -0.743 28.947 29.762 -0.119 0.000 1.395 1190 H HN 0.767 nan 8.280 nan 0.000 0.530 1191 Y N 1.144 121.469 120.300 0.042 0.000 2.181 1191 Y HA -0.185 4.364 4.550 -0.000 0.000 0.288 1191 Y C 2.195 178.231 175.900 0.227 0.000 1.146 1191 Y CA 1.138 59.318 58.100 0.134 0.000 1.164 1191 Y CB -0.322 38.297 38.460 0.265 0.000 0.982 1191 Y HN 0.033 nan 8.280 nan 0.000 0.515 1192 L N 0.099 121.622 121.223 0.500 0.000 2.046 1192 L HA -0.196 4.144 4.340 -0.000 0.000 0.208 1192 L C 2.447 179.471 176.870 0.257 0.000 1.077 1192 L CA 1.289 56.333 54.840 0.340 0.000 0.747 1192 L CB -0.583 41.628 42.059 0.253 0.000 0.896 1192 L HN 0.234 nan 8.230 nan 0.000 0.432 1193 E N 0.395 120.772 120.200 0.295 0.000 2.153 1193 E HA -0.194 4.156 4.350 -0.000 0.000 0.194 1193 E C 2.259 178.986 176.600 0.211 0.000 0.988 1193 E CA 1.329 57.925 56.400 0.327 0.000 0.811 1193 E CB -0.197 29.785 29.700 0.470 0.000 0.746 1193 E HN 0.493 nan 8.360 nan 0.000 0.466 1194 A N 0.991 123.876 122.820 0.108 0.000 1.968 1194 A HA -0.066 4.254 4.320 -0.000 0.000 0.217 1194 A C 2.337 179.991 177.584 0.117 0.000 1.169 1194 A CA 0.646 52.647 52.037 -0.060 0.000 0.638 1194 A CB -0.506 18.377 19.000 -0.195 0.000 0.812 1194 A HN 0.151 nan 8.150 nan 0.000 0.446 1195 L N -0.865 120.424 121.223 0.109 0.000 2.056 1195 L HA -0.183 4.157 4.340 -0.000 0.000 0.207 1195 L C 3.093 179.963 176.870 -0.000 0.000 1.078 1195 L CA 1.124 55.939 54.840 -0.041 0.000 0.749 1195 L CB -0.486 41.493 42.059 -0.134 0.000 0.901 1195 L HN 0.434 nan 8.230 nan 0.000 0.433 1196 A N -0.756 122.098 122.820 0.056 0.000 1.898 1196 A HA -0.263 4.057 4.320 -0.000 0.000 0.216 1196 A C 1.996 179.600 177.584 0.034 0.000 1.181 1196 A CA 1.348 53.419 52.037 0.057 0.000 0.620 1196 A CB -1.045 18.026 19.000 0.117 0.000 0.819 1196 A HN 0.612 nan 8.150 nan 0.000 0.442 1197 W N 1.694 122.883 121.300 -0.185 0.000 2.355 1197 W HA -0.307 4.353 4.660 -0.000 0.000 0.309 1197 W C 2.359 178.726 176.519 -0.254 0.000 1.206 1197 W CA 2.531 59.692 57.345 -0.308 0.000 1.284 1197 W CB -0.234 28.707 29.460 -0.865 0.000 1.145 1197 W HN 0.547 nan 8.180 nan 0.000 0.502 1198 Q N 1.149 120.787 119.800 -0.270 0.000 2.167 1198 Q HA -0.210 4.130 4.340 -0.000 0.000 0.202 1198 Q C 2.028 177.854 176.000 -0.290 0.000 0.970 1198 Q CA 2.372 57.866 55.803 -0.515 0.000 0.855 1198 Q CB -1.139 27.432 28.738 -0.277 0.000 0.911 1198 Q HN 0.580 nan 8.270 nan 0.000 0.438 1199 R N 0.097 120.492 120.500 -0.174 0.000 2.119 1199 R HA -0.014 4.326 4.340 -0.000 0.000 0.222 1199 R C 1.453 177.664 176.300 -0.149 0.000 1.088 1199 R CA 1.268 57.306 56.100 -0.104 0.000 0.984 1199 R CB -0.451 29.814 30.300 -0.058 0.000 0.884 1199 R HN 0.211 nan 8.270 nan 0.000 0.447 1200 D N 1.083 121.356 120.400 -0.212 0.000 2.084 1200 D HA -0.166 4.474 4.640 -0.000 0.000 0.194 1200 D C 1.881 178.021 176.300 -0.267 0.000 0.990 1200 D CA 2.285 56.158 54.000 -0.212 0.000 0.826 1200 D CB -0.045 40.619 40.800 -0.226 0.000 0.971 1200 D HN 0.400 nan 8.370 nan 0.000 0.453 1201 T N -0.295 113.954 114.554 -0.507 0.000 2.881 1201 T HA -0.082 4.268 4.350 -0.000 0.000 0.270 1201 T C 1.915 176.473 174.700 -0.236 0.000 1.068 1201 T CA 1.619 63.444 62.100 -0.458 0.000 1.131 1201 T CB -0.181 68.178 68.868 -0.847 0.000 0.871 1201 T HN 0.076 nan 8.240 nan 0.000 0.479 1202 A N 1.295 123.992 122.820 -0.206 0.000 2.125 1202 A HA 0.024 4.344 4.320 -0.000 0.000 0.219 1202 A C 2.322 179.864 177.584 -0.070 0.000 1.156 1202 A CA 1.315 53.237 52.037 -0.192 0.000 0.671 1202 A CB -0.550 18.350 19.000 -0.166 0.000 0.794 1202 A HN 0.686 nan 8.150 nan 0.000 0.459 1203 K N -1.487 118.886 120.400 -0.045 0.000 2.280 1203 K HA -0.113 4.207 4.320 -0.000 0.000 0.202 1203 K C 1.543 178.168 176.600 0.041 0.000 1.047 1203 K CA 1.230 57.508 56.287 -0.013 0.000 0.942 1203 K CB -0.316 32.162 32.500 -0.036 0.000 0.739 1203 K HN 0.561 nan 8.250 nan 0.000 0.457 1204 F N 1.600 121.514 119.950 -0.059 0.000 2.069 1204 F HA -0.263 4.264 4.527 -0.000 0.000 0.298 1204 F C 2.155 178.080 175.800 0.208 0.000 1.113 1204 F CA 1.744 59.771 58.000 0.046 0.000 1.214 1204 F CB -0.163 38.858 39.000 0.036 0.000 0.978 1204 F HN 0.155 nan 8.300 nan 0.000 0.474 1205 H N -1.076 118.189 119.070 0.324 0.000 2.387 1205 H HA -0.112 4.444 4.556 -0.000 0.000 0.299 1205 H C 2.296 177.656 175.328 0.054 0.000 1.090 1205 H CA 0.479 56.651 56.048 0.207 0.000 1.332 1205 H CB -0.175 29.669 29.762 0.136 0.000 1.386 1205 H HN 0.403 nan 8.280 nan 0.000 0.516 1206 A N 1.010 123.906 122.820 0.128 0.000 1.902 1206 A HA -0.133 4.187 4.320 -0.000 0.000 0.217 1206 A C 2.362 179.904 177.584 -0.071 0.000 1.181 1206 A CA 1.130 53.176 52.037 0.016 0.000 0.623 1206 A CB -0.571 18.423 19.000 -0.011 0.000 0.818 1206 A HN 0.290 nan 8.150 nan 0.000 0.443 1207 I N -1.930 118.542 120.570 -0.162 0.000 2.179 1207 I HA -0.240 3.930 4.170 -0.000 0.000 0.242 1207 I C 2.162 178.049 176.117 -0.384 0.000 1.088 1207 I CA 1.466 62.557 61.300 -0.347 0.000 1.357 1207 I CB -0.279 37.372 38.000 -0.583 0.000 1.051 1207 I HN 0.315 nan 8.210 nan 0.000 0.409 1208 F N -0.115 119.737 119.950 -0.164 0.000 2.335 1208 F HA 0.104 4.631 4.527 -0.000 0.000 0.296 1208 F C 2.248 177.932 175.800 -0.193 0.000 1.091 1208 F CA 1.003 58.902 58.000 -0.168 0.000 1.399 1208 F CB -0.548 38.355 39.000 -0.163 0.000 1.067 1208 F HN -0.029 nan 8.300 nan 0.000 0.520 1209 G N -1.899 106.893 108.800 -0.012 0.000 3.228 1209 G HA2 0.413 4.373 3.960 -0.000 0.000 0.245 1209 G HA3 0.413 4.373 3.960 -0.000 0.000 0.245 1209 G C 1.419 176.248 174.900 -0.119 0.000 1.051 1209 G CA 0.317 45.311 45.100 -0.176 0.000 0.809 1209 G HN 0.549 nan 8.290 nan 0.000 0.531 1210 G N 0.489 109.249 108.800 -0.066 0.000 2.336 1210 G HA2 -0.226 3.734 3.960 -0.000 0.000 0.233 1210 G HA3 -0.226 3.734 3.960 -0.000 0.000 0.233 1210 G C 0.329 175.222 174.900 -0.013 0.000 1.053 1210 G CA 0.745 45.818 45.100 -0.045 0.000 0.625 1210 G HN 1.264 nan 8.290 nan 0.000 0.511 1211 K N -1.031 119.376 120.400 0.012 0.000 2.625 1211 K HA 0.585 4.905 4.320 -0.000 0.000 0.284 1211 K C -1.464 175.178 176.600 0.070 0.000 0.984 1211 K CA -0.663 55.646 56.287 0.036 0.000 0.865 1211 K CB 1.211 33.739 32.500 0.046 0.000 1.468 1211 K HN 0.421 nan 8.250 nan 0.000 0.407 1212 N N 0.990 119.724 118.700 0.057 0.000 2.369 1212 N HA 0.454 5.194 4.740 -0.000 0.000 0.287 1212 N C -2.831 172.675 175.510 -0.006 0.000 1.067 1212 N CA -0.982 52.105 53.050 0.062 0.000 0.888 1212 N CB 1.877 40.405 38.487 0.067 0.000 1.616 1212 N HN 0.506 nan 8.380 nan 0.000 0.482 1213 P HA 0.265 nan 4.420 nan 0.000 0.272 1213 P C -1.101 176.206 177.300 0.011 0.000 1.240 1213 P CA 0.330 63.368 63.100 -0.105 0.000 0.791 1213 P CB 0.222 31.726 31.700 -0.325 0.000 0.978 1214 H N -2.470 116.694 119.070 0.158 0.000 2.904 1214 H HA -0.099 4.457 4.556 -0.000 0.000 0.333 1214 H C -2.101 173.337 175.328 0.183 0.000 1.271 1214 H CA -0.766 55.402 56.048 0.200 0.000 1.183 1214 H CB -1.420 28.442 29.762 0.168 0.000 1.519 1214 H HN 0.412 nan 8.280 nan 0.000 0.441 1215 P HA 0.010 nan 4.420 nan 0.000 0.274 1215 P C -0.074 177.158 177.300 -0.113 0.000 1.260 1215 P CA -0.110 62.985 63.100 -0.008 0.000 0.793 1215 P CB 0.906 32.480 31.700 -0.210 0.000 1.048 1216 N N -0.817 117.669 118.700 -0.356 0.000 2.487 1216 N HA 0.518 5.258 4.740 -0.000 0.000 0.292 1216 N C -0.608 174.131 175.510 -1.285 0.000 1.108 1216 N CA -0.206 52.550 53.050 -0.490 0.000 0.956 1216 N CB 0.469 38.860 38.487 -0.159 0.000 1.176 1216 N HN 0.320 nan 8.380 nan 0.000 0.484 1217 F N -0.198 118.957 119.950 -1.324 0.000 2.664 1217 F HA 0.737 5.264 4.527 -0.000 0.000 0.329 1217 F C -0.321 174.884 175.800 -0.992 0.000 1.090 1217 F CA -0.965 56.416 58.000 -1.031 0.000 0.978 1217 F CB 1.306 39.712 39.000 -0.990 0.000 1.378 1217 F HN 0.065 nan 8.300 nan 0.000 0.495 1218 V N 1.211 120.948 119.914 -0.295 0.000 2.932 1218 V HA 0.512 4.632 4.120 -0.000 0.000 0.307 1218 V C -1.389 174.832 176.094 0.212 0.000 1.147 1218 V CA -0.883 61.405 62.300 -0.020 0.000 0.951 1218 V CB 2.259 34.056 31.823 -0.043 0.000 1.031 1218 V HN 0.504 nan 8.190 nan 0.000 0.426 1219 V N 6.364 126.547 119.914 0.449 0.000 2.485 1219 V HA 0.488 4.608 4.120 -0.000 0.000 0.287 1219 V C 1.481 177.849 176.094 0.457 0.000 1.022 1219 V CA 1.761 64.315 62.300 0.424 0.000 1.067 1219 V CB 0.288 32.382 31.823 0.452 0.000 0.967 1219 V HN 1.684 nan 8.190 nan 0.000 0.479 1220 G N 3.117 112.059 108.800 0.237 0.000 2.179 1220 G HA2 0.127 4.087 3.960 -0.000 0.000 0.220 1220 G HA3 0.127 4.087 3.960 -0.000 0.000 0.220 1220 G C 0.482 175.429 174.900 0.078 0.000 0.990 1220 G CA -0.167 44.985 45.100 0.086 0.000 0.646 1220 G HN 1.770 nan 8.290 nan 0.000 0.517 1221 G N -1.984 106.938 108.800 0.203 0.000 2.512 1221 G HA2 0.628 4.588 3.960 -0.000 0.000 0.181 1221 G HA3 0.628 4.588 3.960 -0.000 0.000 0.181 1221 G C -0.632 174.338 174.900 0.117 0.000 1.173 1221 G CA 0.797 46.001 45.100 0.174 0.000 0.988 1221 G HN 1.832 nan 8.290 nan 0.000 0.485 1222 V N -2.194 117.765 119.914 0.075 0.000 2.914 1222 V HA 0.786 4.906 4.120 -0.000 0.000 0.314 1222 V C -2.246 173.795 176.094 -0.089 0.000 1.084 1222 V CA -1.709 60.569 62.300 -0.038 0.000 0.963 1222 V CB 2.036 33.822 31.823 -0.062 0.000 1.025 1222 V HN 0.479 nan 8.190 nan 0.000 0.432 1223 P HA 0.042 nan 4.420 nan 0.000 0.225 1223 P C 0.578 177.785 177.300 -0.155 0.000 1.156 1223 P CA 0.833 63.803 63.100 -0.218 0.000 0.787 1223 P CB 0.038 31.605 31.700 -0.223 0.000 0.802 1224 S N 1.203 116.847 115.700 -0.094 0.000 2.422 1224 S HA 0.347 4.817 4.470 -0.000 0.000 0.283 1224 S C -2.199 172.386 174.600 -0.025 0.000 1.163 1224 S CA -1.407 56.765 58.200 -0.047 0.000 1.054 1224 S CB -0.092 63.123 63.200 0.025 0.000 0.967 1224 S HN 0.031 nan 8.310 nan 0.000 0.499 1225 P HA 0.437 nan 4.420 nan 0.000 0.276 1225 P C -0.676 176.619 177.300 -0.008 0.000 1.252 1225 P CA -0.708 62.378 63.100 -0.024 0.000 0.802 1225 P CB 0.735 32.410 31.700 -0.041 0.000 1.035 1226 I N 1.151 121.721 120.570 0.001 0.000 2.404 1226 I HA 0.390 4.560 4.170 -0.000 0.000 0.293 1226 I C -0.166 175.947 176.117 -0.006 0.000 0.992 1226 I CA -0.054 61.248 61.300 0.003 0.000 1.149 1226 I CB 1.563 39.571 38.000 0.014 0.000 1.315 1226 I HN 0.270 nan 8.210 nan 0.000 0.446 1227 D N 5.834 126.227 120.400 -0.011 0.000 2.484 1227 D HA 0.135 4.775 4.640 -0.000 0.000 0.206 1227 D C -0.029 176.263 176.300 -0.014 0.000 1.322 1227 D CA -0.448 53.545 54.000 -0.012 0.000 0.913 1227 D CB 1.600 42.391 40.800 -0.014 0.000 1.559 1227 D HN 0.156 nan 8.370 nan 0.000 0.565 1228 L N 2.088 123.304 121.223 -0.011 0.000 2.275 1228 L HA 0.080 4.420 4.340 -0.000 0.000 0.215 1228 L C 1.170 178.033 176.870 -0.011 0.000 1.119 1228 L CA 1.349 56.183 54.840 -0.011 0.000 0.790 1228 L CB -0.316 41.738 42.059 -0.008 0.000 0.919 1228 L HN 0.486 nan 8.230 nan 0.000 0.443 1229 D N -1.702 118.691 120.400 -0.011 0.000 2.559 1229 D HA 0.109 4.749 4.640 -0.000 0.000 0.234 1229 D C 0.248 176.540 176.300 -0.014 0.000 1.226 1229 D CA 0.140 54.133 54.000 -0.011 0.000 0.830 1229 D CB 0.916 41.711 40.800 -0.009 0.000 1.028 1229 D HN 0.048 nan 8.370 nan 0.000 0.492 1230 S N 1.055 116.745 115.700 -0.017 0.000 2.536 1230 S HA 0.139 4.609 4.470 -0.000 0.000 0.298 1230 S C 0.615 175.200 174.600 -0.024 0.000 1.083 1230 S CA -0.708 57.480 58.200 -0.020 0.000 0.995 1230 S CB 1.752 64.939 63.200 -0.023 0.000 1.058 1230 S HN 0.094 nan 8.310 nan 0.000 0.488 1231 D N 1.819 122.205 120.400 -0.024 0.000 2.363 1231 D HA 0.054 4.694 4.640 -0.000 0.000 0.226 1231 D C 0.702 176.982 176.300 -0.033 0.000 1.020 1231 D CA 0.262 54.246 54.000 -0.027 0.000 0.892 1231 D CB 0.218 41.004 40.800 -0.023 0.000 0.900 1231 D HN 0.240 nan 8.370 nan 0.000 0.531 1232 S N -1.121 114.558 115.700 -0.035 0.000 3.021 1232 S HA 0.600 5.070 4.470 -0.000 0.000 0.252 1232 S C -0.397 174.175 174.600 -0.046 0.000 0.996 1232 S CA -0.066 58.109 58.200 -0.041 0.000 1.084 1232 S CB -0.206 62.972 63.200 -0.036 0.000 1.021 1232 S HN 0.530 nan 8.310 nan 0.000 0.566 1233 A N 0.744 123.536 122.820 -0.046 0.000 2.564 1233 A HA 0.778 5.098 4.320 -0.000 0.000 0.288 1233 A C -1.571 175.981 177.584 -0.053 0.000 1.164 1233 A CA -0.598 51.411 52.037 -0.046 0.000 0.712 1233 A CB 0.507 19.486 19.000 -0.034 0.000 1.303 1233 A HN 0.252 nan 8.150 nan 0.000 0.418 1234 L N 2.666 123.860 121.223 -0.049 0.000 2.418 1234 L HA 0.251 4.591 4.340 -0.000 0.000 0.274 1234 L C 0.733 177.581 176.870 -0.036 0.000 1.135 1234 L CA 0.694 55.499 54.840 -0.058 0.000 0.870 1234 L CB -0.884 41.159 42.059 -0.026 0.000 1.154 1234 L HN 0.941 nan 8.230 nan 0.000 0.462 1235 N N 1.881 120.556 118.700 -0.042 0.000 3.229 1235 N HA 0.538 5.278 4.740 -0.000 0.000 0.315 1235 N C 0.537 176.036 175.510 -0.018 0.000 1.520 1235 N CA -0.311 52.723 53.050 -0.026 0.000 0.769 1235 N CB 0.950 39.421 38.487 -0.026 0.000 1.766 1235 N HN 0.267 nan 8.380 nan 0.000 0.618 1236 A N 0.109 122.924 122.820 -0.008 0.000 1.940 1236 A HA -0.195 4.124 4.320 -0.000 0.000 0.219 1236 A C 2.109 179.696 177.584 0.005 0.000 1.176 1236 A CA 1.384 53.424 52.037 0.006 0.000 0.631 1236 A CB -0.730 18.274 19.000 0.008 0.000 0.814 1236 A HN 0.668 nan 8.150 nan 0.000 0.446 1237 K N -0.332 120.061 120.400 -0.012 0.000 2.025 1237 K HA -0.128 4.192 4.320 -0.000 0.000 0.207 1237 K C 1.996 178.575 176.600 -0.036 0.000 