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 3lvg_1_A DATA FIRST_RESID 1078 DATA SEQUENCE NTSAVQVLIE HIGNLDRAYE FAERCNEPAV WSQLAKAQLQ KGMVKEAIDS DATA SEQUENCE YIKADDPSSY MEVVQAANTS GNWEELVKYL QMARKKARES YVETELIFAL DATA SEQUENCE AKTNRLAELE EFINGPNNAH IQQVGDRCYD EKMYDAAKLL YNNVSNFGRL DATA SEQUENCE ASTLVHLGEY QAAVDGARKA NSTRTWKEVC FACVDGKEFR LAQMCGLHIV DATA SEQUENCE VHADELEELI NYYQDRGYFE ELITMLEAAL GLERAHMGMF TELAILYSKF DATA SEQUENCE KPQKMREHLE LFWSRVNIPK VLRAAEQAHL WAELVFLYDK YEEYDNAIIT DATA SEQUENCE MMNHPTDAWK EGQFKDIITK VANVELYYRA IQFYLEFKPL LLNDLLMVLS DATA SEQUENCE PRLDHTRAVN YFSKVKQLPL VKPYLRSVQN HNNKSVNESL NNLFITEEDY DATA SEQUENCE QALRTSIDAY DNFDNISLAQ RLEKHELIEF RRIAAYLFKG NNRWKQSVEL DATA SEQUENCE CKKDSLYKDA MQYASESKDT ELAEELLQWF LQEEKRECFG ACLFTCYDLL DATA SEQUENCE RPDVVLETAW RHNIMDFAMP YFIQVMKEYL TKVDKLDASE SLRKEEEQAT DATA SEQUENCE ETQ 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 1078 N HA 0.000 nan 4.740 nan 0.000 0.220 1078 N C 0.000 175.483 175.510 -0.045 0.000 1.280 1078 N CA 0.000 53.036 53.050 -0.023 0.000 0.885 1078 N CB 0.000 38.486 38.487 -0.002 0.000 1.341 1079 T N -0.050 114.470 114.554 -0.057 0.000 3.366 1079 T HA 0.345 4.697 4.350 0.003 0.000 0.249 1079 T C 0.364 175.008 174.700 -0.093 0.000 1.028 1079 T CA 0.672 62.724 62.100 -0.079 0.000 0.938 1079 T CB -0.131 68.696 68.868 -0.069 0.000 1.046 1079 T HN 0.343 nan 8.240 nan 0.000 0.587 1080 S N -0.035 115.607 115.700 -0.097 0.000 2.501 1080 S HA 0.205 4.676 4.470 0.003 0.000 0.250 1080 S C 2.008 176.510 174.600 -0.164 0.000 0.959 1080 S CA 0.085 58.213 58.200 -0.120 0.000 1.250 1080 S CB -0.447 62.690 63.200 -0.106 0.000 0.933 1080 S HN 0.423 nan 8.310 nan 0.000 0.420 1081 A N 1.203 123.939 122.820 -0.140 0.000 2.234 1081 A HA 0.088 4.409 4.320 0.003 0.000 0.216 1081 A C 1.876 179.339 177.584 -0.203 0.000 1.167 1081 A CA 1.720 53.644 52.037 -0.188 0.000 0.698 1081 A CB -0.418 18.538 19.000 -0.073 0.000 0.779 1081 A HN 0.406 nan 8.150 nan 0.000 0.475 1082 V N -1.056 118.799 119.914 -0.099 0.000 2.599 1082 V HA -0.097 4.025 4.120 0.003 0.000 0.237 1082 V C 1.988 178.116 176.094 0.057 0.000 1.081 1082 V CA 1.450 63.783 62.300 0.055 0.000 1.107 1082 V CB -0.442 31.410 31.823 0.048 0.000 0.808 1082 V HN 0.617 nan 8.190 nan 0.000 0.486 1083 Q N 0.123 119.883 119.800 -0.067 0.000 2.449 1083 Q HA -0.154 4.188 4.340 0.003 0.000 0.214 1083 Q C 1.976 177.969 176.000 -0.011 0.000 0.986 1083 Q CA 1.514 57.290 55.803 -0.044 0.000 0.893 1083 Q CB -0.357 28.319 28.738 -0.104 0.000 0.940 1083 Q HN 0.637 nan 8.270 nan 0.000 0.477 1084 V N 1.342 121.169 119.914 -0.146 0.000 2.764 1084 V HA -0.220 3.902 4.120 0.003 0.000 0.261 1084 V C 1.134 177.302 176.094 0.125 0.000 1.108 1084 V CA 1.090 63.242 62.300 -0.247 0.000 1.129 1084 V CB -1.058 30.184 31.823 -0.968 0.000 0.701 1084 V HN 0.387 nan 8.190 nan 0.000 0.495 1085 L N 0.469 121.912 121.223 0.367 0.000 2.451 1085 L HA 0.457 4.799 4.340 0.003 0.000 0.272 1085 L C -0.182 176.816 176.870 0.214 0.000 1.258 1085 L CA 0.926 56.008 54.840 0.402 0.000 1.132 1085 L CB -1.270 41.028 42.059 0.399 0.000 1.361 1085 L HN 0.049 nan 8.230 nan 0.000 0.438 1086 I N -0.435 120.233 120.570 0.163 0.000 3.108 1086 I HA 0.444 4.616 4.170 0.003 0.000 0.312 1086 I C 0.996 177.176 176.117 0.105 0.000 1.095 1086 I CA -1.055 60.311 61.300 0.110 0.000 1.000 1086 I CB 1.535 39.580 38.000 0.074 0.000 1.229 1086 I HN 0.443 nan 8.210 nan 0.000 0.454 1087 E N 1.199 121.453 120.200 0.090 0.000 1.983 1087 E HA -0.275 4.077 4.350 0.003 0.000 0.208 1087 