1.049 1237 K CA 1.024 57.300 56.287 -0.019 0.000 0.933 1237 K CB -0.292 32.192 32.500 -0.025 0.000 0.714 1237 K HN 0.306 nan 8.250 nan 0.000 0.438 1238 R N 0.796 121.259 120.500 -0.062 0.000 2.096 1238 R HA -0.033 4.307 4.340 -0.000 0.000 0.235 1238 R C 2.461 178.701 176.300 -0.100 0.000 1.127 1238 R CA 0.816 56.847 56.100 -0.115 0.000 0.968 1238 R CB -0.770 29.430 30.300 -0.167 0.000 0.861 1238 R HN 0.280 nan 8.270 nan 0.000 0.440 1239 L N 0.264 121.473 121.223 -0.025 0.000 2.291 1239 L HA 0.005 4.345 4.340 -0.000 0.000 0.214 1239 L C 2.492 179.456 176.870 0.157 0.000 1.120 1239 L CA 0.801 55.694 54.840 0.089 0.000 0.799 1239 L CB -0.463 41.658 42.059 0.103 0.000 0.925 1239 L HN 0.109 nan 8.230 nan 0.000 0.446 1240 A N 0.179 123.045 122.820 0.076 0.000 1.898 1240 A HA -0.192 4.128 4.320 -0.000 0.000 0.216 1240 A C 2.156 179.752 177.584 0.020 0.000 1.181 1240 A CA 1.404 53.479 52.037 0.064 0.000 0.620 1240 A CB -0.303 18.717 19.000 0.033 0.000 0.819 1240 A HN 0.431 nan 8.150 nan 0.000 0.442 1241 E N -0.251 119.940 120.200 -0.016 0.000 2.077 1241 E HA -0.130 4.220 4.350 -0.000 0.000 0.193 1241 E C 1.949 178.525 176.600 -0.040 0.000 0.989 1241 E CA 1.298 57.674 56.400 -0.041 0.000 0.800 1241 E CB -0.316 29.336 29.700 -0.079 0.000 0.746 1241 E HN 0.397 nan 8.360 nan 0.000 0.452 1242 V N 1.415 121.294 119.914 -0.058 0.000 2.343 1242 V HA -0.289 3.831 4.120 -0.000 0.000 0.247 1242 V C 2.459 178.540 176.094 -0.023 0.000 1.051 1242 V CA 2.174 64.454 62.300 -0.033 0.000 1.036 1242 V CB -0.526 31.303 31.823 0.009 0.000 0.654 1242 V HN 0.205 nan 8.190 nan 0.000 0.451 1243 R N 0.895 121.293 120.500 -0.169 0.000 2.081 1243 R HA -0.177 4.163 4.340 -0.000 0.000 0.235 1243 R C 2.003 178.225 176.300 -0.129 0.000 1.131 1243 R CA 2.140 58.006 56.100 -0.390 0.000 0.960 1243 R CB -0.447 29.667 30.300 -0.310 0.000 0.856 1243 R HN 0.508 nan 8.270 nan 0.000 0.436 1244 N N 0.379 119.056 118.700 -0.039 0.000 2.244 1244 N HA -0.107 4.633 4.740 -0.000 0.000 0.183 1244 N C 1.627 177.166 175.510 0.048 0.000 1.016 1244 N CA 1.272 54.326 53.050 0.007 0.000 0.866 1244 N CB -0.131 38.363 38.487 0.013 0.000 0.980 1244 N HN 0.273 nan 8.380 nan 0.000 0.430 1245 L N 0.336 121.608 121.223 0.082 0.000 2.093 1245 L HA -0.032 4.308 4.340 -0.000 0.000 0.208 1245 L C 1.996 178.946 176.870 0.133 0.000 1.085 1245 L CA 0.673 55.593 54.840 0.133 0.000 0.755 1245 L CB -0.315 41.904 42.059 0.266 0.000 0.904 1245 L HN 0.104 nan 8.230 nan 0.000 0.435 1246 I N -0.411 120.236 120.570 0.127 0.000 2.208 1246 I HA -0.356 3.813 4.170 -0.000 0.000 0.245 1246 I C 2.610 178.774 176.117 0.079 0.000 1.097 1246 I CA 1.457 62.800 61.300 0.072 0.000 1.363 1246 I CB -0.354 37.662 38.000 0.026 0.000 1.051 1246 I HN 0.355 nan 8.210 nan 0.000 0.413 1247 Q N 0.519 120.356 119.800 0.063 0.000 2.050 1247 Q HA -0.193 4.147 4.340 -0.000 0.000 0.202 1247 Q C 2.397 178.491 176.000 0.156 0.000 0.980 1247 Q CA 2.225 58.078 55.803 0.084 0.000 0.840 1247 Q CB -0.285 28.488 28.738 0.057 0.000 0.898 1247 Q HN 0.611 nan 8.270 nan 0.000 0.424 1248 S N 0.278 116.092 115.700 0.190 0.000 2.423 1248 S HA -0.100 4.370 4.470 -0.000 0.000 0.231 1248 S C 1.965 176.873 174.600 0.512 0.000 1.014 1248 S CA 0.856 59.247 58.200 0.318 0.000 0.965 1248 S CB -0.252 63.125 63.200 0.296 0.000 0.785 1248 S HN 0.237 nan 8.310 nan 0.000 0.495 1249 M N 1.278 121.132 119.600 0.424 0.000 2.065 1249 M HA -0.085 4.395 4.480 -0.000 0.000 0.259 1249 M C 2.680 179.188 176.300 0.348 0.000 1.069 1249 M CA 1.853 57.470 55.300 0.529 0.000 1.110 1249 M CB -0.406 32.379 32.600 0.309 0.000 1.328 1249 M HN 0.283 nan 8.290 nan 0.000 0.405 1250 R N -0.144 120.485 120.500 0.214 0.000 2.091 1250 R HA -0.134 4.206 4.340 -0.000 0.000 0.238 1250 R C 2.027 178.402 176.300 0.125 0.000 1.136 1250 R CA 2.056 58.236 56.100 0.133 0.000 0.959 1250 R CB -0.283 30.069 30.300 0.086 0.000 0.856 1250 R HN 0.314 nan 8.270 nan 0.000 0.437 1251 T N 0.110 114.769 114.554 0.175 0.000 2.777 1251 T HA -0.136 4.214 4.350 -0.000 0.000 0.266 1251 T C 1.302 176.063 174.700 0.102 0.000 1.040 1251 T CA 1.381 63.582 62.100 0.170 0.000 1.141 1251 T CB -0.300 68.718 68.868 0.251 0.000 0.868 1251 T HN 0.214 nan 8.240 nan 0.000 0.444 1252 F N 1.335 121.236 119.950 -0.081 0.000 2.146 1252 F HA -0.089 4.438 4.527 -0.000 0.000 0.298 1252 F C 2.299 177.860 175.800 -0.399 0.000 1.096 1252 F CA 0.802 58.518 58.000 -0.474 0.000 1.275 1252 F CB -0.355 37.962 39.000 -1.139 0.000 1.008 1252 F HN -0.113 nan 8.300 nan 0.000 0.480 1253 V N 0.216 120.094 119.914 -0.060 0.000 2.295 1253 V HA -0.315 3.805 4.120 -0.000 0.000 0.246 1253 V C 2.015 178.037 176.094 -0.119 0.000 1.049 1253 V CA 2.272 64.570 62.300 -0.003 0.000 1.024 1253 V CB -0.621 31.262 31.823 0.100 0.000 0.648 1253 V HN 0.272 nan 8.190 nan 0.000 0.447 1254 D N -0.653 119.692 120.400 -0.092 0.000 2.144 1254 D HA -0.155 4.485 4.640 -0.000 0.000 0.199 1254 D C 2.293 178.505 176.300 -0.146 0.000 0.984 1254 D CA 1.313 55.253 54.000 -0.099 0.000 0.834 1254 D CB -0.069 40.709 40.800 -0.037 0.000 0.955 1254 D HN 0.522 nan 8.370 nan 0.000 0.465 1255 Q N -0.682 118.996 119.800 -0.203 0.000 2.392 1255 Q HA 0.102 4.442 4.340 -0.000 0.000 0.219 1255 Q C 1.692 177.437 176.000 -0.425 0.000 0.895 1255 Q CA 0.161 55.855 55.803 -0.181 0.000 0.929 1255 Q CB 1.464 30.224 28.738 0.036 0.000 1.077 1255 Q HN 0.105 nan 8.270 nan 0.000 0.532 1256 V N -1.006 118.444 119.914 -0.773 0.000 3.001 1256 V HA -0.084 4.036 4.120 -0.000 0.000 0.228 1256 V C 1.467 177.262 176.094 -0.499 0.000 1.204 1256 V CA 0.571 62.224 62.300 -1.079 0.000 1.247 1256 V CB -0.551 29.892 31.823 -2.301 0.000 1.093 1256 V HN 0.230 nan 8.190 nan 0.000 0.504 1257 Y N 1.755 121.705 120.300 -0.583 0.000 2.070 1257 Y HA -0.178 4.372 4.550 -0.000 0.000 0.279 1257 Y C 2.358 178.029 175.900 -0.382 0.000 1.134 1257 Y CA 2.068 59.977 58.100 -0.318 0.000 1.113 1257 Y CB -0.817 37.514 38.460 -0.214 0.000 0.981 1257 Y HN -0.000 nan 8.280 nan 0.000 0.487 1258 V N 1.509 121.136 119.914 -0.479 0.000 2.255 1258 V HA -0.252 3.868 4.120 -0.000 0.000 0.247 1258 V C -0.330 175.560 176.094 -0.339 0.000 1.051 1258 V CA 2.678 64.659 62.300 -0.532 0.000 1.018 1258 V CB -2.008 29.578 31.823 -0.395 0.000 0.641 1258 V HN 0.285 nan 8.190 nan 0.000 0.445 1259 P HA -0.115 nan 4.420 nan 0.000 0.216 1259 P C 1.052 178.295 177.300 -0.096 0.000 1.150 1259 P CA 1.498 64.517 63.100 -0.136 0.000 0.837 1259 P CB -0.055 31.591 31.700 -0.089 0.000 0.786 1260 D N -1.498 118.858 120.400 -0.074 0.000 2.117 1260 D HA -0.106 4.534 4.640 -0.000 0.000 0.198 1260 D C 1.915 178.175 176.300 -0.068 0.000 0.982 1260 D CA 1.330 55.355 54.000 0.042 0.000 0.828 1260 D CB -1.137 39.810 40.800 0.246 0.000 0.967 1260 D HN 0.097 nan 8.370 nan 0.000 0.464 1261 T N 1.089 115.436 114.554 -0.345 0.000 2.624 1261 T HA -0.151 4.199 4.350 -0.000 0.000 0.268 1261 T C 2.139 176.702 174.700 -0.227 0.000 1.041 1261 T CA 0.905 62.737 62.100 -0.447 0.000 1.159 1261 T CB -0.394 68.047 68.868 -0.711 0.000 0.863 1261 T HN 0.139 nan 8.240 nan 0.000 0.434 1262 L N 0.444 121.549 121.223 -0.197 0.000 2.093 1262 L HA -0.004 4.336 4.340 -0.000 0.000 0.208 1262 L C 3.040 179.881 176.870 -0.049 0.000 1.085 1262 L CA 1.042 55.806 54.840 -0.126 0.000 0.755 1262 L CB -0.673 41.312 42.059 -0.123 0.000 0.904 1262 L HN 0.245 nan 8.230 nan 0.000 0.435 1263 A N 0.410 123.225 122.820 -0.008 0.000 1.898 1263 A HA -0.135 4.185 4.320 -0.000 0.000 0.216 1263 A C 2.208 179.890 177.584 0.164 0.000 1.181 1263 A CA 1.362 53.443 52.037 0.073 0.000 0.620 1263 A CB -0.540 18.513 19.000 0.088 0.000 0.819 1263 A HN 0.328 nan 8.150 nan 0.000 0.442 1264 I N -0.303 120.346 120.570 0.132 0.000 2.353 1264 I HA -0.211 3.959 4.170 -0.000 0.000 0.248 1264 I C 2.927 179.172 176.117 0.214 0.000 1.119 1264 I CA 0.819 62.241 61.300 0.203 0.000 1.417 1264 I CB -0.324 37.760 38.000 0.140 0.000 1.078 1264 I HN 0.346 nan 8.210 nan 0.000 0.421 1265 A N 1.134 123.977 122.820 0.038 0.000 1.986 1265 A HA -0.203 4.117 4.320 -0.000 0.000 0.220 1265 A C 2.420 180.036 177.584 0.054 0.000 1.171 1265 A CA 1.979 54.018 52.037 0.003 0.000 0.640 1265 A CB -1.474 17.478 19.000 -0.081 0.000 0.811 1265 A HN 0.482 nan 8.150 nan 0.000 0.451 1266 G N -1.654 107.157 108.800 0.018 0.000 2.462 1266 G HA2 -0.177 3.783 3.960 -0.000 0.000 0.220 1266 G HA3 -0.177 3.783 3.960 -0.000 0.000 0.220 1266 G C 1.131 175.882 174.900 -0.249 0.000 1.121 1266 G CA 1.075 46.096 45.100 -0.132 0.000 0.758 1266 G HN 0.501 nan 8.290 nan 0.000 0.559 1267 F N -1.449 118.422 119.950 -0.132 0.000 2.765 1267 F HA 0.346 4.873 4.527 -0.000 0.000 0.302 1267 F C 0.673 176.182 175.800 -0.484 0.000 1.111 1267 F CA -0.042 57.758 58.000 -0.334 0.000 1.359 1267 F CB 0.363 39.080 39.000 -0.471 0.000 1.097 1267 F HN 0.115 nan 8.300 nan 0.000 0.577 1268 Y N -1.059 119.363 120.300 0.203 0.000 2.696 1268 Y HA 0.224 4.774 4.550 -0.000 0.000 0.255 1268 Y C 1.365 177.417 175.900 0.253 0.000 1.103 1268 Y CA -0.626 57.644 58.100 0.282 0.000 1.126 1268 Y CB -0.081 38.483 38.460 0.173 0.000 1.197 1268 Y HN -0.153 nan 8.280 nan 0.000 0.574 1269 K N 0.597 121.126 120.400 0.214 0.000 2.147 1269 K HA -0.180 4.140 4.320 -0.000 0.000 0.205 1269 K C 1.489 178.171 176.600 0.137 0.000 1.049 1269 K CA 1.733 58.098 56.287 0.130 0.000 0.936 1269 K CB -0.050 32.469 32.500 0.032 0.000 0.722 1269 K HN 0.516 nan 8.250 nan 0.000 0.446 1270 D N -0.074 120.412 120.400 0.144 0.000 2.309 1270 D HA -0.200 4.440 4.640 -0.000 0.000 0.212 1270 D C 1.113 177.366 176.300 -0.079 0.000 0.968 1270 D CA 0.765 54.777 54.000 0.019 0.000 0.882 1270 D CB -0.516 40.270 40.800 -0.024 0.000 0.918 1270 D HN 0.292 nan 8.370 nan 0.000 0.503 1271 W N 1.508 122.889 121.300 0.135 0.000 2.961 1271 W HA 0.276 4.936 4.660 -0.000 0.000 0.240 1271 W C 2.286 178.857 176.519 0.086 0.000 1.305 1271 W CA 0.604 58.033 57.345 0.140 0.000 1.465 1271 W CB -0.073 29.552 29.460 0.276 0.000 1.135 1271 W HN 0.096 nan 8.180 nan 0.000 0.688 1272 G N -0.013 108.880 108.800 0.154 0.000 3.088 1272 G HA2 -0.042 3.918 3.960 -0.000 0.000 0.212 1272 G HA3 -0.042 3.918 3.960 -0.000 0.000 0.212 1272 G C 0.725 175.651 174.900 0.044 0.000 1.173 1272 G CA 0.083 45.236 45.100 0.088 0.000 0.779 1272 G HN 0.344 nan 8.290 nan 0.000 0.540 1273 E N -0.331 119.860 120.200 -0.014 0.000 2.812 1273 E HA 0.200 4.550 4.350 -0.000 0.000 0.211 1273 E C 0.393 176.945 176.600 -0.080 0.000 0.986 1273 E CA -0.398 55.978 56.400 -0.040 0.000 1.119 1273 E CB 0.621 30.281 29.700 -0.066 0.000 1.046 1273 E HN 0.524 nan 8.360 nan 0.000 0.474 1274 R N -1.695 118.759 120.500 -0.077 0.000 2.734 1274 R HA 0.658 4.998 4.340 -0.000 0.000 0.271 1274 R C 0.118 176.500 176.300 0.135 0.000 1.021 1274 R CA -0.581 55.474 56.100 -0.075 0.000 0.893 1274 R CB 0.915 30.948 30.300 -0.445 0.000 1.244 1274 R HN 0.035 nan 8.270 nan 0.000 0.464 1275 G N 0.148 109.137 108.800 0.315 0.000 2.141 1275 G HA2 -0.181 3.779 3.960 -0.000 0.000 0.195 1275 G HA3 -0.181 3.779 3.960 -0.000 0.000 0.195 1275 G C -0.467 174.626 174.900 0.322 0.000 1.012 1275 G CA 0.256 45.626 45.100 0.451 0.000 0.696 1275 G HN 0.585 nan 8.290 nan 0.000 0.508 1276 E N -0.246 120.114 120.200 0.267 0.000 2.432 1276 E HA 0.521 4.871 4.350 -0.000 0.000 0.272 1276 E C 0.565 177.282 176.600 0.196 0.000 0.937 1276 E CA 0.106 56.669 56.400 0.272 0.000 0.812 1276 E CB 0.713 30.603 29.700 0.317 0.000 1.377 1276 E HN 0.555 nan 8.360 nan 0.000 0.399 1277 G N 3.351 112.248 108.800 0.162 0.000 3.735 1277 G HA2 0.186 4.146 3.960 -0.000 0.000 0.283 1277 G HA3 0.186 4.146 3.960 -0.000 0.000 0.283 1277 G C 0.826 175.751 174.900 0.041 0.000 1.007 1277 G CA -0.001 45.151 45.100 0.087 0.000 0.821 1277 G HN 0.413 nan 8.290 nan 0.000 0.505 1278 L N -0.831 120.407 121.223 0.025 0.000 2.433 1278 L HA 0.335 4.675 4.340 -0.000 0.000 0.200 1278 L C 2.232 179.049 176.870 -0.088 0.000 1.059 1278 L CA 0.775 55.584 54.840 -0.052 0.000 0.835 1278 L CB 0.067 42.061 42.059 -0.109 0.000 1.076 1278 L HN 0.289 nan 8.230 nan 0.000 0.481 1279 G N 0.599 109.337 108.800 -0.105 0.000 2.205 1279 G HA2 -0.239 3.721 3.960 -0.000 0.000 0.261 1279 G HA3 -0.239 3.721 3.960 -0.000 0.000 0.261 1279 G C 0.017 174.867 174.900 -0.082 0.000 0.980 1279 G CA 0.130 45.211 45.100 -0.031 0.000 0.632 1279 G HN 0.362 nan 8.290 nan 0.000 0.533 1280 N N -0.115 118.321 118.700 -0.440 0.000 2.321 1280 N HA 0.776 5.516 4.740 -0.000 0.000 0.299 1280 N C -1.125 173.921 175.510 -0.773 0.000 1.048 1280 N CA -0.143 52.706 53.050 -0.335 0.000 0.836 1280 N CB 1.551 39.949 38.487 -0.148 0.000 1.269 1280 N HN 0.086 nan 8.380 nan 0.000 0.486 1281 F N 0.570 120.485 119.950 -0.058 0.000 2.591 1281 F HA 0.518 5.045 4.527 -0.000 0.000 0.309 1281 F C -0.522 175.127 175.800 -0.251 0.000 1.098 1281 F CA -0.971 56.963 58.000 -0.110 0.000 0.937 1281 F CB 1.812 40.787 39.000 -0.042 0.000 1.250 1281 F HN 0.177 nan 8.300 nan 0.000 0.447 1282 L N 2.839 123.944 121.223 -0.197 0.000 2.410 1282 L HA 0.845 5.185 4.340 -0.000 0.000 0.270 1282 L C -1.593 175.082 176.870 -0.326 0.000 0.983 1282 L CA -0.424 54.178 54.840 -0.396 0.000 0.822 1282 L CB 1.640 43.284 42.059 -0.691 0.000 1.285 1282 L HN 0.757 nan 8.230 nan 0.000 0.409 1283 C N 4.336 123.503 119.300 -0.222 0.000 2.482 1283 C HA 0.440 4.900 4.460 -0.000 0.000 0.317 1283 C C 0.574 175.588 174.990 0.041 0.000 1.197 1283 C CA -0.572 58.353 59.018 -0.154 0.000 1.432 1283 C CB 1.270 28.975 27.740 -0.057 0.000 2.062 1283 C HN 0.849 nan 8.230 nan 0.000 0.471 1284 Y N 1.730 122.015 120.300 -0.026 0.000 2.475 1284 Y HA 0.300 4.850 4.550 -0.000 0.000 0.289 1284 Y C 1.718 177.684 175.900 0.109 0.000 1.121 1284 Y CA 0.948 59.076 58.100 0.047 0.000 1.257 1284 Y CB -0.946 37.531 38.460 0.028 0.000 1.026 1284 Y HN 1.088 nan 8.280 nan 0.000 0.555 1285 G N 0.568 109.479 108.800 0.184 0.000 2.758 1285 G HA2 0.016 3.976 3.960 -0.000 0.000 0.686 1285 G HA3 0.016 3.976 3.960 -0.000 0.000 0.686 1285 G C -1.142 173.538 174.900 -0.367 0.000 1.389 1285 G CA -0.159 45.009 45.100 0.113 0.000 0.845 1285 G HN 0.259 nan 8.290 nan 0.000 0.572 1286 D N -1.155 118.815 120.400 -0.717 0.000 2.792 1286 D HA 0.527 5.167 4.640 -0.000 0.000 0.335 1286 D C 0.263 176.109 176.300 -0.757 0.000 1.353 1286 D CA 0.145 53.551 54.000 -0.991 0.000 0.839 1286 D CB 0.587 41.224 40.800 -0.272 0.000 1.396 1286 D HN 1.618 nan 8.370 nan 0.000 0.479 1287 L N -0.889 120.051 121.223 -0.472 0.000 3.315 1287 L HA -0.109 4.231 4.340 -0.000 0.000 0.667 1287 L C -2.267 174.612 176.870 0.016 0.000 1.285 1287 L CA -0.318 54.374 54.840 -0.247 0.000 1.127 1287 L CB -1.320 40.614 42.059 -0.208 0.000 1.759 1287 L HN 0.290 nan 8.230 nan 0.000 0.886 1288 P HA 0.063 nan 4.420 nan 0.000 0.274 1288 P C 0.775 178.177 177.300 0.171 0.000 1.237 1288 P CA -0.142 63.137 63.100 0.299 0.000 0.793 1288 P CB 1.143 33.014 31.700 0.285 0.000 0.977 1289 T N 0.300 114.969 114.554 0.192 0.000 2.867 1289 T HA 0.069 4.419 4.350 -0.000 0.000 0.268 1289 T C 1.037 175.813 174.700 0.126 0.000 1.057 1289 T CA 1.711 63.924 62.100 0.187 0.000 1.136 1289 T CB -0.417 68.532 68.868 0.136 0.000 0.874 1289 T HN 0.688 nan 8.240 nan 0.000 0.466 1290 G N -1.166 107.681 108.800 0.079 0.000 3.222 1290 G HA2 0.604 4.564 3.960 -0.000 0.000 0.263 1290 G HA3 0.604 4.564 3.960 -0.000 0.000 0.263 1290 G C 0.936 175.850 174.900 0.023 0.000 1.312 1290 G CA 0.120 45.248 45.100 0.046 0.000 0.934 1290 G HN 0.078 nan 8.290 nan 0.000 0.577 1291 A N -0.484 122.343 122.820 0.011 0.000 1.930 1291 A HA 0.239 4.559 4.320 -0.000 0.000 0.217 1291 A C 1.800 179.385 177.584 0.003 0.000 1.175 1291 A CA 1.807 53.843 52.037 -0.001 0.000 0.627 1291 A CB -0.898 18.099 19.000 -0.005 0.000 0.815 1291 A HN 1.473 nan 8.150 nan 0.000 0.443 1292 S N -0.612 115.093 115.700 0.008 0.000 2.565 1292 S HA 0.494 4.964 4.470 -0.000 0.000 0.274 1292 S C 0.065 174.685 174.600 0.034 0.000 1.309 1292 S CA -0.646 57.559 58.200 0.008 0.000 1.043 1292 S CB 0.862 64.057 63.200 -0.008 0.000 0.939 1292 S HN 0.277 nan 8.310 nan 0.000 0.504 1293 L N 2.652 123.907 121.223 0.053 0.000 2.436 1293 L HA 0.135 4.475 4.340 -0.000 0.000 0.244 1293 L C 0.071 176.954 176.870 0.022 0.000 1.396 1293 L CA 0.133 55.057 54.840 0.139 0.000 1.217 1293 L CB -0.875 41.267 42.059 0.138 0.000 1.420 1293 L HN 0.771 nan 8.230 nan 0.000 0.434 1294 D N 2.142 122.479 120.400 -0.105 0.000 2.317 1294 D HA 0.208 4.848 4.640 -0.000 0.000 0.234 1294 D C -1.656 174.179 176.300 -0.776 0.000 1.112 1294 D CA -2.271 51.557 54.000 -0.286 0.000 0.840 1294 D CB 1.868 42.575 40.800 -0.155 0.000 1.078 1294 D HN 0.040 nan 8.370 nan 0.000 0.486 1295 P HA -0.106 nan 4.420 nan 0.000 0.218 1295 P C 0.838 177.730 177.300 -0.679 0.000 1.146 1295 P CA 1.182 63.473 63.100 -1.349 0.000 0.813 1295 P CB 0.199 31.604 31.700 -0.492 0.000 0.778 1296 A N -1.775 120.828 122.820 -0.361 0.000 2.168 1296 A HA -0.067 4.253 4.320 -0.000 0.000 0.215 1296 A C 2.100 179.622 177.584 -0.102 0.000 1.152 1296 A CA 1.676 53.618 52.037 -0.158 0.000 0.716 1296 A CB -1.276 17.665 19.000 -0.099 0.000 0.794 1296 A HN 0.136 nan 8.150 nan 0.000 0.465 1297 T N -1.051 113.409 114.554 -0.157 0.000 3.023 1297 T HA 0.316 4.666 4.350 -0.000 0.000 0.253 1297 T C 0.153 174.953 174.700 0.167 0.000 1.038 1297 T CA -0.516 61.581 62.100 -0.006 0.000 0.962 1297 T CB -0.312 68.540 68.868 -0.027 0.000 1.018 1297 T HN 0.388 nan 8.240 nan 0.000 0.521 1298 F N 1.397 121.377 119.950 0.050 0.000 2.563 1298 F HA 0.099 4.626 4.527 -0.000 0.000 0.363 1298 F C 1.603 177.433 175.800 0.050 0.000 1.123 1298 F CA -0.631 57.402 58.000 0.056 0.000 1.307 1298 F CB 0.737 39.786 39.000 0.081 0.000 1.115 1298 F HN 0.024 nan 8.300 nan 0.000 0.592 1299 L N 2.558 123.886 121.223 0.175 0.000 2.005 1299 L HA -0.109 4.231 4.340 -0.000 0.000 0.207 1299 L C 0.246 177.091 176.870 -0.042 0.000 1.072 1299 L CA 1.308 56.135 54.840 -0.022 0.000 0.744 1299 L CB -0.016 41.892 42.059 -0.250 0.000 0.895 1299 L HN 0.315 nan 8.230 nan 0.000 0.433 1300 F N 1.691 121.682 119.950 0.068 0.000 2.390 1300 F HA 0.355 4.882 4.527 -0.000 0.000 0.361 1300 F C -1.839 174.043 175.800 0.136 0.000 1.124 1300 F CA -3.648 54.373 58.000 0.035 0.000 1.149 1300 F CB 0.009 38.986 39.000 -0.040 0.000 1.160 1300 F HN -0.027 nan 8.300 nan 0.000 0.501 1301 P HA 0.106 nan 4.420 nan 0.000 0.272 1301 P C -0.434 177.032 177.300 0.276 0.000 1.230 1301 P CA -0.561 62.724 63.100 0.309 0.000 0.788 1301 P CB 0.976 32.798 31.700 0.203 0.000 0.949 1302 R N 0.713 121.389 120.500 0.292 0.000 2.410 1302 R HA 0.611 4.951 4.340 -0.000 0.000 0.288 1302 R C -0.036 176.356 176.300 0.153 0.000 1.051 1302 R CA 0.052 56.298 56.100 0.244 0.000 1.021 1302 R CB 0.105 30.570 30.300 0.274 0.000 1.032 1302 R HN 0.834 nan 8.270 nan 0.000 0.481 1303 G N 0.823 109.687 108.800 0.105 0.000 2.336 1303 G HA2 0.411 4.371 3.960 -0.000 0.000 0.300 1303 G HA3 0.411 4.371 3.960 -0.000 0.000 0.300 1303 G C -2.059 172.805 174.900 -0.059 0.000 1.375 1303 G CA -0.306 44.828 45.100 0.056 0.000 0.885 1303 G HN 0.780 nan 8.290 nan 0.000 0.599 1304 A N -0.416 122.346 122.820 -0.097 0.000 2.414 1304 A HA 0.875 5.195 4.320 -0.000 0.000 0.306 1304 A C -0.763 176.835 177.584 0.024 0.000 1.054 1304 A CA -0.611 51.272 52.037 -0.257 0.000 0.724 1304 A CB 1.269 19.733 19.000 -0.894 0.000 1.267 1304 A HN 0.963 nan 8.150 nan 0.000 0.418 1305 I N 2.354 122.970 120.570 0.076 0.000 2.378 1305 I HA 0.359 4.529 4.170 -0.000 0.000 0.291 1305 I C -0.776 175.472 176.117 0.218 0.000 0.992 1305 I CA -0.290 61.146 61.300 0.226 0.000 1.154 1305 I CB 1.530 39.692 38.000 0.270 0.000 1.315 1305 I HN 0.488 nan 8.210 nan 0.000 0.448 1306 L N 5.575 126.950 121.223 0.253 0.000 2.325 1306 L HA 0.439 4.779 4.340 -0.000 0.000 0.278 1306 L C -0.081 176.879 176.870 0.150 0.000 1.023 1306 L CA -0.662 54.272 54.840 0.157 0.000 0.811 1306 L CB 1.262 43.378 42.059 0.095 0.000 1.249 1306 L HN 0.656 nan 8.230 nan 0.000 0.431 1307 D N 2.742 123.195 120.400 0.088 0.000 2.837 1307 D HA -0.211 4.429 4.640 -0.000 0.000 0.230 1307 D C 0.462 176.777 176.300 0.026 0.000 1.152 1307 D CA 0.772 54.799 54.000 0.045 0.000 0.736 1307 D CB -0.668 40.162 40.800 0.050 0.000 1.084 1307 D HN 0.770 nan 8.370 nan 0.000 0.429 1308 R N -1.418 119.122 120.500 0.068 0.000 3.875 1308 R HA -0.226 4.114 4.340 -0.000 0.000 0.321 1308 R C -0.218 176.117 176.300 0.059 0.000 1.196 1308 R CA 1.224 57.306 56.100 -0.030 0.000 0.868 1308 R CB -1.479 28.544 30.300 -0.462 0.000 1.333 1308 R HN 0.270 nan 8.270 nan 0.000 0.522 1309 D N 0.618 121.087 120.400 0.116 0.000 2.411 1309 D HA 0.131 4.771 4.640 -0.000 0.000 0.225 1309 D C 0.719 177.096 176.300 0.128 0.000 1.156 1309 D CA -0.435 53.633 54.000 0.113 0.000 0.874 1309 D CB 0.854 41.722 40.800 0.114 0.000 1.034 1309 D HN -0.050 nan 8.370 nan 0.000 0.502 1310 L N 2.984 124.281 121.223 0.123 0.000 2.599 1310 L HA 0.023 4.363 4.340 -0.000 0.000 0.230 1310 L C 2.118 179.043 176.870 0.091 0.000 1.141 1310 L CA 0.719 55.632 54.840 0.122 0.000 0.877 1310 L CB -0.893 41.255 42.059 0.147 0.000 1.009 1310 L HN 0.481 nan 8.230 nan 0.000 0.447 1311 S N -3.548 112.194 115.700 0.070 0.000 2.548 1311 S HA 0.110 4.580 4.470 -0.000 0.000 0.215 1311 S C 0.735 175.342 174.600 0.012 0.000 0.976 1311 S CA -0.138 58.089 58.200 0.045 0.000 0.908 1311 S CB -0.094 63.132 63.200 0.043 0.000 0.781 1311 S HN 0.276 nan 8.310 nan 0.000 0.519 1312 T N 3.603 118.151 114.554 -0.009 0.000 2.906 1312 T HA 0.478 4.828 4.350 -0.000 0.000 0.302 1312 T C -0.815 173.790 174.700 -0.159 0.000 1.002 1312 T CA -0.570 61.464 62.100 -0.111 0.000 0.988 1312 T CB 1.085 69.841 68.868 -0.187 0.000 0.972 1312 T HN 0.136 nan 8.240 nan 0.000 0.447 1313 I N 4.581 125.080 120.570 -0.119 0.000 2.291 1313 I HA 0.211 4.381 4.170 -0.000 0.000 0.292 1313 I C 0.755 176.811 176.117 -0.101 0.000 1.064 1313 I CA -0.610 60.653 61.300 -0.062 0.000 1.269 1313 I CB -0.044 37.963 38.000 0.012 0.000 1.418 1313 I HN 0.567 nan 8.210 nan 0.000 0.485 1314 H N 5.121 124.248 119.070 0.094 0.000 2.652 1314 H HA 0.223 4.779 4.556 -0.000 0.000 0.349 1314 H C 0.118 175.544 175.328 0.163 0.000 1.099 1314 H CA -0.030 56.114 56.048 0.161 0.000 1.417 1314 H CB 1.217 31.130 29.762 0.251 0.000 1.457 1314 H HN 0.505 nan 8.280 nan 0.000 0.568 1315 E N 1.256 121.651 120.200 0.324 0.000 2.366 1315 E HA 0.217 4.567 4.350 -0.000 0.000 0.266 1315 E C -0.375 176.461 176.600 0.392 0.000 1.051 1315 E CA -0.468 56.095 56.400 0.272 0.000 0.884 1315 E CB 1.626 31.452 29.700 0.209 0.000 1.006 1315 E HN 0.275 nan 8.360 nan 0.000 0.417 1316 V N 2.157 122.265 119.914 0.323 0.000 2.540 1316 V HA 0.352 4.472 4.120 -0.000 0.000 0.302 1316 V C -1.243 175.037 176.094 0.309 0.000 1.035 1316 V CA -0.686 61.870 62.300 0.426 0.000 0.873 1316 V CB 1.918 33.979 31.823 0.397 0.000 0.992 1316 V HN 0.603 nan 8.190 nan 0.000 0.428 1317 D N 4.631 125.224 120.400 0.322 0.000 2.414 1317 D HA 0.370 5.010 4.640 -0.000 0.000 0.232 1317 D C 0.734 177.188 176.300 0.257 0.000 1.070 1317 D CA -0.275 53.856 54.000 0.220 0.000 0.839 1317 D CB 1.852 42.751 40.800 0.164 0.000 1.079 1317 D HN 0.600 nan 8.370 nan 0.000 0.521 1318 L N 2.811 124.159 121.223 0.209 0.000 2.465 1318 L HA 0.034 4.373 4.340 -0.000 0.000 0.224 1318 L C 1.713 178.879 176.870 0.493 0.000 1.145 1318 L CA 0.930 55.942 54.840 0.287 0.000 0.834 1318 L CB 0.071 42.135 42.059 0.008 0.000 0.944 1318 L HN 0.435 nan 8.230 nan 0.000 0.451 1319 E N -0.437 119.954 120.200 0.318 0.000 2.490 1319 E HA 0.244 4.594 4.350 -0.000 0.000 0.209 1319 E C 0.687 177.279 176.600 -0.013 0.000 0.971 1319 E CA -0.081 56.490 56.400 0.285 0.000 0.988 1319 E CB 0.519 30.410 29.700 0.318 0.000 1.029 1319 E HN 0.311 nan 8.360 nan 0.000 0.496 1320 A N 1.398 124.225 122.820 0.012 0.000 2.451 1320 A HA 0.061 4.381 4.320 -0.000 0.000 0.266 1320 A C 1.152 178.611 177.584 -0.208 0.000 1.119 1320 A CA 0.188 52.184 52.037 -0.068 0.000 0.786 1320 A CB 0.401 19.399 19.000 -0.003 0.000 1.061 1320 A HN 0.029 nan 8.150 nan 0.000 0.503 1321 T N 2.071 116.456 114.554 -0.283 0.000 3.007 1321 T HA -0.004 4.346 4.350 -0.000 0.000 0.270 1321 T C 1.488 176.109 174.700 -0.131 0.000 1.107 1321 T CA 1.924 63.809 62.100 -0.360 0.000 1.118 1321 T CB -0.207 68.523 68.868 -0.230 0.000 0.889 1321 T HN 0.807 nan 8.240 nan 0.000 0.506 1322 G N -0.290 108.455 108.800 -0.091 0.000 3.337 1322 G HA2 0.207 4.166 3.960 -0.000 0.000 0.246 1322 G HA3 0.207 4.166 3.960 -0.000 0.000 0.246 1322 G C 1.089 175.945 174.900 -0.073 0.000 1.131 1322 G CA -0.229 44.834 45.100 -0.060 0.000 0.773 1322 G HN 0.449 nan 8.290 nan 0.000 0.544 1323 E N -0.005 120.163 120.200 -0.053 0.000 2.045 1323 E HA 0.177 4.527 4.350 -0.000 0.000 0.195 1323 E C 0.187 176.802 176.600 0.026 0.000 0.953 1323 E CA -0.095 56.216 56.400 -0.148 0.000 0.859 1323 E CB 0.268 29.919 29.700 -0.082 0.000 0.854 1323 E HN 0.219 nan 8.360 nan 0.000 0.471 1324 I N 2.448 123.166 120.570 0.246 0.000 2.363 1324 I HA 0.038 4.208 4.170 -0.000 0.000 0.292 1324 I C -0.123 176.032 176.117 0.063 0.000 1.075 1324 I CA 0.391 61.881 61.300 0.317 0.000 1.333 1324 I CB 0.426 38.665 38.000 0.399 0.000 1.415 1324 I HN 0.100 nan 8.210 nan 0.000 0.502 1325 Q N 5.880 125.684 119.800 0.007 0.000 2.359 1325 Q HA 0.447 4.787 4.340 -0.000 0.000 0.274 1325 Q C -1.209 174.643 176.000 -0.246 0.000 1.074 1325 Q CA -0.856 54.832 55.803 -0.191 0.000 0.810 1325 Q CB 3.070 31.683 28.738 -0.208 0.000 1.342 1325 Q HN 0.522 nan 8.270 nan 0.000 0.427 1326 E N 1.857 121.845 120.200 -0.353 0.000 2.166 1326 E HA 0.423 4.773 4.350 -0.000 0.000 0.275 1326 E C -1.133 175.321 176.600 -0.243 0.000 0.941 1326 E CA -0.291 55.964 56.400 -0.242 0.000 0.784 1326 E CB 1.320 30.882 29.700 -0.230 0.000 1.115 1326 E HN 0.287 nan 8.360 nan 0.000 0.399 1327 F N 0.641 120.551 119.950 -0.067 0.000 2.483 1327 F HA 0.277 4.804 4.527 -0.000 0.000 0.329 1327 F C 0.939 176.604 175.800 -0.226 0.000 1.064 1327 F CA -0.835 57.116 58.000 -0.082 0.000 0.986 1327 F CB 1.516 40.470 39.000 -0.078 0.000 1.218 1327 F HN 0.254 nan 8.300 nan 0.000 0.484 1328 V N -1.775 118.042 119.914 -0.161 0.000 3.017 1328 V HA 0.237 4.357 4.120 -0.000 0.000 0.354 1328 V C 0.312 176.262 176.094 -0.240 0.000 1.389 1328 V CA -0.443 61.688 62.300 -0.281 0.000 1.163 1328 V CB -0.489 31.001 31.823 -0.555 0.000 1.178 1328 V HN 0.745 nan 8.190 nan 0.000 0.547 1329 N N 1.454 120.056 118.700 -0.162 0.000 2.205 1329 N HA -0.123 4.617 4.740 -0.000 0.000 0.186 1329 N C 0.953 176.130 175.510 -0.555 0.000 1.015 1329 N CA 2.044 54.916 53.050 -0.297 0.000 0.862 1329 N CB -0.413 37.928 38.487 -0.244 0.000 0.986 1329 N HN 0.806 nan 8.380 nan 0.000 0.429 1330 H N -1.527 117.390 119.070 -0.255 0.000 2.549 1330 H HA 0.452 5.008 4.556 -0.000 0.000 0.253 1330 H C -0.762 174.153 175.328 -0.688 0.000 1.170 1330 H CA -0.377 55.420 56.048 -0.419 0.000 0.943 1330 H CB 0.556 30.061 29.762 -0.428 0.000 1.849 1330 H HN -0.032 nan 8.280 nan 0.000 0.603 1331 S N -0.461 114.968 115.700 -0.452 0.000 2.570 1331 S HA 0.140 4.610 4.470 -0.000 0.000 0.286 1331 S C -0.677 173.664 174.600 -0.432 0.000 1.099 1331 S CA -0.939 56.951 58.200 -0.517 0.000 0.913 1331 S CB 1.315 64.437 63.200 -0.130 0.000 1.085 1331 S HN 0.339 nan 8.310 nan 0.000 0.480 1332 W N 2.684 123.657 121.300 -0.546 0.000 1.435 1332 W HA 0.354 5.014 4.660 -0.000 0.000 0.471 1332 W C -0.818 175.231 176.519 -0.783 0.000 0.590 1332 W CA -0.753 56.119 57.345 -0.789 0.000 2.419 1332 W CB -1.530 27.067 29.460 -1.438 0.000 1.251 1332 W HN 0.561 nan 8.180 nan 0.000 0.338 1333 Y N -0.343 119.967 120.300 0.017 0.000 2.605 1333 Y HA 0.371 4.921 4.550 -0.000 0.000 0.343 1333 Y C -0.142 175.741 175.900 -0.028 0.000 1.036 1333 Y CA -1.402 56.726 58.100 0.045 0.000 1.065 1333 Y CB 1.927 40.374 38.460 -0.023 0.000 1.288 1333 Y HN -0.141 nan 8.280 nan 0.000 0.481 1334 E N 0.526 120.858 120.200 0.220 0.000 2.199 1334 E HA 0.403 4.753 4.350 -0.000 0.000 0.265 1334 E C -1.968 174.794 176.600 0.271 0.000 0.882 1334 E CA -0.559 55.927 56.400 0.143 0.000 0.759 1334 E CB 0.785 30.558 29.700 0.121 0.000 1.148 1334 E HN 0.348 nan 8.360 nan 0.000 0.412 1335 Y N 2.219 122.546 120.300 0.044 0.000 2.330 1335 Y HA 0.128 4.677 4.550 -0.000 0.000 0.336 1335 Y C 1.497 177.398 175.900 0.002 0.000 1.036 1335 Y CA -1.269 56.834 58.100 0.005 0.000 1.125 1335 Y CB 1.809 40.251 38.460 -0.029 0.000 1.194 1335 Y HN 0.684 nan 8.280 nan 0.000 0.469 1336 S N 0.280 116.060 115.700 0.134 0.000 2.447 1336 S HA -0.099 4.371 4.470 -0.000 0.000 0.233 1336 S C 1.341 175.969 174.600 0.047 0.000 1.006 1336 S CA 0.963 59.203 58.200 0.067 0.000 0.957 1336 S CB -0.784 62.435 63.200 0.031 0.000 0.773 1336 S HN 0.510 nan 8.310 nan 0.000 0.507 1337 V N -1.671 118.266 119.914 0.040 0.000 3.573 1337 V HA 0.603 4.723 4.120 -0.000 0.000 0.270 1337 V C 0.942 177.069 176.094 0.056 0.000 1.221 1337 V CA -0.103 62.210 62.300 0.022 0.000 1.163 1337 V CB -1.403 30.401 31.823 -0.032 0.000 0.847 1337 V HN 0.909 nan 8.190 nan 0.000 0.468 1338 G N 0.839 109.696 108.800 0.094 0.000 3.055 1338 G HA2 -0.158 3.802 3.960 -0.000 0.000 0.685 1338 G HA3 -0.158 3.802 3.960 -0.000 0.000 0.685 1338 G C -0.292 174.678 174.900 0.117 0.000 1.212 1338 G CA -0.185 44.965 45.100 0.083 0.000 0.822 1338 G HN 0.173 nan 8.290 nan 0.000 0.610 1339 N N 0.606 119.334 118.700 0.045 0.000 2.609 1339 N HA -0.037 4.703 4.740 -0.000 0.000 0.190 1339 N C 1.526 177.020 175.510 -0.027 0.000 1.157 1339 N CA 1.437 54.462 53.050 -0.040 0.000 0.918 1339 N CB 0.120 38.559 38.487 -0.081 0.000 0.978 1339 N HN 0.807 nan 8.380 nan 0.000 0.448 1340 D N -1.210 119.218 120.400 0.046 0.000 2.369 1340 D HA 0.012 4.652 4.640 -0.000 0.000 0.211 1340 D C 0.446 176.866 176.300 0.200 0.000 1.077 1340 D CA 0.060 54.112 54.000 0.087 0.000 0.842 1340 D CB 0.322 41.151 40.800 0.048 0.000 0.947 1340 D HN -0.055 nan 8.370 nan 0.000 0.509 1341 R N 0.397 121.003 120.500 0.177 0.000 2.573 1341 R HA 0.664 5.003 4.340 -0.000 0.000 0.272 1341 R C 0.507 176.763 176.300 -0.074 0.000 1.009 1341 R CA -0.581 55.590 56.100 0.119 0.000 1.059 1341 R CB 1.419 31.755 30.300 0.060 0.000 1.112 1341 R HN 0.080 nan 8.270 nan 0.000 0.517 1342 G N 1.162 109.635 108.800 -0.545 0.000 2.388 1342 G HA2 0.577 4.537 3.960 -0.000 0.000 0.330 1342 G HA3 0.577 4.537 3.960 -0.000 0.000 0.330 1342 G C -0.790 173.772 174.900 -0.564 0.000 1.142 1342 G CA -0.634 43.723 45.100 -1.239 0.000 0.908 1342 G HN 0.279 nan 8.290 nan 0.000 0.473 1343 L N 1.458 122.388 121.223 -0.489 0.000 2.356 1343 L HA 0.298 4.638 4.340 -0.000 0.000 0.277 1343 L C -0.067 176.585 176.870 -0.364 0.000 0.996 1343 L CA -1.126 53.460 54.840 -0.424 0.000 0.822 1343 L CB 2.083 43.756 42.059 -0.643 0.000 1.256 1343 L HN 0.739 nan 8.230 nan 0.000 0.413 1344 H N 5.278 124.139 119.070 -0.348 0.000 2.897 1344 H HA 0.078 4.634 4.556 -0.000 0.000 0.347 1344 H C -1.866 173.167 175.328 -0.492 0.000 1.068 1344 H CA -0.650 55.169 56.048 -0.383 0.000 1.426 1344 H CB 1.232 30.840 29.762 -0.255 0.000 1.410 1344 H HN 0.293 nan 8.280 nan 0.000 0.597 1345 P HA -0.163 nan 4.420 nan 0.000 0.219 1345 P C 0.780 177.718 177.300 -0.604 0.000 1.146 1345 P CA 1.448 63.885 63.100 -1.105 0.000 0.808 1345 P CB -0.056 30.539 31.700 -1.841 0.000 0.779 1346 Y N 0.219 120.280 120.300 -0.399 0.000 2.315 1346 Y HA -0.172 4.378 4.550 -0.000 0.000 0.288 1346 Y C 1.507 177.368 175.900 -0.066 0.000 1.154 1346 Y CA 0.748 58.836 58.100 -0.020 0.000 1.229 1346 Y CB -0.358 38.204 38.460 0.169 0.000 0.980 1346 Y HN 0.116 nan 8.280 nan 0.000 0.540 1347 E N -0.473 119.735 120.200 0.013 0.000 2.624 1347 E HA 0.163 4.513 4.350 -0.000 0.000 0.210 1347 E C 0.863 177.345 176.600 -0.197 0.000 0.997 1347 E CA -0.312 56.044 56.400 -0.074 0.000 0.999 1347 E CB 0.560 30.211 29.700 -0.082 0.000 1.040 1347 E HN 0.261 nan 8.360 nan 0.000 0.469 1348 G N 0.975 109.638 108.800 -0.228 0.000 2.664 1348 G HA2 0.137 4.097 3.960 -0.000 0.000 0.242 1348 G HA3 0.137 4.097 3.960 -0.000 0.000 0.242 1348 G C -0.256 174.515 174.900 -0.215 0.000 1.225 1348 G CA -0.092 44.834 45.100 -0.291 0.000 0.849 1348 G HN 0.030 nan 8.290 nan 0.000 0.581 1349 Q N -1.044 118.624 119.800 -0.220 0.000 2.359 1349 Q HA 0.466 4.806 4.340 -0.000 0.000 0.274 1349 Q C -1.276 174.740 176.000 0.026 0.000 1.074 1349 Q CA -0.564 55.184 55.803 -0.091 0.000 0.810 1349 Q CB 2.602 31.259 28.738 -0.134 0.000 1.342 1349 Q HN 0.456 nan 8.270 nan 0.000 0.427 1350 T N 1.995 116.592 114.554 0.072 0.000 3.226 1350 T HA 0.328 4.678 4.350 -0.000 0.000 0.378 1350 T C -0.835 174.005 174.700 0.234 0.000 1.380 1350 T CA -0.691 61.482 62.100 0.122 0.000 1.396 1350 T CB -0.044 68.866 68.868 0.070 0.000 1.044 1350 T HN 0.343 nan 8.240 nan 0.000 0.586 1351 N N 3.257 122.157 118.700 0.333 0.000 2.469 1351 N HA 0.330 5.070 4.740 -0.000 0.000 0.253 1351 N C -0.328 175.410 175.510 0.380 0.000 0.970 1351 N CA -0.510 52.713 53.050 0.289 0.000 0.940 1351 N CB 1.812 40.428 38.487 0.215 0.000 1.128 1351 N HN 0.477 nan 8.380 nan 0.000 0.503 1352 L N 1.515 122.922 121.223 0.306 0.000 2.410 1352 L HA 0.150 4.490 4.340 -0.000 0.000 0.273 1352 L C 0.629 177.646 176.870 0.244 0.000 1.144 1352 L CA 0.315 55.340 54.840 0.308 0.000 0.863 1352 L CB 0.186 42.366 42.059 0.200 0.000 1.140 1352 L HN 0.446 nan 8.230 nan 0.000 0.463 1353 E N 2.387 122.702 120.200 0.192 0.000 2.923 1353 E HA 0.088 4.438 4.350 -0.000 0.000 0.266 1353 E C -0.243 176.352 176.600 -0.008 0.000 1.157 1353 E CA -0.328 56.132 56.400 0.100 0.000 0.795 1353 E CB 0.388 30.128 29.700 0.067 0.000 1.454 1353 E HN 0.429 nan 8.360 nan 0.000 0.386 1354 Y N 2.923 123.122 120.300 -0.169 0.000 2.130 1354 Y HA -0.097 4.453 4.550 -0.000 0.000 0.287 1354 Y C 1.197 176.839 175.900 -0.428 0.000 1.124 1354 Y CA 1.891 59.651 58.100 -0.566 0.000 1.118 1354 Y CB 0.478 38.673 38.460 -0.441 0.000 0.994 1354 Y HN 0.396 nan 8.280 nan 0.000 0.497 1355 D N -0.133 120.190 120.400 -0.129 0.000 2.097 1355 D HA -0.130 4.510 4.640 -0.000 0.000 0.197 1355 D C 2.106 178.309 176.300 -0.162 0.000 0.984 1355 D CA 1.419 55.327 54.000 -0.153 0.000 0.826 1355 D CB -0.336 40.444 40.800 -0.034 0.000 0.973 1355 D HN 0.318 nan 8.370 nan 0.000 0.460 1356 R N -0.015 120.426 120.500 -0.098 0.000 2.236 1356 R HA 0.114 4.454 4.340 -0.000 0.000 0.208 1356 R C 1.102 177.354 176.300 -0.080 0.000 1.036 1356 R CA 0.353 56.410 56.100 -0.071 0.000 1.001 1356 R CB 0.352 30.632 30.300 -0.033 0.000 0.896 1356 R HN -0.083 nan 8.270 nan 0.000 0.464 1357 R N -0.355 120.086 120.500 -0.099 0.000 2.426 1357 R HA 0.167 4.507 4.340 -0.000 0.000 0.263 1357 R C 0.666 176.938 176.300 -0.048 0.000 0.961 1357 R CA 0.357 56.428 56.100 -0.049 0.000 1.086 1357 R CB 0.579 30.896 30.300 0.028 0.000 1.186 1357 R HN 0.400 nan 8.270 nan 0.000 0.537 1358 G N -0.172 108.527 108.800 -0.168 0.000 2.157 1358 G HA2 -0.237 3.723 3.960 -0.000 0.000 0.239 1358 G HA3 -0.237 3.723 3.960 -0.000 0.000 0.239 1358 G C 0.560 175.243 174.900 -0.362 0.000 0.982 1358 G CA -0.134 44.861 45.100 -0.176 0.000 0.650 1358 G HN 0.552 nan 8.290 nan 0.000 0.527 1359 G N -0.432 107.807 108.800 -0.934 0.000 2.353 1359 G HA2 0.510 4.470 3.960 -0.000 0.000 0.239 1359 G HA3 0.510 4.470 3.960 -0.000 0.000 0.239 1359 G C 0.301 174.547 174.900 -1.090 0.000 1.295 1359 G CA 0.449 44.351 45.100 -1.995 0.000 0.884 1359 G HN 0.987 nan 8.290 nan 0.000 0.537 1360 V N 2.246 121.739 119.914 -0.701 0.000 2.465 1360 V HA 0.492 4.612 4.120 -0.000 0.000 0.279 1360 V C 0.971 177.040 176.094 -0.042 0.000 1.045 1360 V CA -0.563 61.524 62.300 -0.355 0.000 0.938 1360 V CB 1.196 32.726 31.823 -0.488 0.000 0.986 1360 V HN 1.031 nan 8.190 nan 0.000 0.467 1361 A N 7.768 130.620 122.820 0.054 0.000 2.454 1361 A HA 0.550 4.869 4.320 -0.000 0.000 0.260 1361 A C -2.239 175.488 177.584 0.239 0.000 1.106 1361 A CA -0.997 51.132 52.037 0.152 0.000 0.780 1361 A CB -0.286 18.760 19.000 0.077 0.000 1.044 1361 A HN 0.687 nan 8.150 nan 0.000 0.498 1362 P HA 0.263 nan 4.420 nan 0.000 0.269 1362 P C -2.248 175.108 177.300 0.093 0.000 1.215 1362 P CA -0.628 62.596 63.100 0.207 0.000 0.780 1362 P CB -0.115 31.640 31.700 0.091 0.000 0.898 1363 P HA 0.221 nan 4.420 nan 0.000 0.279 1363 P C -1.368 175.979 177.300 0.077 0.000 1.239 1363 P CA -0.134 62.963 63.100 -0.005 0.000 0.789 1363 P CB 0.327 32.011 31.700 -0.027 0.000 0.933 1364 Y N -0.497 119.819 120.300 0.027 0.000 2.609 1364 Y HA 0.636 5.186 4.550 -0.000 0.000 0.342 1364 Y C 0.497 176.415 175.900 0.030 0.000 1.058 1364 Y CA -1.030 57.086 58.100 0.027 0.000 1.055 1364 Y CB 1.317 39.799 38.460 0.037 0.000 1.292 1364 Y HN -0.007 nan 8.280 nan 0.000 0.476 1365 K N -0.273 120.293 120.400 0.277 0.000 2.436 1365 K HA 0.268 4.588 4.320 -0.000 0.000 0.198 1365 K C -0.518 176.212 176.600 0.216 0.000 1.174 1365 K CA 0.346 56.727 56.287 0.157 0.000 0.951 1365 K CB 0.788 33.337 32.500 0.082 0.000 1.040 1365 K HN 0.709 nan 8.250 nan 0.000 0.536 1366 Q N 0.793 120.746 119.800 0.256 0.000 2.315 1366 Q HA 0.399 4.739 4.340 -0.000 0.000 0.273 1366 Q C -0.359 175.664 176.000 0.038 0.000 1.053 1366 Q CA -0.470 55.406 55.803 0.121 0.000 0.817 1366 Q CB 2.590 31.340 28.738 0.019 0.000 1.326 1366 Q HN 0.034 nan 8.270 nan 0.000 0.423 1367 L N 1.110 122.321 121.223 -0.021 0.000 2.476 1367 L HA 0.169 4.509 4.340 -0.000 0.000 0.264 1367 L C 0.498 177.273 176.870 -0.158 0.000 1.224 1367 L CA -0.057 54.704 54.840 -0.132 0.000 0.821 1367 L CB 0.296 42.328 42.059 -0.044 0.000 1.101 1367 L HN 0.537 nan 8.230 nan 0.000 0.488 1368 D N 0.550 120.869 120.400 -0.135 0.000 2.392 1368 D HA 0.171 4.811 4.640 -0.000 0.000 0.228 1368 D C 0.005 176.247 176.300 -0.097 0.000 1.074 1368 D CA -0.273 53.652 54.000 -0.126 0.000 0.838 1368 D CB 1.892 42.632 40.800 -0.101 0.000 1.067 1368 D HN 0.127 nan 8.370 nan 0.000 0.511 1369 V N 3.329 123.113 119.914 -0.216 0.000 3.647 1369 V HA -0.056 4.064 4.120 -0.000 0.000 0.279 1369 V C 2.003 178.090 176.094 -0.012 0.000 1.314 1369 V CA 1.196 63.310 62.300 -0.309 0.000 1.125 1369 V CB -0.111 31.167 31.823 -0.908 0.000 0.907 1369 V HN 0.682 nan 8.190 nan 0.000 0.434 1370 S N -0.892 114.817 115.700 0.014 0.000 2.428 1370 S HA -0.082 4.388 4.470 -0.000 0.000 0.230 1370 S C 1.043 175.749 174.600 0.177 0.000 1.014 1370 S CA 1.287 59.545 58.200 0.097 0.000 0.957 1370 S CB 0.180 63.391 63.200 0.019 0.000 0.784 1370 S HN 0.641 nan 8.310 nan 0.000 0.499 1371 D N 0.672 121.158 120.400 0.143 0.000 3.368 1371 D HA 0.464 5.104 4.640 -0.000 0.000 0.189 1371 D C 0.401 176.721 176.300 0.033 0.000 1.279 1371 D CA 0.176 54.182 54.000 0.011 0.000 1.206 1371 D CB 0.011 40.782 40.800 -0.048 0.000 1.136 1371 D HN 0.245 nan 8.370 nan 0.000 0.490 1372 G N -0.520 108.224 108.800 -0.093 0.000 2.313 1372 G HA2 0.293 4.253 3.960 -0.000 0.000 0.250 1372 G HA3 0.293 4.253 3.960 -0.000 0.000 0.250 1372 G C -0.365 174.308 174.900 -0.378 0.000 1.281 1372 G CA 0.423 45.299 45.100 -0.373 0.000 0.917 1372 G HN 0.530 nan 8.290 nan 0.000 0.501 1373 Y N 0.273 120.092 120.300 -0.802 0.000 2.738 1373 Y HA 0.657 5.206 4.550 -0.000 0.000 0.249 1373 Y C 0.245 175.380 175.900 -1.275 0.000 1.157 1373 Y CA -0.631 57.017 58.100 -0.754 0.000 1.189 1373 Y CB 0.229 38.523 38.460 -0.276 0.000 1.262 1373 Y HN 0.568 nan 8.280 nan 0.000 0.554 1374 S N -0.780 113.662 115.700 -2.098 0.000 2.547 1374 S HA 0.236 4.706 4.470 -0.000 0.000 0.270 1374 S C -1.249 172.730 174.600 -1.034 0.000 1.150 1374 S CA -0.726 56.724 58.200 -1.251 0.000 0.850 1374 S CB 0.246 63.076 63.200 -0.616 0.000 1.118 1374 S HN 0.429 nan 8.310 nan 0.000 0.461 1375 W N 2.539 123.759 121.300 -0.134 0.000 3.256 1375 W HA 0.349 5.009 4.660 -0.000 0.000 0.269 1375 W C 0.386 177.007 176.519 0.170 0.000 1.310 1375 W CA -0.367 57.045 57.345 0.111 0.000 1.673 1375 W CB 0.269 29.867 29.460 0.230 0.000 1.115 1375 W HN 0.254 nan 8.180 nan 0.000 0.686 1376 L N 1.608 122.935 121.223 0.173 0.000 2.326 1376 L HA 0.259 4.599 4.340 -0.000 0.000 0.278 1376 L C 0.654 177.537 176.870 0.021 0.000 1.092 1376 L CA -0.485 54.405 54.840 0.084 0.000 0.810 1376 L CB 0.566 42.606 42.059 -0.033 0.000 1.153 1376 L HN -0.169 nan 8.230 nan 0.000 0.439 1377 K N 1.503 121.872 120.400 -0.052 0.000 2.120 1377 K HA 0.480 4.800 4.320 -0.000 0.000 0.245 1377 K C -0.111 176.398 176.600 -0.151 0.000 1.024 1377 K CA -0.463 55.738 56.287 -0.143 0.000 0.906 1377 K CB 0.790 33.145 32.500 -0.241 0.000 1.051 1377 K HN 0.715 nan 8.250 nan 0.000 0.491 1378 A N 2.999 125.748 122.820 -0.119 0.000 2.394 1378 A HA 0.379 4.699 4.320 -0.000 0.000 0.333 1378 A C -2.481 175.056 177.584 -0.079 0.000 1.397 1378 A CA -1.728 50.252 52.037 -0.095 0.000 0.884 1378 A CB 0.230 19.201 19.000 -0.047 0.000 1.147 1378 A HN 0.307 nan 8.150 nan 0.000 0.505 1379 P HA 0.494 nan 4.420 nan 0.000 0.284 1379 P C -0.644 176.509 177.300 -0.245 0.000 1.253 1379 P CA -0.307 62.453 63.100 -0.566 0.000 0.800 1379 P CB 0.954 31.721 31.700 -1.554 0.000 0.961 1380 R N 1.663 122.216 120.500 0.087 0.000 2.744 1380 R HA 0.374 4.714 4.340 -0.000 0.000 0.279 1380 R C -1.553 175.131 176.300 0.641 0.000 0.977 1380 R CA -0.497 55.865 56.100 0.437 0.000 0.906 1380 R CB 1.814 32.312 30.300 0.330 0.000 1.197 1380 R HN 0.596 nan 8.270 nan 0.000 0.463 1381 W N 3.901 125.495 121.300 0.489 0.000 2.318 1381 W HA 0.276 4.936 4.660 -0.000 0.000 0.315 1381 W C -0.034 176.607 176.519 0.205 0.000 1.033 1381 W CA -0.459 57.103 57.345 0.361 0.000 1.275 1381 W CB 0.704 30.312 29.460 0.247 0.000 1.250 1381 W HN 0.671 nan 8.180 nan 0.000 0.421 1382 K N 4.926 125.098 120.400 -0.380 0.000 3.078 1382 K HA -0.245 4.075 4.320 -0.000 0.000 0.261 1382 K C 1.044 177.605 176.600 -0.067 0.000 0.947 1382 K CA 1.145 57.226 56.287 -0.345 0.000 0.702 1382 K CB -1.473 30.596 32.500 -0.718 0.000 1.318 1382 K HN 1.177 nan 8.250 nan 0.000 0.473 1383 G N -0.343 108.500 108.800 0.072 0.000 2.205 1383 G HA2 -0.361 3.599 3.960 -0.000 0.000 0.261 1383 G HA3 -0.361 3.599 3.960 -0.000 0.000 0.261 1383 G C 0.049 174.994 174.900 0.074 0.000 0.980 1383 G CA 0.587 45.726 45.100 0.065 0.000 0.632 1383 G HN 0.401 nan 8.290 nan 0.000 0.533 1384 R N 0.834 121.432 120.500 0.164 0.000 2.368 1384 R HA 0.558 4.898 4.340 -0.000 0.000 0.302 1384 R C 0.159 176.595 176.300 0.227 0.000 1.002 1384 R CA -0.224 55.982 56.100 0.177 0.000 0.929 1384 R CB 1.114 31.553 30.300 0.231 0.000 1.073 1384 R HN 0.180 nan 8.270 nan 0.000 0.464 1385 S N 1.744 117.524 115.700 0.133 0.000 2.549 1385 S HA 0.222 4.692 4.470 -0.000 0.000 0.283 1385 S C 0.043 174.707 174.600 0.106 0.000 1.320 1385 S CA -0.667 57.618 58.200 0.142 0.000 1.058 1385 S CB 0.792 64.025 63.200 0.055 0.000 0.882 1385 S HN 0.431 nan 8.310 nan 0.000 0.498 1386 V N 1.084 121.076 119.914 0.129 0.000 3.102 1386 V HA 0.738 4.858 4.120 -0.000 0.000 0.312 1386 V C -0.674 175.381 176.094 -0.065 0.000 1.135 1386 V CA -1.135 61.124 62.300 -0.068 0.000 1.022 1386 V CB 1.938 33.656 31.823 -0.176 0.000 1.056 1386 V HN 0.839 nan 8.190 nan 0.000 0.436 1387 E N 1.329 121.404 120.200 -0.208 0.000 2.191 1387 E HA 0.725 5.075 4.350 -0.000 0.000 0.274 1387 E C -0.809 175.780 176.600 -0.019 0.000 0.948 1387 E CA -0.765 55.627 56.400 -0.013 0.000 0.802 1387 E CB 2.145 31.862 29.700 0.029 0.000 1.137 1387 E HN 1.141 nan 8.360 nan 0.000 0.397 1388 V N 0.651 120.590 119.914 0.042 0.000 3.113 1388 V HA 1.007 5.127 4.120 -0.000 0.000 0.316 1388 V C 0.444 176.569 176.094 0.051 0.000 1.125 1388 V CA 0.178 62.439 62.300 -0.065 0.000 1.026 1388 V CB 0.861 32.535 31.823 -0.248 0.000 1.080 1388 V HN 1.072 nan 8.190 nan 0.000 0.444 1389 G N 1.494 110.278 108.800 -0.027 0.000 2.352 1389 G HA2 0.020 3.980 3.960 -0.000 0.000 0.324 1389 G HA3 0.020 3.980 3.960 -0.000 0.000 0.324 1389 G C -2.602 172.266 174.900 -0.053 0.000 1.249 1389 G CA -0.004 45.090 45.100 -0.010 0.000 1.053 1389 G HN 0.628 nan 8.290 nan 0.000 0.492 1390 P HA -0.002 nan 4.420 nan 0.000 0.216 1390 P C 2.214 179.443 177.300 -0.119 0.000 1.150 1390 P CA 1.375 64.431 63.100 -0.074 0.000 0.837 1390 P CB 0.088 31.735 31.700 -0.089 0.000 0.786 1391 L N -0.452 120.704 121.223 -0.110 0.000 2.093 1391 L HA -0.011 4.329 4.340 -0.000 0.000 0.208 1391 L C 2.179 178.889 176.870 -0.267 0.000 1.085 1391 L CA 1.799 56.525 54.840 -0.190 0.000 0.755 1391 L CB -1.584 40.388 42.059 -0.145 0.000 0.904 1391 L HN -0.134 nan 8.230 nan 0.000 0.435 1392 A N -0.245 122.519 122.820 -0.094 0.000 1.883 1392 A HA -0.231 4.089 4.320 -0.000 0.000 0.217 1392 A C 2.449 179.946 177.584 -0.145 0.000 1.186 1392 A CA 1.938 53.935 52.037 -0.067 0.000 0.624 1392 A CB -0.525 18.517 19.000 0.070 0.000 0.822 1392 A HN 0.499 nan 8.150 nan 0.000 0.444 1393 R N -0.864 119.530 120.500 -0.177 0.000 2.066 1393 R HA -0.046 4.294 4.340 -0.000 0.000 0.232 1393 R C 2.063 178.289 176.300 -0.124 0.000 1.131 1393 R CA 1.378 57.350 56.100 -0.213 0.000 0.955 1393 R CB -0.575 29.430 30.300 -0.492 0.000 0.851 1393 R HN 0.389 nan 8.270 nan 0.000 0.432 1394 V N 1.740 121.572 119.914 -0.138 0.000 2.407 1394 V HA -0.221 3.899 4.120 -0.000 0.000 0.248 1394 V C 2.304 178.338 176.094 -0.101 0.000 1.055 1394 V CA 1.594 63.836 62.300 -0.098 0.000 1.049 1394 V CB -0.420 31.329 31.823 -0.124 0.000 0.662 1394 V HN 0.282 nan 8.190 nan 0.000 0.455 1395 L N -1.444 119.653 121.223 -0.209 0.000 2.093 1395 L HA -0.202 4.138 4.340 -0.000 0.000 0.208 1395 L C 2.459 179.306 176.870 -0.039 0.000 1.085 1395 L CA 1.540 56.255 54.840 -0.209 0.000 0.755 1395 L CB -0.450 41.353 42.059 -0.427 0.000 0.904 1395 L HN 0.338 nan 8.230 nan 0.000 0.435 1396 M N -0.333 119.246 119.600 -0.034 0.000 2.156 1396 M HA -0.130 4.350 4.480 -0.000 0.000 0.264 1396 M C 2.081 178.425 176.300 0.074 0.000 1.067 1396 M CA 1.739 57.058 55.300 0.031 0.000 1.131 1396 M CB -0.246 32.371 32.600 0.029 0.000 1.368 1396 M HN 0.051 nan 8.290 nan 0.000 0.416 1397 L N -1.874 119.391 121.223 0.071 0.000 2.042 1397 L HA -0.249 4.091 4.340 -0.000 0.000 0.210 1397 L C 2.355 179.292 176.870 0.112 0.000 1.076 1397 L CA 1.515 56.403 54.840 0.080 0.000 0.749 1397 L CB -0.925 41.119 42.059 -0.024 0.000 0.893 1397 L HN 0.306 nan 8.230 nan 0.000 0.432 1398 Y N 0.389 120.682 120.300 -0.012 0.000 2.163 1398 Y HA -0.231 4.319 4.550 -0.000 0.000 0.288 1398 Y C 2.482 178.387 175.900 0.009 0.000 1.136 1398 Y CA 1.326 59.422 58.100 -0.007 0.000 1.147 1398 Y CB -0.198 38.230 38.460 -0.054 0.000 0.987 1398 Y HN 0.101 nan 8.280 nan 0.000 0.509 1399 A N -1.002 121.941 122.820 0.206 0.000 2.015 1399 A HA -0.139 4.181 4.320 -0.000 0.000 0.219 1399 A C 1.992 179.611 177.584 0.059 0.000 1.163 1399 A CA 1.917 54.032 52.037 0.129 0.000 0.646 1399 A CB -1.195 17.875 19.000 0.116 0.000 0.806 1399 A HN 0.547 nan 8.150 nan 0.000 0.448 1400 T N -4.586 110.003 114.554 0.059 0.000 3.122 1400 T HA 0.424 4.774 4.350 -0.000 0.000 0.250 1400 T C 1.186 175.904 174.700 0.029 0.000 1.067 1400 T CA 0.896 63.026 62.100 0.050 0.000 0.966 1400 T CB 0.070 68.984 68.868 0.078 0.000 1.002 1400 T HN 1.620 nan 8.240 nan 0.000 0.542 1401 G N 1.627 110.421 108.800 -0.009 0.000 2.160 1401 G HA2 -0.283 3.677 3.960 -0.000 0.000 0.244 1401 G HA3 -0.283 3.677 3.960 -0.000 0.000 0.244 1401 G C -0.129 174.761 174.900 -0.017 0.000 1.022 1401 G CA 0.079 45.146 45.100 -0.055 0.000 0.741 1401 G HN 0.969 nan 8.290 nan 0.000 0.508 1402 H N 0.697 119.729 119.070 -0.062 0.000 3.091 1402 H HA 0.322 4.878 4.556 -0.000 0.000 0.289 1402 H C 1.471 176.757 175.328 -0.071 0.000 0.995 1402 H CA 0.514 56.536 56.048 -0.044 0.000 1.461 1402 H CB 0.559 30.318 29.762 -0.005 0.000 1.510 1402 H HN 0.170 nan 8.280 nan 0.000 0.546 1403 D N 3.418 123.682 120.400 -0.227 0.000 2.097 1403 D HA -0.215 4.424 4.640 -0.000 0.000 0.195 1403 D C 1.828 178.112 176.300 -0.025 0.000 0.989 1403 D CA 1.272 55.197 54.000 -0.126 0.000 0.827 1403 D CB -0.086 40.622 40.800 -0.154 0.000 0.966 1403 D HN 0.769 nan 8.370 nan 0.000 0.456 1404 Q N 0.142 119.949 119.800 0.012 0.000 2.084 1404 Q HA -0.118 4.222 4.340 -0.000 0.000 0.202 1404 Q C 2.046 178.160 176.000 0.190 0.000 0.978 1404 Q CA 1.442 57.317 55.803 0.121 0.000 0.844 1404 Q CB -0.037 28.796 28.738 0.157 0.000 0.898 1404 Q HN 0.203 nan 8.270 nan 0.000 0.426 1405 A N 1.106 124.147 122.820 0.367 0.000 1.902 1405 A HA -0.198 4.122 4.320 -0.000 0.000 0.217 1405 A C 2.068 179.731 177.584 0.132 0.000 1.181 1405 A CA 1.414 53.533 52.037 0.136 0.000 0.623 1405 A CB -0.482 18.536 19.000 0.030 0.000 0.818 1405 A HN 0.331 nan 8.150 nan 0.000 0.443 1406 R N -0.341 120.196 120.500 0.062 0.000 2.073 1406 R HA -0.148 4.192 4.340 -0.000 0.000 0.234 1406 R C 2.130 178.457 176.300 0.045 0.000 1.134 1406 R CA 1.635 57.709 56.100 -0.043 0.000 0.952 1406 R CB -0.439 29.689 30.300 -0.287 0.000 0.850 1406 R HN 0.716 nan 8.270 nan 0.000 0.433 1407 E N 0.523 120.734 120.200 0.018 0.000 2.070 1407 E HA -0.223 4.127 4.350 -0.000 0.000 0.197 1407 E C 1.938 178.553 176.600 0.025 0.000 1.004 1407 E CA 1.101 57.510 56.400 0.015 0.000 0.805 1407 E CB -0.100 29.599 29.700 -0.001 0.000 0.744 1407 E HN 0.081 nan 8.360 nan 0.000 0.451 1408 L N 0.399 121.640 121.223 0.030 0.000 2.027 1408 L HA -0.134 4.206 4.340 -0.000 0.000 0.206 1408 L C 2.368 179.240 176.870 0.003 0.000 1.074 1408 L CA 1.254 56.096 54.840 0.003 0.000 0.745 1408 L CB -0.927 41.131 42.059 -0.002 0.000 0.898 1408 L HN 0.059 nan 8.230 nan 0.000 0.433 1409 V N -0.204 119.742 119.914 0.053 0.000 2.270 1409 V HA -0.259 3.861 4.120 -0.000 0.000 0.245 1409 V C 2.240 178.353 176.094 0.032 0.000 1.043 1409 V CA 1.719 64.037 62.300 0.030 0.000 1.014 1409 V CB -0.488 31.391 31.823 0.094 0.000 0.645 1409 V HN 0.372 nan 8.190 nan 0.000 0.447 1410 D N -0.208 120.257 120.400 0.109 0.000 2.117 1410 D HA -0.136 4.503 4.640 -0.000 0.000 0.197 1410 D C 2.443 178.751 176.300 0.015 0.000 0.987 1410 D CA 1.578 55.621 54.000 0.071 0.000 0.829 1410 D CB -0.343 40.512 40.800 0.091 0.000 0.961 1410 D HN 0.313 nan 8.370 nan 0.000 0.460 1411 S N -0.211 115.490 115.700 0.003 0.000 2.359 1411 S HA -0.168 4.302 4.470 -0.000 0.000 0.223 1411 S C 2.087 176.666 174.600 -0.036 0.000 1.039 1411 S CA 1.714 59.903 58.200 -0.019 0.000 1.042 1411 S CB -0.368 62.815 63.200 -0.028 0.000 0.915 1411 S HN 0.310 nan 8.310 nan 0.000 0.439 1412 T N 2.360 116.885 114.554 -0.047 0.000 2.737 1412 T HA 0.046 4.396 4.350 -0.000 0.000 0.265 1412 T C 1.754 176.415 174.700 -0.065 0.000 1.038 1412 T CA 1.032 63.091 62.100 -0.070 0.000 1.144 1412 T CB -0.323 68.490 68.868 -0.091 0.000 0.866 1412 T HN 0.253 nan 8.240 nan 0.000 0.434 1413 L N 1.316 122.503 121.223 -0.059 0.000 2.093 1413 L HA -0.059 4.281 4.340 -0.000 0.000 0.208 1413 L C 2.874 179.719 176.870 -0.042 0.000 1.085 1413 L CA 1.346 56.152 54.840 -0.057 0.000 0.755 1413 L CB -0.579 41.443 42.059 -0.061 0.000 0.904 1413 L HN 0.364 nan 8.230 nan 0.000 0.435 1414 S N -0.318 115.363 115.700 -0.032 0.000 2.414 1414 S HA -0.173 4.296 4.470 -0.000 0.000 0.227 1414 S C 2.165 176.743 174.600 -0.036 0.000 1.022 1414 S CA 0.399 58.583 58.200 -0.028 0.000 0.958 1414 S CB -0.279 62.910 63.200 -0.018 0.000 0.797 1414 S HN 0.327 nan 8.310 nan 0.000 0.493 1415 R N 0.734 121.209 120.500 -0.042 0.000 2.096 1415 R HA 0.095 4.435 4.340 -0.000 0.000 0.235 1415 R C 1.779 178.045 176.300 -0.056 0.000 1.127 1415 R CA 1.412 57.484 56.100 -0.048 0.000 0.968 1415 R CB -0.377 29.891 30.300 -0.053 0.000 0.861 1415 R HN 0.503 nan 8.270 nan 0.000 0.440 1416 L N 0.431 121.620 121.223 -0.057 0.000 2.591 1416 L HA 0.035 4.375 4.340 -0.000 0.000 0.228 1416 L C 0.084 176.922 176.870 -0.053 0.000 1.133 1416 L CA 0.134 54.938 54.840 -0.060 0.000 0.880 1416 L CB -0.129 41.895 42.059 -0.058 0.000 1.033 1416 L HN 0.200 nan 8.230 nan 0.000 0.450 1417 D N 1.035 121.407 120.400 -0.045 0.000 2.697 1417 D HA -0.212 4.428 4.640 -0.000 0.000 0.238 1417 D C -0.619 175.661 176.300 -0.032 0.000 1.152 1417 D CA 0.717 54.695 54.000 -0.037 0.000 0.666 1417 D CB -0.862 39.914 40.800 -0.040 0.000 1.037 1417 D HN 0.165 nan 8.370 nan 0.000 0.423 1418 L N -0.030 121.173 121.223 -0.032 0.000 2.341 1418 L HA 0.719 5.059 4.340 -0.000 0.000 0.267 1418 L C -1.703 175.151 176.870 -0.026 0.000 1.009 1418 L CA -1.870 52.953 54.840 -0.027 0.000 0.819 1418 L CB 1.959 44.000 42.059 -0.031 0.000 1.323 1418 L HN -0.057 nan 8.230 nan 0.000 0.425 1419 P HA 0.182 nan 4.420 nan 0.000 0.284 1419 P C 0.678 177.962 177.300 -0.026 0.000 1.292 1419 P CA -0.520 62.572 63.100 -0.013 0.000 0.800 1419 P CB 1.304 33.006 31.700 0.003 0.000 1.188 1420 V N 0.569 120.468 119.914 -0.025 0.000 2.407 1420 V HA -0.246 3.873 4.120 -0.000 0.000 0.248 1420 V C 1.948 178.039 176.094 -0.006 0.000 1.055 1420 V CA 2.604 64.865 62.300 -0.065 0.000 1.049 1420 V CB -1.827 29.963 31.823 -0.055 0.000 0.662 1420 V HN 0.666 nan 8.190 nan 0.000 0.455 1421 D N 1.094 121.545 120.400 0.085 0.000 2.371 1421 D HA 0.021 4.661 4.640 -0.000 0.000 0.221 1421 D C 1.714 178.120 176.300 0.176 0.000 0.986 1421 D CA 0.957 55.091 54.000 0.223 0.000 0.899 1421 D CB -0.142 40.746 40.800 0.147 0.000 0.902 1421 D HN 0.388 nan 8.370 nan 0.000 0.530 1422 A N 0.293 123.142 122.820 0.049 0.000 2.168 1422 A HA 0.082 4.402 4.320 -0.000 0.000 0.215 1422 A C 2.084 179.642 177.584 -0.043 0.000 1.152 1422 A CA 0.283 52.333 52.037 0.021 0.000 0.716 1422 A CB -0.707 18.291 19.000 -0.004 0.000 0.794 1422 A HN 0.345 nan 8.150 nan 0.000 0.465 1423 L N -1.698 119.425 121.223 -0.167 0.000 2.131 1423 L HA -0.157 4.183 4.340 -0.000 0.000 0.210 1423 L C 0.417 177.087 176.870 -0.334 0.000 1.092 1423 L CA 0.692 55.319 54.840 -0.355 0.000 0.759 1423 L CB -0.481 41.192 42.059 -0.644 0.000 0.903 1423 L HN 0.486 nan 8.230 nan 0.000 0.435 1424 Y N 0.777 121.056 120.300 -0.034 0.000 2.570 1424 Y HA 0.217 4.767 4.550 -0.000 0.000 0.336 1424 Y C 0.568 176.511 175.900 0.071 0.000 1.284 1424 Y CA -0.339 57.788 58.100 0.045 0.000 1.761 1424 Y CB -0.149 38.364 38.460 0.088 0.000 1.724 1424 Y HN 0.080 nan 8.280 nan 0.000 0.455 1425 S N -1.823 113.966 115.700 0.148 0.000 2.645 1425 S HA 0.157 4.627 4.470 -0.000 0.000 0.268 1425 S C 0.434 175.111 174.600 0.128 0.000 1.110 1425 S CA -0.719 57.572 58.200 0.152 0.000 0.823 1425 S CB 0.858 64.135 63.200 0.128 0.000 1.091 1425 S HN 0.198 nan 8.310 nan 0.000 0.466 1426 T N 1.398 116.086 114.554 0.223 0.000 2.699 1426 T HA -0.088 4.262 4.350 -0.000 0.000 0.268 1426 T C 1.678 176.519 174.700 0.235 0.000 1.036 1426 T CA 1.700 63.967 62.100 0.279 0.000 1.147 1426 T CB -0.538 68.674 68.868 0.574 0.000 0.862 1426 T HN 0.498 nan 8.240 nan 0.000 0.446 1427 L N 0.463 121.825 121.223 0.231 0.000 2.017 1427 L HA -0.048 4.292 4.340 -0.000 0.000 0.208 1427 L C 2.805 179.676 176.870 0.003 0.000 1.073 1427 L CA 1.881 56.779 54.840 0.097 0.000 0.745 1427 L CB -1.051 41.077 42.059 0.114 0.000 0.894 1427 L HN 0.412 nan 8.230 nan 0.000 0.432 1428 G N -0.705 108.087 108.800 -0.012 0.000 2.418 1428 G HA2 -0.301 3.659 3.960 -0.000 0.000 0.217 1428 G HA3 -0.301 3.659 3.960 -0.000 0.000 0.217 1428 G C 1.708 176.540 174.900 -0.114 0.000 1.158 1428 G CA 0.698 45.740 45.100 -0.095 0.000 0.771 1428 G HN 0.322 nan 8.290 nan 0.000 0.545 1429 R N -0.156 120.292 120.500 -0.086 0.000 2.081 1429 R HA -0.080 4.260 4.340 -0.000 0.000 0.235 1429 R C 2.539 178.797 176.300 -0.070 0.000 1.131 1429 R CA 1.900 57.930 56.100 -0.117 0.000 0.960 1429 R CB -0.481 29.705 30.300 -0.191 0.000 0.856 1429 R HN 0.321 nan 8.270 nan 0.000 0.436 1430 T N 0.359 114.919 114.554 0.010 0.000 2.821 1430 T HA -0.047 4.303 4.350 -0.000 0.000 0.267 1430 T C 1.762 176.439 174.700 -0.039 0.000 1.046 1430 T CA 1.204 63.355 62.100 0.084 0.000 1.139 1430 T CB -0.169 68.781 68.868 0.137 0.000 0.871 1430 T HN 0.445 nan 8.240 nan 0.000 0.454 1431 A N 1.501 124.257 122.820 -0.105 0.000 1.898 1431 A HA 0.256 4.576 4.320 -0.000 0.000 0.216 1431 A C 2.669 180.150 177.584 -0.171 0.000 1.181 1431 A CA 1.629 53.564 52.037 -0.169 0.000 0.620 1431 A CB -1.133 17.773 19.000 -0.157 0.000 0.819 1431 A HN 0.479 nan 8.150 nan 0.000 0.442 1432 A N -0.004 122.727 122.820 -0.148 0.000 1.917 1432 A HA -0.240 4.080 4.320 -0.000 0.000 0.219 1432 A C 2.250 179.765 177.584 -0.116 0.000 1.182 1432 A CA 2.004 53.957 52.037 -0.140 0.000 0.633 1432 A CB -0.562 18.345 19.000 -0.156 0.000 0.819 1432 A HN 0.583 nan 8.150 nan 0.000 0.448 1433 R N -0.460 119.958 120.500 -0.137 0.000 2.091 1433 R HA -0.122 4.218 4.340 -0.000 0.000 0.238 1433 R C 2.273 178.513 176.300 -0.100 0.000 1.136 1433 R CA 1.601 57.579 56.100 -0.204 0.000 0.959 1433 R CB -0.419 29.716 30.300 -0.276 0.000 0.856 1433 R HN 0.448 nan 8.270 nan 0.000 0.437 1434 A N 0.996 123.687 122.820 -0.214 0.000 1.898 1434 A HA -0.076 4.244 4.320 -0.000 0.000 0.216 1434 A C 2.214 179.610 177.584 -0.314 0.000 1.181 1434 A CA 1.087 52.791 52.037 -0.555 0.000 0.620 1434 A CB -0.480 17.965 19.000 -0.926 0.000 0.819 1434 A HN 0.335 nan 8.150 nan 0.000 0.442 1435 L N -0.052 121.048 121.223 -0.205 0.000 2.046 1435 L HA -0.226 4.114 4.340 -0.000 0.000 0.208 1435 L C 2.709 179.566 176.870 -0.020 0.000 1.077 1435 L CA 1.907 56.675 54.840 -0.120 0.000 0.747 1435 L CB -0.805 41.194 42.059 -0.100 0.000 0.896 1435 L HN 0.740 nan 8.230 nan 0.000 0.432 1436 E N -0.143 120.085 120.200 0.046 0.000 2.204 1436 E HA -0.148 4.201 4.350 -0.000 0.000 0.194 1436 E C 1.986 178.725 176.600 0.230 0.000 0.989 1436 E CA 1.306 57.804 56.400 0.165 0.000 0.824 1436 E CB -0.163 29.681 29.700 0.240 0.000 0.756 1436 E HN 0.303 nan 8.360 nan 0.000 0.477 1437 S N 0.978 116.834 115.700 0.259 0.000 2.382 1437 S HA -0.153 4.317 4.470 -0.000 0.000 0.228 1437 S C 1.749 176.436 174.600 0.145 0.000 1.027 1437 S CA 1.440 59.819 58.200 0.297 0.000 0.991 1437 S CB -0.191 63.263 63.200 0.424 0.000 0.823 1437 S HN 0.170 nan 8.310 nan 0.000 0.469 1438 K N 2.067 122.494 120.400 0.045 0.000 2.026 1438 K HA 0.044 4.364 4.320 -0.000 0.000 0.208 1438 K C 1.718 178.323 176.600 0.009 0.000 1.048 1438 K CA 1.388 57.677 56.287 0.002 0.000 0.929 1438 K CB -0.797 31.673 32.500 -0.051 0.000 0.713 1438 K HN 0.369 nan 8.250 nan 0.000 0.439 1439 I N 0.281 120.862 120.570 0.018 0.000 2.226 1439 I HA -0.280 3.890 4.170 -0.000 0.000 0.245 1439 I C 2.209 178.293 176.117 -0.055 0.000 1.100 1439 I CA 1.099 62.394 61.300 -0.009 0.000 1.374 1439 I CB -0.179 37.813 38.000 -0.014 0.000 1.057 1439 I HN 0.126 nan 8.210 nan 0.000 0.413 1440 L N -0.412 120.803 121.223 -0.013 0.000 2.056 1440 L HA -0.173 4.167 4.340 -0.000 0.000 0.207 1440 L C 2.561 179.401 176.870 -0.050 0.000 1.078 1440 L CA 0.844 55.656 54.840 -0.048 0.000 0.749 1440 L CB -0.392 41.675 42.059 0.013 0.000 0.901 1440 L HN 0.083 nan 8.230 nan 0.000 0.433 1441 V N -0.064 119.857 119.914 0.013 0.000 2.490 1441 V HA -0.276 3.844 4.120 -0.000 0.000 0.250 1441 V C 1.819 177.885 176.094 -0.046 0.000 1.061 1441 V CA 1.961 64.272 62.300 0.019 0.000 1.064 1441 V CB -0.291 31.579 31.823 0.078 0.000 0.670 1441 V HN 0.456 nan 8.190 nan 0.000 0.461 1442 D N 0.278 120.634 120.400 -0.074 0.000 2.224 1442 D HA -0.014 4.626 4.640 -0.000 0.000 0.205 1442 D C 2.057 178.227 176.300 -0.217 0.000 0.965 1442 D CA 1.348 55.283 54.000 -0.108 0.000 0.852 1442 D CB -0.164 40.586 40.800 -0.083 0.000 0.947 1442 D HN 0.529 nan 8.370 nan 0.000 0.494 1443 A N 0.254 122.866 122.820 -0.347 0.000 2.119 1443 A HA -0.030 4.290 4.320 -0.000 0.000 0.216 1443 A C 2.036 179.060 177.584 -0.933 0.000 1.152 1443 A CA 0.516 52.124 52.037 -0.715 0.000 0.708 1443 A CB -0.238 18.208 19.000 -0.922 0.000 0.805 1443 A HN 0.049 nan 8.150 nan 0.000 0.460 1444 M N -0.936 118.390 119.600 -0.456 0.000 2.117 1444 M HA -0.163 4.317 4.480 -0.000 0.000 0.262 1444 M C 2.247 178.526 176.300 -0.034 0.000 1.065 1444 M CA 1.786 57.008 55.300 -0.131 0.000 1.114 1444 M CB -1.058 31.564 32.600 0.035 0.000 1.361 1444 M HN 0.560 nan 8.290 nan 0.000 0.408 1445 Q N 0.039 119.794 119.800 -0.075 0.000 2.170 1445 Q HA -0.062 4.278 4.340 -0.000 0.000 0.203 1445 Q C 1.914 177.937 176.000 0.038 0.000 0.976 1445 Q CA 2.012 57.833 55.803 0.031 0.000 0.858 1445 Q CB -0.677 28.060 28.738 -0.002 0.000 0.907 1445 Q HN 0.543 nan 8.270 nan 0.000 0.433 1446 G N -0.745 107.961 108.800 -0.157 0.000 2.402 1446 G HA2 -0.210 3.749 3.960 -0.000 0.000 0.216 1446 G HA3 -0.210 3.749 3.960 -0.000 0.000 0.216 1446 G C 0.842 175.728 174.900 -0.024 0.000 1.162 1446 G CA 0.673 45.678 45.100 -0.157 0.000 0.777 1446 G HN 0.360 nan 8.290 nan 0.000 0.539 1447 W N -0.147 121.204 121.300 0.085 0.000 2.381 1447 W HA 0.012 4.672 4.660 -0.000 0.000 0.301 1447 W C 2.177 178.768 176.519 0.120 0.000 1.205 1447 W CA 0.506 57.899 57.345 0.080 0.000 1.285 1447 W CB -1.337 28.166 29.460 0.071 0.000 1.133 1447 W HN 0.344 nan 8.180 nan 0.000 0.521 1448 Y N 2.102 122.567 120.300 0.274 0.000 2.163 1448 Y HA -0.225 4.325 4.550 -0.000 0.000 0.288 1448 Y C 2.039 178.028 175.900 0.149 0.000 1.136 1448 Y CA 2.239 60.474 58.100 0.225 0.000 1.147 1448 Y CB -0.566 38.026 38.460 0.220 0.000 0.987 1448 Y HN -0.231 nan 8.280 nan 0.000 0.509 1449 D N -0.328 120.177 120.400 0.175 0.000 2.144 1449 D HA -0.131 4.509 4.640 -0.000 0.000 0.199 1449 D C 2.336 178.636 176.300 -0.000 0.000 0.984 1449 D CA 1.456 55.489 54.000 0.055 0.000 0.834 1449 D CB -0.843 40.015 40.800 0.097 0.000 0.955 1449 D HN 0.545 nan 8.370 nan 0.000 0.465 1450 G N 0.859 109.691 108.800 0.053 0.000 2.422 1450 G HA2 -0.203 3.757 3.960 -0.000 0.000 0.218 1450 G HA3 -0.203 3.757 3.960 -0.000 0.000 0.218 1450 G C 1.616 176.521 174.900 0.008 0.000 1.146 1450 G CA 0.516 45.646 45.100 0.050 0.000 0.769 1450 G HN 0.242 nan 8.290 nan 0.000 0.547 1451 L N 0.707 121.919 121.223 -0.019 0.000 2.005 1451 L HA 0.036 4.376 4.340 -0.000 0.000 0.207 1451 L C 2.572 179.375 176.870 -0.111 0.000 1.072 1451 L CA 1.319 56.124 54.840 -0.059 0.000 0.744 1451 L CB -0.366 41.656 42.059 -0.062 0.000 0.895 1451 L HN 0.069 nan 8.230 nan 0.000 0.433 1452 I N 0.449 120.887 120.570 -0.220 0.000 2.163 1452 I HA -0.277 3.893 4.170 -0.000 0.000 0.243 1452 I C 2.746 178.813 176.117 -0.083 0.000 1.085 1452 I CA 1.579 62.768 61.300 -0.186 0.000 1.347 1452 I CB -2.078 35.771 38.000 -0.252 0.000 1.044 1452 I HN 0.386 nan 8.210 nan 0.000 0.408 1453 A N 0.634 123.420 122.820 -0.057 0.000 1.908 1453 A HA -0.262 4.057 4.320 -0.000 0.000 0.218 1453 A C 2.266 179.839 177.584 -0.018 0.000 1.181 1453 A CA 2.096 54.118 52.037 -0.024 0.000 0.627 1453 A CB -1.036 17.959 19.000 -0.007 0.000 0.818 1453 A HN 0.567 nan 8.150 nan 0.000 0.445 1454 N N -0.132 118.557 118.700 -0.018 0.000 2.142 1454 N HA -0.124 4.616 4.740 -0.000 0.000 0.186 1454 N C 1.716 177.218 175.510 -0.014 0.000 1.023 1454 N CA 1.554 54.598 53.050 -0.011 0.000 0.852 1454 N CB -0.067 38.416 38.487 -0.006 0.000 0.998 1454 N HN 0.234 nan 8.380 nan 0.000 0.424 1455 V N 1.749 121.650 119.914 -0.022 0.000 2.332 1455 V HA -0.232 3.888 4.120 -0.000 0.000 0.248 1455 V C 2.464 178.549 176.094 -0.015 0.000 1.055 1455 V CA 1.741 64.030 62.300 -0.018 0.000 1.038 1455 V CB -0.535 31.273 31.823 -0.025 0.000 0.651 1455 V HN 0.390 nan 8.190 nan 0.000 0.450 1456 K N 0.805 121.194 120.400 -0.018 0.000 2.148 1456 K HA -0.148 4.172 4.320 -0.000 0.000 0.204 1456 K C 2.087 178.683 176.600 -0.007 0.000 1.050 1456 K CA 1.553 57.833 56.287 -0.012 0.000 0.942 1456 K CB -0.194 32.299 32.500 -0.013 0.000 0.724 1456 K HN 0.615 nan 8.250 nan 0.000 0.446 1457 S N -1.193 114.503 115.700 -0.007 0.000 2.607 1457 S HA 0.132 4.601 4.470 -0.000 0.000 0.224 1457 S C 1.223 175.821 174.600 -0.003 0.000 0.969 1457 S CA 0.397 58.595 58.200 -0.003 0.000 0.927 1457 S CB 0.258 63.457 63.200 -0.002 0.000 0.772 1457 S HN 0.551 nan 8.310 nan 0.000 0.533 1458 G N 0.807 109.605 108.800 -0.004 0.000 2.184 1458 G HA2 -0.189 3.771 3.960 -0.000 0.000 0.206 1458 G HA3 -0.189 3.771 3.960 -0.000 0.000 0.206 1458 G C -0.382 174.517 174.900 -0.002 0.000 0.995 1458 G CA -0.084 45.015 45.100 -0.002 0.000 0.651 1458 G HN 0.623 nan 8.290 nan 0.000 0.511 1459 D N 1.407 121.805 120.400 -0.002 0.000 2.380 1459 D HA 0.541 5.181 4.640 -0.000 0.000 0.230 1459 D C 1.485 177.784 176.300 -0.001 0.000 1.154 1459 D CA 0.514 54.513 54.000 -0.001 0.000 0.859 1459 D CB 0.776 41.576 40.800 -0.001 0.000 1.045 1459 D HN 0.272 nan 8.370 nan 0.000 0.495 1460 T N 0.477 115.032 114.554 0.002 0.000 3.084 1460 T HA 0.175 4.525 4.350 -0.000 0.000 0.270 1460 T C 0.797 175.503 174.700 0.010 0.000 1.008 1460 T CA -0.597 61.506 62.100 0.004 0.000 0.900 1460 T CB -0.089 68.780 68.868 0.003 0.000 1.084 1460 T HN 0.226 nan 8.240 nan 0.000 0.538 1461 K N 2.389 122.795 120.400 0.011 0.000 2.451 1461 K HA 0.178 4.498 4.320 -0.000 0.000 0.280 1461 K C 0.753 177.369 176.600 0.027 0.000 1.020 1461 K CA 0.694 56.992 56.287 0.020 0.000 1.008 1461 K CB 0.409 32.915 32.500 0.010 0.000 0.917 1461 K HN 0.356 nan 8.250 nan 0.000 0.478 1462 T N 1.093 115.679 114.554 0.054 0.000 3.058 1462 T HA 0.191 4.541 4.350 -0.000 0.000 0.278 1462 T C -0.249 174.537 174.700 0.144 0.000 0.974 1462 T CA -0.425 61.714 62.100 0.065 0.000 0.893 1462 T CB -0.112 68.784 68.868 0.047 0.000 1.138 1462 T HN 0.443 nan 8.240 nan 0.000 0.529 1463 F N 2.017 121.939 119.950 -0.046 0.000 2.573 1463 F HA 0.489 5.016 4.527 -0.000 0.000 0.316 1463 F C -1.077 174.707 175.800 -0.027 0.000 1.148 1463 F CA -1.093 56.874 58.000 -0.054 0.000 0.940 1463 F CB 1.541 40.479 39.000 -0.104 0.000 1.214 1463 F HN 0.036 nan 8.300 nan 0.000 0.448 1464 N N 5.131 123.459 118.700 -0.621 0.000 2.462 1464 N HA 0.066 4.806 4.740 -0.000 0.000 0.242 1464 N C 0.535 175.526 175.510 -0.865 0.000 1.010 1464 N CA -0.288 52.455 53.050 -0.512 0.000 0.939 1464 N CB 0.749 39.088 38.487 -0.247 0.000 1.127 1464 N HN 0.776 nan 8.380 nan 0.000 0.509 1465 E N 3.132 122.958 120.200 -0.624 0.000 2.489 1465 E HA -0.047 4.303 4.350 -0.000 0.000 0.193 1465 E C 0.699 177.296 176.600 -0.004 0.000 1.057 1465 E CA 0.405 56.600 56.400 -0.342 0.000 0.866 1465 E CB -0.233 29.487 29.700 0.034 0.000 0.916 1465 E HN 0.525 nan 8.360 nan 0.000 0.500 1466 T N 1.794 116.327 114.554 -0.035 0.000 2.624 1466 T HA -0.119 4.231 4.350 -0.000 0.000 0.268 1466 T C 1.513 176.291 174.700 0.131 0.000 1.041 1466 T CA 1.613 63.741 62.100 0.046 0.000 1.159 1466 T CB -0.089 68.788 68.868 0.017 0.000 0.863 1466 T HN 0.219 nan 8.240 nan 0.000 0.434 1467 L N 0.232 121.561 121.223 0.177 0.000 2.965 1467 L HA 0.263 4.603 4.340 -0.000 0.000 0.254 1467 L C 1.642 178.814 176.870 0.504 0.000 1.220 1467 L CA -0.428 54.600 54.840 0.312 0.000 1.023 1467 L CB -0.060 42.152 42.059 0.256 0.000 1.355 1467 L HN 0.448 nan 8.230 nan 0.000 0.545 1468 W N 1.799 123.242 121.300 0.238 0.000 2.335 1468 W HA -0.102 4.558 4.660 -0.000 0.000 0.311 1468 W C 0.620 177.290 176.519 0.253 0.000 1.213 1468 W CA 0.903 58.438 57.345 0.317 0.000 1.274 1468 W CB 0.379 30.033 29.460 0.324 0.000 1.148 1468 W HN 0.103 nan 8.180 nan 0.000 0.498 1469 E N 0.642 120.881 120.200 0.065 0.000 2.344 1469 E HA 0.036 4.385 4.350 -0.000 0.000 0.270 1469 E C -1.547 174.626 176.600 -0.712 0.000 1.021 1469 E CA -1.701 54.540 56.400 -0.265 0.000 0.887 1469 E CB 0.539 30.184 29.700 -0.092 0.000 0.997 1469 E HN 0.059 nan 8.360 nan 0.000 0.429 1470 P HA -0.194 nan 4.420 nan 0.000 0.218 1470 P C 1.435 178.159 177.300 -0.959 0.000 1.148 1470 P CA 1.612 63.564 63.100 -1.913 0.000 0.822 1470 P CB 0.151 31.080 31.700 -1.286 0.000 0.784 1471 S N -0.504 114.888 115.700 -0.513 0.000 2.440 1471 S HA -0.186 4.284 4.470 -0.000 0.000 0.240 1471 S C 1.918 176.418 174.600 -0.166 0.000 1.014 1471 S CA 1.737 59.786 58.200 -0.252 0.000 0.980 1471 S CB -1.575 61.531 63.200 -0.158 0.000 0.775 1471 S HN 0.307 nan 8.310 nan 0.000 0.499 1472 S N -0.986 114.597 115.700 -0.196 0.000 2.558 1472 S HA 0.190 4.660 4.470 -0.000 0.000 0.217 1472 S C 0.164 174.882 174.600 0.196 0.000 0.975 1472 S CA -0.819 57.388 58.200 0.013 0.000 0.912 1472 S CB -0.442 62.802 63.200 0.074 0.000 0.776 1472 S HN 0.578 nan 8.310 nan 0.000 0.526 1473 W N 3.814 125.113 121.300 -0.003 0.000 2.237 1473 W HA 0.514 5.174 4.660 -0.000 0.000 0.335 1473 W C -2.245 174.271 176.519 -0.004 0.000 1.230 1473 W CA -3.153 54.190 57.345 -0.003 0.000 1.253 1473 W CB -0.814 28.640 29.460 -0.010 0.000 1.129 1473 W HN 0.050 nan 8.180 nan 0.000 0.590 1474 P HA 0.010 nan 4.420 nan 0.000 0.269 1474 P C 0.777 178.159 177.300 0.137 0.000 1.215 1474 P CA 0.075 63.251 63.100 0.127 0.000 0.780 1474 P CB 0.723 32.465 31.700 0.070 0.000 0.898 1475 S N 1.440 117.192 115.700 0.088 0.000 2.515 1475 S HA -0.010 4.460 4.470 -0.000 0.000 0.231 1475 S C 0.717 175.356 174.600 0.066 0.000 0.987 1475 S CA 0.200 58.448 58.200 0.080 0.000 0.936 1475 S CB -0.173 63.054 63.200 0.046 0.000 0.766 1475 S HN 0.351 nan 8.310 nan 0.000 0.528 1476 R N 0.940 121.468 120.500 0.046 0.000 2.538 1476 R HA 0.819 5.159 4.340 -0.000 0.000 0.292 1476 R C -1.044 175.255 176.300 -0.002 0.000 1.008 1476 R CA -0.069 56.041 56.100 0.017 0.000 0.896 1476 R CB 1.555 31.853 30.300 -0.004 0.000 1.187 1476 R HN 0.298 nan 8.270 nan 0.000 0.440 1477 A N 2.330 125.138 122.820 -0.021 0.000 2.594 1477 A HA 0.663 4.983 4.320 -0.000 0.000 0.295 1477 A C -1.428 176.115 177.584 -0.068 0.000 1.071 1477 A CA -0.739 51.266 52.037 -0.053 0.000 0.685 1477 A CB 2.194 21.149 19.000 -0.075 0.000 1.285 1477 A HN 0.683 nan 8.150 nan 0.000 0.405 1478 Q N 0.576 120.325 119.800 -0.084 0.000 2.435 1478 Q HA 0.745 5.085 4.340 -0.000 0.000 0.282 1478 Q C -0.481 175.537 176.000 0.031 0.000 1.020 1478 Q CA -0.614 55.154 55.803 -0.059 0.000 0.820 1478 Q CB 2.051 30.629 28.738 -0.266 0.000 1.436 1478 Q HN 1.819 nan 8.270 nan 0.000 0.395 1479 G N 0.071 108.988 108.800 0.196 0.000 2.677 1479 G HA2 0.545 4.505 3.960 -0.000 0.000 0.291 1479 G HA3 0.545 4.505 3.960 -0.000 0.000 0.291 1479 G C -1.930 173.016 174.900 0.077 0.000 1.435 1479 G CA -0.390 44.795 45.100 0.141 0.000 0.826 1479 G HN 0.720 nan 8.290 nan 0.000 0.491 1480 V N 0.168 120.007 119.914 -0.126 0.000 2.531 1480 V HA 0.860 4.980 4.120 -0.000 0.000 0.301 1480 V C 0.307 176.166 176.094 -0.392 0.000 1.034 1480 V CA 0.139 62.127 62.300 -0.519 0.000 0.865 1480 V CB 1.465 32.716 31.823 -0.954 0.000 0.995 1480 V HN 1.382 nan 8.190 nan 0.000 0.424 1481 G N 6.628 115.200 108.800 -0.381 0.000 2.322 1481 G HA2 0.608 4.568 3.960 -0.000 0.000 0.309 1481 G HA3 0.608 4.568 3.960 -0.000 0.000 0.309 1481 G C -0.813 173.896 174.900 -0.318 0.000 1.121 1481 G CA -0.405 44.536 45.100 -0.266 0.000 0.886 1481 G HN 1.166 nan 8.290 nan 0.000 0.447 1482 I N 0.176 120.614 120.570 -0.220 0.000 2.603 1482 I HA 0.862 5.032 4.170 -0.000 0.000 0.300 1482 I C -0.381 175.707 176.117 -0.050 0.000 1.017 1482 I CA -1.689 59.538 61.300 -0.122 0.000 1.098 1482 I CB 2.125 40.057 38.000 -0.113 0.000 1.279 1482 I HN 0.459 nan 8.210 nan 0.000 0.437 1483 M N 2.953 122.571 119.600 0.029 0.000 2.534 1483 M HA 0.397 4.877 4.480 -0.000 0.000 0.280 1483 M C -1.636 174.668 176.300 0.007 0.000 1.217 1483 M CA -0.502 54.779 55.300 -0.031 0.000 0.893 1483 M CB 2.585 35.127 32.600 -0.098 0.000 1.730 1483 M HN 0.644 nan 8.290 nan 0.000 0.483 1484 E N 1.963 122.169 120.200 0.009 0.000 2.046 1484 E HA 0.512 4.862 4.350 -0.000 0.000 0.279 1484 E C -0.671 175.985 176.600 0.094 0.000 0.989 1484 E CA -0.125 56.284 56.400 0.016 0.000 0.798 1484 E CB 1.508 31.227 29.700 0.031 0.000 1.086 1484 E HN 0.694 nan 8.360 nan 0.000 0.399 1485 A N 4.632 127.432 122.820 -0.034 0.000 2.259 1485 A HA 0.414 4.734 4.320 -0.000 0.000 0.278 1485 A C -1.497 175.896 177.584 -0.318 0.000 1.107 1485 A CA -1.163 50.798 52.037 -0.126 0.000 0.828 1485 A CB 0.090 19.008 19.000 -0.138 0.000 1.111 1485 A HN 0.248 nan 8.150 nan 0.000 0.498 1486 P HA -0.105 nan 4.420 nan 0.000 0.219 1486 P C 0.939 178.148 177.300 -0.152 0.000 1.146 1486 P CA 1.406 64.088 63.100 -0.697 0.000 0.808 1486 P CB 0.105 31.483 31.700 -0.537 0.000 0.779 1487 R N -1.944 118.508 120.500 -0.080 0.000 2.334 1487 R HA 0.422 4.762 4.340 -0.000 0.000 0.216 1487 R C 1.033 177.346 176.300 0.021 0.000 0.905 1487 R CA 0.390 56.503 56.100 0.020 0.000 1.064 1487 R CB 0.436 30.785 30.300 0.081 0.000 1.046 1487 R HN 0.194 nan 8.270 nan 0.000 0.508 1488 G N 0.127 108.900 108.800 -0.044 0.000 2.278 1488 G HA2 0.153 4.113 3.960 -0.000 0.000 0.265 1488 G HA3 0.153 4.113 3.960 -0.000 0.000 0.265 1488 G C -1.495 173.315 174.900 -0.150 0.000 1.329 1488 G CA -0.616 44.429 45.100 -0.091 0.000 1.017 1488 G HN 0.154 nan 8.290 nan 0.000 0.472 1489 A N -0.428 122.206 122.820 -0.310 0.000 2.491 1489 A HA 0.580 4.900 4.320 -0.000 0.000 0.261 1489 A C -0.126 177.296 177.584 -0.271 0.000 1.101 1489 A CA 0.702 52.394 52.037 -0.575 0.000 0.772 1489 A CB 0.474 18.644 19.000 -1.383 0.000 1.043 1489 A HN 2.093 nan 8.150 nan 0.000 0.501 1490 L N 3.117 124.322 121.223 -0.031 0.000 2.362 1490 L HA 0.843 5.183 4.340 -0.000 0.000 0.275 1490 L C 0.071 177.158 176.870 0.362 0.000 0.998 1490 L CA 0.088 55.050 54.840 0.202 0.000 0.820 1490 L CB 1.949 44.022 42.059 0.023 0.000 1.270 1490 L HN 0.719 nan 8.230 nan 0.000 0.415 1491 G N 2.647 111.708 108.800 0.435 0.000 2.591 1491 G HA2 0.499 4.459 3.960 -0.000 0.000 0.306 1491 G HA3 0.499 4.459 3.960 -0.000 0.000 0.306 1491 G C -1.663 173.344 174.900 0.178 0.000 1.334 1491 G CA -0.420 44.669 45.100 -0.018 0.000 0.981 1491 G HN 0.741 nan 8.290 nan 0.000 0.491 1492 H N 0.895 119.770 119.070 -0.324 0.000 2.589 1492 H HA 0.260 4.816 4.556 -0.000 0.000 0.335 1492 H C -0.950 174.128 175.328 -0.417 0.000 1.019 1492 H CA -0.712 55.239 56.048 -0.161 0.000 1.213 1492 H CB 1.943 31.657 29.762 -0.081 0.000 1.472 1492 H HN 0.416 nan 8.280 nan 0.000 0.508 1493 W N 5.305 126.426 121.300 -0.298 0.000 2.429 1493 W HA 0.399 5.059 4.660 -0.000 0.000 0.314 1493 W C -0.407 175.894 176.519 -0.364 0.000 1.062 1493 W CA -0.574 56.553 57.345 -0.364 0.000 1.211 1493 W CB 1.760 30.890 29.460 -0.549 0.000 1.305 1493 W HN 0.357 nan 8.180 nan 0.000 0.476 1494 I N 3.686 124.240 120.570 -0.028 0.000 2.509 1494 I HA 0.452 4.622 4.170 -0.000 0.000 0.293 1494 I C -1.083 175.113 176.117 0.133 0.000 1.020 1494 I CA -0.770 60.475 61.300 -0.092 0.000 1.088 1494 I CB 1.863 39.731 38.000 -0.220 0.000 1.267 1494 I HN -0.062 nan 8.210 nan 0.000 0.430 1495 V N 8.147 128.126 119.914 0.110 0.000 2.384 1495 V HA 0.446 4.566 4.120 -0.000 0.000 0.287 1495 V C 0.022 176.144 176.094 0.047 0.000 1.020 1495 V CA -0.459 61.880 62.300 0.065 0.000 0.850 1495 V CB 1.391 33.250 31.823 0.060 0.000 0.987 1495 V HN 0.483 nan 8.190 nan 0.000 0.436 1496 I N 4.312 124.895 120.570 0.021 0.000 2.359 1496 I HA 0.510 4.680 4.170 -0.000 0.000 0.294 1496 I C -0.005 176.141 176.117 0.049 0.000 0.987 1496 I CA -0.287 61.038 61.300 0.040 0.000 1.225 1496 I CB 1.540 39.545 38.000 0.008 0.000 1.366 1496 I HN 0.611 nan 8.210 nan 0.000 0.466 1497 E N 5.341 125.582 120.200 0.068 0.000 2.244 1497 E HA 0.201 4.551 4.350 -0.000 0.000 0.260 1497 E C -1.273 175.373 176.600 0.076 0.000 0.884 1497 E CA -0.617 55.818 56.400 0.059 0.000 0.777 1497 E CB 1.345 31.065 29.700 0.034 0.000 1.197 1497 E HN 0.519 nan 8.360 nan 0.000 0.416 1498 D N 2.553 123.004 120.400 0.085 0.000 2.708 1498 D HA -0.212 4.427 4.640 -0.000 0.000 0.236 1498 D C 0.837 177.188 176.300 0.084 0.000 1.146 1498 D CA 1.649 55.691 54.000 0.071 0.000 0.662 1498 D CB -1.075 39.745 40.800 0.034 0.000 1.059 1498 D HN 1.038 nan 8.370 nan 0.000 0.428 1499 G N -0.958 107.958 108.800 0.192 0.000 2.179 1499 G HA2 -0.349 3.611 3.960 -0.000 0.000 0.260 1499 G HA3 -0.349 3.611 3.960 -0.000 0.000 0.260 1499 G C 0.315 175.356 174.900 0.236 0.000 0.977 1499 G CA 0.526 45.773 45.100 0.244 0.000 0.641 1499 G HN 0.420 nan 8.290 nan 0.000 0.533 1500 R N -0.443 120.151 120.500 0.156 0.000 2.892 1500 R HA 0.675 5.015 4.340 -0.000 0.000 0.265 1500 R C 0.268 176.626 176.300 0.097 0.000 1.025 1500 R CA -1.639 54.523 56.100 0.102 0.000 0.982 1500 R CB 0.549 30.876 30.300 0.046 0.000 1.185 1500 R HN 0.196 nan 8.270 nan 0.000 0.484 1501 I N 1.965 122.577 120.570 0.070 0.000 2.505 1501 I HA 0.006 4.176 4.170 -0.000 0.000 0.287 1501 I C 1.270 177.422 176.117 0.058 0.000 1.104 1501 I CA 0.231 61.578 61.300 0.079 0.000 1.387 1501 I CB 1.164 39.208 38.000 0.074 0.000 1.404 1501 I HN 0.730 nan 8.210 nan 0.000 0.528 1502 A N 5.454 128.312 122.820 0.063 0.000 1.911 1502 A HA 0.096 4.416 4.320 -0.000 0.000 0.212 1502 A C 0.843 178.459 177.584 0.054 0.000 1.189 1502 A CA 0.871 52.935 52.037 0.046 0.000 0.639 1502 A CB 0.033 19.054 19.000 0.035 0.000 0.839 1502 A HN 0.668 nan 8.150 nan 0.000 0.449 1503 N N -2.446 116.303 118.700 0.082 0.000 2.331 1503 N HA 0.474 5.214 4.740 -0.000 0.000 0.280 1503 N C -2.133 173.472 175.510 0.158 0.000 1.155 1503 N CA -0.423 52.686 53.050 0.098 0.000 0.822 1503 N CB 1.455 39.986 38.487 0.074 0.000 1.619 1503 N HN 0.173 nan 8.380 nan 0.000 0.476 1504 Y N 1.471 121.786 120.300 0.025 0.000 2.330 1504 Y HA 0.363 4.913 4.550 -0.000 0.000 0.324 1504 Y C -1.320 174.580 175.900 0.001 0.000 1.093 1504 Y CA -0.558 57.555 58.100 0.022 0.000 1.103 1504 Y CB 1.239 39.684 38.460 -0.025 0.000 1.183 1504 Y HN 0.305 nan 8.280 nan 0.000 0.433 1505 Q N 4.433 124.311 119.800 0.130 0.000 2.310 1505 Q HA 0.635 4.975 4.340 -0.000 0.000 0.270 1505 Q C -1.101 174.984 176.000 0.142 0.000 1.025 1505 Q CA -0.667 55.200 55.803 0.106 0.000 0.772 1505 Q CB 2.210 30.926 28.738 -0.037 0.000 1.253 1505 Q HN 0.766 nan 8.270 nan 0.000 0.450 1506 A N 2.438 125.294 122.820 0.060 0.000 2.290 1506 A HA 0.653 4.973 4.320 -0.000 0.000 0.310 1506 A C -0.294 177.365 177.584 0.125 0.000 1.202 1506 A CA -0.494 51.538 52.037 -0.008 0.000 0.837 1506 A CB 0.783 19.496 19.000 -0.478 0.000 1.139 1506 A HN 0.419 nan 8.150 nan 0.000 0.509 1507 V N 3.856 123.980 119.914 0.351 0.000 2.378 1507 V HA 0.416 4.536 4.120 -0.000 0.000 0.288 1507 V C -0.137 176.197 176.094 0.401 0.000 1.016 1507 V CA -0.489 61.981 62.300 0.282 0.000 0.840 1507 V CB 1.049 33.015 31.823 0.239 0.000 0.994 1507 V HN 0.643 nan 8.190 nan 0.000 0.431 1508 V N 7.166 127.277 119.914 0.328 0.000 2.732 1508 V HA 0.383 4.502 4.120 -0.000 0.000 0.310 1508 V C -1.281 175.050 176.094 0.395 0.000 1.053 1508 V CA -1.627 60.895 62.300 0.370 0.000 0.957 1508 V CB 2.134 34.182 31.823 0.376 0.000 1.018 1508 V HN 0.589 nan 8.190 nan 0.000 0.452 1509 P HA -0.122 nan 4.420 nan 0.000 0.216 1509 P C 1.473 178.965 177.300 0.320 0.000 1.153 1509 P CA 1.414 64.715 63.100 0.336 0.000 0.858 1509 P CB 0.216 32.013 31.700 0.160 0.000 0.789 1510 S N -0.981 114.869 115.700 0.250 0.000 2.481 1510 S HA -0.061 4.409 4.470 -0.000 0.000 0.231 1510 S C 1.804 176.458 174.600 0.090 0.000 0.996 1510 S CA 1.364 59.675 58.200 0.184 0.000 0.942 1510 S CB -1.099 62.228 63.200 0.212 0.000 0.768 1510 S HN 0.312 nan 8.310 nan 0.000 0.520 1511 T N 0.879 115.516 114.554 0.139 0.000 2.708 1511 T HA -0.123 4.227 4.350 -0.000 0.000 0.266 1511 T C 1.326 175.995 174.700 -0.052 0.000 1.037 1511 T CA 1.144 63.253 62.100 0.015 0.000 1.146 1511 T CB -0.365 68.502 68.868 -0.001 0.000 0.865 1511 T HN 0.555 nan 8.240 nan 0.000 0.435 1512 W N 2.071 123.381 121.300 0.016 0.000 2.354 1512 W HA -0.058 4.602 4.660 -0.000 0.000 0.315 1512 W C 2.477 178.931 176.519 -0.108 0.000 1.206 1512 W CA 0.582 57.922 57.345 -0.008 0.000 1.290 1512 W CB -0.558 28.918 29.460 0.028 0.000 1.152 1512 W HN 0.168 nan 8.180 nan 0.000 0.489 1513 N N -0.129 118.638 118.700 0.112 0.000 2.171 1513 N HA -0.078 4.662 4.740 -0.000 0.000 0.184 1513 N C 1.598 176.634 175.510 -0.789 0.000 1.021 1513 N CA 1.858 54.809 53.050 -0.166 0.000 0.854 1513 N CB -0.974 37.555 38.487 0.069 0.000 0.994 1513 N HN 0.116 nan 8.380 nan 0.000 0.426 1514 A N 0.276 122.537 122.820 -0.932 0.000 2.238 1514 A HA 0.369 4.689 4.320 -0.000 0.000 0.210 1514 A C 1.242 178.532 177.584 -0.491 0.000 1.179 1514 A CA 0.160 51.468 52.037 -1.216 0.000 0.827 1514 A CB -0.453 18.042 19.000 -0.842 0.000 0.856 1514 A HN 0.233 nan 8.150 nan 0.000 0.488 1515 G N 0.823 109.435 108.800 -0.313 0.000 2.594 1515 G HA2 0.436 4.396 3.960 -0.000 0.000 0.243 1515 G HA3 0.436 4.396 3.960 -0.000 0.000 0.243 1515 G C -2.133 172.651 174.900 -0.192 0.000 1.229 1515 G CA -0.785 44.191 45.100 -0.208 0.000 0.843 1515 G HN 0.233 nan 8.290 nan 0.000 0.578 1516 P HA 0.292 nan 4.420 nan 0.000 0.328 1516 P C -0.095 177.120 177.300 -0.140 0.000 1.305 1516 P CA -0.844 62.117 63.100 -0.232 0.000 0.745 1516 P CB 1.145 32.412 31.700 -0.722 0.000 1.462 1517 R N 0.029 120.481 120.500 -0.081 0.000 2.784 1517 R HA 0.154 4.494 4.340 -0.000 0.000 0.266 1517 R C 0.670 176.993 176.300 0.039 0.000 1.044 1517 R CA 0.278 56.346 56.100 -0.055 0.000 1.151 1517 R CB -0.170 30.031 30.300 -0.165 0.000 1.037 1517 R HN 0.581 nan 8.270 nan 0.000 0.478 1518 D N -0.226 120.167 120.400 -0.013 0.000 2.595 1518 D HA 0.153 4.793 4.640 -0.000 0.000 0.268 1518 D C 1.068 177.341 176.300 -0.045 0.000 1.181 1518 D CA -0.513 53.424 54.000 -0.105 0.000 1.085 1518 D CB -0.240 40.332 40.800 -0.379 0.000 1.186 1518 D HN 0.397 nan 8.370 nan 0.000 0.621 1519 G N -1.174 107.508 108.800 -0.196 0.000 2.471 1519 G HA2 -0.209 3.751 3.960 -0.000 0.000 0.219 1519 G HA3 -0.209 3.751 3.960 -0.000 0.000 0.219 1519 G C 1.460 176.326 174.900 -0.057 0.000 1.125 1519 G CA 0.229 45.268 45.100 -0.102 0.000 0.775 1519 G HN 0.332 nan 8.290 nan 0.000 0.548 1520 R N -0.400 120.042 120.500 -0.096 0.000 2.310 1520 R HA 0.280 4.620 4.340 -0.000 0.000 0.202 1520 R C 1.768 178.050 176.300 -0.029 0.000 0.933 1520 R CA 0.630 56.694 56.100 -0.061 0.000 1.054 1520 R CB 0.093 30.342 30.300 -0.085 0.000 0.985 1520 R HN 0.294 nan 8.270 nan 0.000 0.489 1521 G N 1.277 110.077 108.800 -0.001 0.000 2.168 1521 G HA2 -0.370 3.590 3.960 -0.000 0.000 0.257 1521 G HA3 -0.370 3.590 3.960 -0.000 0.000 0.257 1521 G C -0.351 174.515 174.900 -0.057 0.000 0.997 1521 G CA 0.538 45.629 45.100 -0.015 0.000 0.708 1521 G HN 0.506 nan 8.290 nan 0.000 0.520 1522 Q N -0.143 119.617 119.800 -0.067 0.000 2.304 1522 Q HA 0.706 5.046 4.340 -0.000 0.000 0.260 1522 Q C 0.503 176.458 176.000 -0.074 0.000 0.965 1522 Q CA -0.046 55.715 55.803 -0.069 0.000 0.898 1522 Q CB 1.188 29.891 28.738 -0.059 0.000 1.196 1522 Q HN 0.941 nan 8.270 nan 0.000 0.402 1523 A N 2.817 125.589 122.820 -0.081 0.000 2.351 1523 A HA 0.608 4.928 4.320 -0.000 0.000 0.257 1523 A C 0.558 178.103 177.584 -0.065 0.000 1.087 1523 A CA 0.051 52.032 52.037 -0.092 0.000 0.798 1523 A CB 0.354 19.279 19.000 -0.125 0.000 1.033 1523 A HN 0.851 nan 8.150 nan 0.000 0.488 1524 G N -1.128 107.627 108.800 -0.074 0.000 2.588 1524 G HA2 0.482 4.442 3.960 -0.000 0.000 0.281 1524 G HA3 0.482 4.442 3.960 -0.000 0.000 0.281 1524 G C 1.140 175.995 174.900 -0.074 0.000 1.236 1524 G CA 0.187 45.243 45.100 -0.073 0.000 0.969 1524 G HN 1.358 nan 8.290 nan 0.000 0.504 1525 A N -0.507 122.268 122.820 -0.075 0.000 1.892 1525 A HA -0.122 4.198 4.320 -0.000 0.000 0.218 1525 A C 2.146 179.679 177.584 -0.084 0.000 1.188 1525 A CA 1.866 53.886 52.037 -0.027 0.000 0.631 1525 A CB -0.798 18.230 19.000 0.046 0.000 0.822 1525 A HN 0.636 nan 8.150 nan 0.000 0.447 1526 Y N 0.235 120.249 120.300 -0.477 0.000 2.145 1526 Y HA -0.164 4.386 4.550 -0.000 0.000 0.286 1526 Y C 2.468 178.243 175.900 -0.208 0.000 1.145 1526 Y CA 1.159 58.969 58.100 -0.484 0.000 1.148 1526 Y CB -1.140 37.094 38.460 -0.376 0.000 0.981 1526 Y HN 0.520 nan 8.280 nan 0.000 0.507 1527 E N -0.277 119.919 120.200 -0.007 0.000 2.051 1527 E HA -0.168 4.182 4.350 -0.000 0.000 0.192 1527 E C 2.396 178.949 176.600 -0.078 0.000 0.991 1527 E CA 1.153 57.506 56.400 -0.077 0.000 0.799 1527 E CB -0.305 29.311 29.700 -0.139 0.000 0.748 1527 E HN 0.376 nan 8.360 nan 0.000 0.449 1528 A N 1.224 124.021 122.820 -0.039 0.000 2.015 1528 A HA -0.011 4.309 4.320 -0.000 0.000 0.219 1528 A C 2.299 179.909 177.584 0.044 0.000 1.163 1528 A CA 1.418 53.448 52.037 -0.011 0.000 0.646 1528 A CB -0.411 18.593 19.000 0.007 0.000 0.806 1528 A HN 0.280 nan 8.150 nan 0.000 0.448 1529 A N -0.230 122.649 122.820 0.098 0.000 1.897 1529 A HA 0.083 4.403 4.320 -0.000 0.000 0.215 1529 A C 2.051 179.642 177.584 0.011 0.000 1.181 1529 A CA 1.198 53.349 52.037 0.190 0.000 0.620 1529 A CB -0.499 18.769 19.000 0.448 0.000 0.821 1529 A HN 0.433 nan 8.150 nan 0.000 0.443 1530 L N -0.733 120.400 121.223 -0.150 0.000 2.275 1530 L HA -0.179 4.161 4.340 -0.000 0.000 0.215 1530 L C 2.505 179.236 176.870 -0.231 0.000 1.119 1530 L CA 1.014 55.586 54.840 -0.447 0.000 0.790 1530 L CB -0.382 41.509 42.059 -0.280 0.000 0.919 1530 L HN 0.504 nan 8.230 nan 0.000 0.443 1531 Q N -0.843 118.904 119.800 -0.089 0.000 2.432 1531 Q HA -0.090 4.250 4.340 -0.000 0.000 0.205 1531 Q C 0.193 176.214 176.000 0.035 0.000 0.945 1531 Q CA 0.229 56.010 55.803 -0.036 0.000 0.924 1531 Q CB 0.124 28.825 28.738 -0.062 0.000 1.016 1531 Q HN 0.214 nan 8.270 nan 0.000 0.503 1532 D N 1.085 121.544 120.400 0.099 0.000 2.494 1532 D HA 0.023 4.663 4.640 -0.000 0.000 0.217 1532 D C -0.492 175.935 176.300 0.211 0.000 1.153 1532 D CA -0.006 54.076 54.000 0.137 0.000 0.954 1532 D CB -0.658 40.231 40.800 0.148 0.000 1.034 1532 D HN 0.199 nan 8.370 nan 0.000 0.518 1533 N N 3.028 121.793 118.700 0.108 0.000 2.783 1533 N HA -0.195 4.545 4.740 -0.000 0.000 0.247 1533 N C -1.031 174.445 175.510 -0.057 0.000 1.089 1533 N CA 0.144 53.198 53.050 0.006 0.000 0.690 1533 N CB -0.945 37.505 38.487 -0.061 0.000 0.991 1533 N HN 0.580 nan 8.380 nan 0.000 0.552 1534 H N 0.673 119.703 119.070 -0.067 0.000 2.457 1534 H HA 0.322 4.878 4.556 -0.000 0.000 0.335 1534 H C -0.406 174.895 175.328 -0.045 0.000 1.115 1534 H CA -0.322 55.684 56.048 -0.070 0.000 1.219 1534 H CB 1.583 31.334 29.762 -0.018 0.000 1.471 1534 H HN 0.251 nan 8.280 nan 0.000 0.491 1535 Q N 1.864 121.681 119.800 0.030 0.000 2.356 1535 Q HA 0.323 4.663 4.340 -0.000 0.000 0.270 1535 Q C -1.183 174.854 176.000 0.062 0.000 1.058 1535 Q CA -0.842 54.981 55.803 0.033 0.000 0.802 1535 Q CB 2.355 31.090 28.738 -0.005 0.000 1.303 1535 Q HN 0.332 nan 8.270 nan 0.000 0.444 1536 L N 2.466 123.724 121.223 0.059 0.000 2.257 1536 L HA 0.257 4.597 4.340 -0.000 0.000 0.290 1536 L C 0.914 177.816 176.870 0.054 0.000 1.044 1536 L CA 0.038 54.915 54.840 0.061 0.000 0.810 1536 L CB 1.286 43.368 42.059 0.037 0.000 1.193 1536 L HN 0.746 nan 8.230 nan 0.000 0.425 1537 V N 1.300 121.267 119.914 0.089 0.000 2.515 1537 V HA -0.001 4.119 4.120 -0.000 0.000 0.250 1537 V C 0.260 176.358 176.094 0.006 0.000 1.058 1537 V CA 1.560 63.886 62.300 0.043 0.000 1.064 1537 V CB 0.041 31.872 31.823 0.013 0.000 0.675 1537 V HN 0.882 nan 8.190 nan 0.000 0.461 1538 D N -0.929 119.490 120.400 0.032 0.000 2.616 1538 D HA 0.219 4.859 4.640 -0.000 0.000 0.238 1538 D C 0.584 176.861 176.300 -0.038 0.000 1.354 1538 D CA 0.192 54.180 54.000 -0.019 0.000 0.970 1538 D CB 1.736 42.501 40.800 -0.058 0.000 1.369 1538 D HN 0.139 nan 8.370 nan 0.000 0.585 1539 V N 2.326 122.220 119.914 -0.034 0.000 2.913 1539 V HA -0.028 4.091 4.120 -0.000 0.000 0.260 1539 V C 1.572 177.629 176.094 -0.062 0.000 1.098 1539 V CA 1.156 63.432 62.300 -0.040 0.000 1.121 1539 V CB -0.576 31.236 31.823 -0.017 0.000 0.714 1539 V HN 0.331 nan 8.190 nan 0.000 0.487 1540 K N 0.259 120.618 120.400 -0.069 0.000 2.459 1540 K HA 0.182 4.502 4.320 -0.000 0.000 0.193 1540 K C 0.847 177.341 176.600 -0.175 0.000 1.030 1540 K CA 0.542 56.787 56.287 -0.070 0.000 1.026 1540 K CB 0.064 32.545 32.500 -0.031 0.000 0.809 1540 K HN 0.611 nan 8.250 nan 0.000 0.504 1541 Q N 0.793 120.392 119.800 -0.334 0.000 3.230 1541 Q HA 0.127 4.467 4.340 -0.000 0.000 0.303 1541 Q C -2.479 173.077 176.000 -0.739 0.000 0.884 1541 Q CA -1.273 53.985 55.803 -0.909 0.000 0.859 1541 Q CB 1.506 29.890 28.738 -0.590 0.000 1.432 1541 Q HN 0.007 nan 8.270 nan 0.000 0.403 1542 P HA 0.057 nan 4.420 nan 0.000 0.218 1542 P C 0.576 177.723 177.300 -0.256 0.000 1.793 1542 P CA 0.130 63.080 63.100 -0.250 0.000 0.941 1542 P CB -0.206 31.418 31.700 -0.126 0.000 1.919 1543 I N 0.593 120.916 120.570 -0.412 0.000 2.567 1543 I HA -0.253 3.917 4.170 -0.000 0.000 0.257 1543 I C 1.465 177.376 176.117 -0.344 0.000 1.184 1543 I CA 1.465 62.527 61.300 -0.397 0.000 1.451 1543 I CB 0.205 37.800 38.000 -0.674 0.000 1.089 1543 I HN 0.003 nan 8.210 nan 0.000 0.441 1544 E N 0.813 120.914 120.200 -0.165 0.000 2.107 1544 E HA -0.152 4.198 4.350 -0.000 0.000 0.191 1544 E C 2.079 178.795 176.600 0.195 0.000 0.982 1544 E CA 1.234 57.717 56.400 0.138 0.000 0.809 1544 E CB -0.162 29.730 29.700 0.320 0.000 0.756 1544 E HN 0.516 nan 8.360 nan 0.000 0.459 1545 I N 0.526 121.128 120.570 0.053 0.000 2.202 1545 I HA -0.261 3.909 4.170 -0.000 0.000 0.242 1545 I C 2.053 178.104 176.117 -0.109 0.000 1.091 1545 I CA 0.966 62.266 61.300 -0.001 0.000 1.368 1545 I CB -0.205 37.770 38.000 -0.042 0.000 1.058 1545 I HN 0.115 nan 8.210 nan 0.000 0.410 1546 L N 0.117 121.215 121.223 -0.208 0.000 2.012 1546 L HA -0.233 4.107 4.340 -0.000 0.000 0.210 1546 L C 2.753 179.388 176.870 -0.392 0.000 1.073 1546 L CA 1.502 56.088 54.840 -0.423 0.000 0.748 1546 L CB -0.703 41.162 42.059 -0.323 0.000 0.891 1546 L HN 0.185 nan 8.230 nan 0.000 0.431 1547 R N -0.712 119.578 120.500 -0.349 0.000 2.091 1547 R HA -0.145 4.195 4.340 -0.000 0.000 0.238 1547 R C 2.309 178.650 176.300 0.069 0.000 1.136 1547 R CA 1.973 57.838 56.100 -0.393 0.000 0.959 1547 R CB -0.552 29.035 30.300 -1.189 0.000 0.856 1547 R HN 0.330 nan 8.270 nan 0.000 0.437 1548 T N 0.907 115.562 114.554 0.168 0.000 2.851 1548 T HA 0.023 4.373 4.350 -0.000 0.000 0.262 1548 T C 1.793 176.612 174.700 0.199 0.000 1.043 1548 T CA 0.616 62.910 62.100 0.324 0.000 1.140 1548 T CB 0.052 69.221 68.868 0.502 0.000 0.872 1548 T HN 0.026 nan 8.240 nan 0.000 0.446 1549 I N 1.240 121.806 120.570 -0.007 0.000 2.179 1549 I HA -0.127 4.043 4.170 -0.000 0.000 0.242 1549 I C 2.173 178.239 176.117 -0.086 0.000 1.088 1549 I CA 1.705 62.897 61.300 -0.180 0.000 1.357 1549 I CB -1.251 36.573 38.000 -0.293 0.000 1.051 1549 I HN 0.443 nan 8.210 nan 0.000 0.409 1550 H N 0.320 119.344 119.070 -0.076 0.000 2.456 1550 H HA -0.119 4.437 4.556 -0.000 0.000 0.296 1550 H C 2.422 177.576 175.328 -0.291 0.000 1.079 1550 H CA 1.307 57.258 56.048 -0.163 0.000 1.322 1550 H CB 0.162 29.768 29.762 -0.259 0.000 1.388 1550 H HN 0.374 nan 8.280 nan 0.000 0.538 1551 S N 0.353 116.003 115.700 -0.083 0.000 2.442 1551 S HA -0.164 4.306 4.470 -0.000 0.000 0.236 1551 S C 1.549 176.080 174.600 -0.116 0.000 1.007 1551 S CA 0.928 59.119 58.200 -0.015 0.000 0.965 1551 S CB -0.475 62.833 63.200 0.180 0.000 0.773 1551 S HN 0.298 nan 8.310 nan 0.000 0.504 1552 F N 1.681 121.586 119.950 -0.075 0.000 2.743 1552 F HA 0.241 4.768 4.527 -0.000 0.000 0.297 1552 F C 0.882 176.639 175.800 -0.071 0.000 1.131 1552 F CA 0.356 58.334 58.000 -0.037 0.000 1.426 1552 F CB -0.174 38.797 39.000 -0.048 0.000 1.116 1552 F HN 0.153 nan 8.300 nan 0.000 0.583 1553 D N 0.246 120.648 120.400 0.003 0.000 2.760 1553 D HA -0.141 4.499 4.640 -0.000 0.000 0.244 1553 D C -2.634 173.739 176.300 0.121 0.000 1.123 1553 D CA -0.130 53.779 54.000 -0.152 0.000 0.719 1553 D CB -0.578 39.907 40.800 -0.524 0.000 1.045 1553 D HN 0.084 nan 8.370 nan 0.000 0.426 1554 P HA 0.145 nan 4.420 nan 0.000 0.268 1554 P C -0.242 177.209 177.300 0.251 0.000 1.204 1554 P CA -0.475 62.818 63.100 0.322 0.000 0.768 1554 P CB 1.117 33.000 31.700 0.305 0.000 0.842 1555 C N 6.065 125.515 119.300 0.250 0.000 2.478 1555 C HA 0.336 4.796 4.460 -0.000 0.000 0.334 1555 C C 1.281 176.399 174.990 0.212 0.000 1.106 1555 C CA -0.485 58.659 59.018 0.209 0.000 1.363 1555 C CB -0.959 26.903 27.740 0.203 0.000 1.941 1555 C HN 0.486 nan 8.230 nan 0.000 0.436 1556 I N 4.034 124.719 120.570 0.192 0.000 2.584 1556 I HA 0.047 4.217 4.170 -0.000 0.000 0.255 1556 I C 2.582 178.815 176.117 0.193 0.000 1.145 1556 I CA 1.492 62.910 61.300 0.196 0.000 1.462 1556 I CB -1.558 36.567 38.000 0.209 0.000 1.102 1556 I HN 0.785 nan 8.210 nan 0.000 0.433 1557 A N 0.424 123.350 122.820 0.176 0.000 1.892 1557 A HA -0.275 4.044 4.320 -0.000 0.000 0.218 1557 A C 2.622 180.335 177.584 0.215 0.000 1.188 1557 A CA 2.200 54.342 52.037 0.175 0.000 0.631 1557 A CB -1.276 17.817 19.000 0.155 0.000 0.822 1557 A HN 0.477 nan 8.150 nan 0.000 0.447 1558 C N -1.404 118.046 119.300 0.250 0.000 2.432 1558 C HA 0.070 4.530 4.460 -0.000 0.000 0.277 1558 C C 3.370 178.595 174.990 0.392 0.000 1.249 1558 C CA 0.902 60.119 59.018 0.331 0.000 1.725 1558 C CB -1.277 26.670 27.740 0.345 0.000 2.028 1558 C HN 0.708 nan 8.230 nan 0.000 0.477 1559 A N -0.512 122.479 122.820 0.286 0.000 1.933 1559 A HA -0.081 4.239 4.320 -0.000 0.000 0.218 1559 A C 2.157 179.839 177.584 0.163 0.000 1.175 1559 A CA 2.349 54.525 52.037 0.231 0.000 0.628 1559 A CB -0.416 18.671 19.000 0.145 0.000 0.814 1559 A HN 0.417 nan 8.150 nan 0.000 0.444 1560 V N -0.163 119.814 119.914 0.104 0.000 2.672 1560 V HA 0.081 4.201 4.120 -0.000 0.000 0.242 1560 V C 0.910 176.705 176.094 -0.498 0.000 1.059 1560 V CA 0.695 62.926 62.300 -0.115 0.000 1.081 1560 V CB -0.925 30.951 31.823 0.089 0.000 0.752 1560 V HN 0.869 nan 8.190 nan 0.000 0.472 1561 H N 0.000 119.116 119.070 0.077 0.000 2.539 1561 H HA 0.000 4.556 4.556 -0.000 0.000 0.296 1561 H CA 0.000 56.059 56.048 0.019 0.000 1.023 1561 H CB 0.000 29.745 29.762 -0.029 0.000 1.292 1561 H HN 0.000 nan 8.280 nan 0.000 0.496