E C 1.062 177.713 176.600 0.085 0.000 1.006 1087 E CA 1.284 57.732 56.400 0.079 0.000 0.872 1087 E CB -0.457 29.291 29.700 0.080 0.000 0.806 1087 E HN 0.606 nan 8.360 nan 0.000 0.510 1088 H N 0.078 119.163 119.070 0.025 0.000 2.696 1088 H HA 0.041 4.598 4.556 0.003 0.000 0.288 1088 H C 0.594 175.934 175.328 0.020 0.000 1.096 1088 H CA 0.467 56.526 56.048 0.019 0.000 1.202 1088 H CB -0.116 29.653 29.762 0.012 0.000 1.279 1088 H HN 0.219 nan 8.280 nan 0.000 0.630 1089 I N -2.197 118.466 120.570 0.156 0.000 4.624 1089 I HA 0.235 4.407 4.170 0.003 0.000 0.327 1089 I C 1.565 177.753 176.117 0.117 0.000 1.295 1089 I CA 0.597 61.968 61.300 0.119 0.000 1.267 1089 I CB 1.361 39.407 38.000 0.076 0.000 1.249 1089 I HN 0.252 nan 8.210 nan 0.000 0.440 1090 G N -0.271 108.598 108.800 0.115 0.000 2.894 1090 G HA2 0.452 4.414 3.960 0.003 0.000 0.164 1090 G HA3 0.452 4.414 3.960 0.003 0.000 0.164 1090 G C -1.273 173.652 174.900 0.042 0.000 1.180 1090 G CA -0.188 44.988 45.100 0.126 0.000 0.997 1090 G HN 0.134 nan 8.290 nan 0.000 0.572 1091 N N -0.932 117.771 118.700 0.005 0.000 7.317 1091 N HA -0.097 4.644 4.740 0.003 0.000 0.066 1091 N C 0.575 176.022 175.510 -0.105 0.000 1.412 1091 N CA -0.134 52.900 53.050 -0.026 0.000 1.895 1091 N CB -0.399 38.065 38.487 -0.039 0.000 0.942 1091 N HN 0.998 nan 8.380 nan 0.000 1.166 1092 L N 0.862 122.050 121.223 -0.059 0.000 5.941 1092 L HA -0.358 3.983 4.340 0.003 0.000 0.053 1092 L C 0.283 176.829 176.870 -0.540 0.000 2.109 1092 L CA 1.735 56.532 54.840 -0.071 0.000 1.775 1092 L CB -1.074 41.006 42.059 0.034 0.000 2.631 1092 L HN 0.726 nan 8.230 nan 0.000 0.953 1093 D N 0.498 120.705 120.400 -0.323 0.000 2.906 1093 D HA 0.082 4.723 4.640 0.003 0.000 0.237 1093 D C 1.113 177.101 176.300 -0.520 0.000 1.201 1093 D CA 0.893 54.631 54.000 -0.437 0.000 0.998 1093 D CB -0.007 40.719 40.800 -0.123 0.000 1.183 1093 D HN 0.302 nan 8.370 nan 0.000 0.436 1094 R N -0.298 119.753 120.500 -0.748 0.000 3.718 1094 R HA 0.210 4.551 4.340 0.003 0.000 0.136 1094 R C 1.843 177.499 176.300 -1.072 0.000 0.698 1094 R CA 0.415 56.156 56.100 -0.598 0.000 1.110 1094 R CB -0.304 29.843 30.300 -0.255 0.000 1.594 1094 R HN 0.092 nan 8.270 nan 0.000 0.490 1095 A N 0.907 123.189 122.820 -0.897 0.000 1.948 1095 A HA -0.198 4.124 4.320 0.003 0.000 0.220 1095 A C 1.356 178.468 177.584 -0.786 0.000 1.177 1095 A CA 1.728 53.340 52.037 -0.708 0.000 0.636 1095 A CB -0.754 18.170 19.000 -0.127 0.000 0.815 1095 A HN 0.627 nan 8.150 nan 0.000 0.449 1096 Y N -1.715 118.313 120.300 -0.452 0.000 2.532 1096 Y HA 0.483 5.035 4.550 0.003 0.000 0.283 1096 Y C 1.376 177.045 175.900 -0.384 0.000 1.181 1096 Y CA -0.088 57.809 58.100 -0.339 0.000 1.256 1096 Y CB -0.352 37.928 38.460 -0.300 0.000 1.112 1096 Y HN 0.288 nan 8.280 nan 0.000 0.521 1097 E N 0.527 120.350 120.200 -0.629 0.000 2.415 1097 E HA 0.070 4.422 4.350 0.003 0.000 0.197 1097 E C -0.079 176.416 176.600 -0.175 0.000 1.007 1097 E CA 0.267 56.446 56.400 -0.368 0.000 0.890 1097 E CB 0.130 29.603 29.700 -0.379 0.000 0.891 1097 E HN 0.612 nan 8.360 nan 0.000 0.496 1098 F N -2.337 117.630 119.950 0.028 0.000 2.850 1098 F HA 0.633 5.161 4.527 0.003 0.000 0.329 1098 F C 0.746 176.616 175.800 0.117 0.000 1.182 1098 F CA -1.002 57.032 58.000 0.058 0.000 1.270 1098 F CB -0.270 38.748 39.000 0.029 0.000 0.979 1098 F HN -0.159 nan 8.300 nan 0.000 0.506 1099 A N -0.233 122.815 122.820 0.380 0.000 2.192 1099 A HA 0.166 4.488 4.320 0.003 0.000 0.208 1099 A C 1.933 179.743 177.584 0.378 0.000 1.220 1099 A CA 0.303 52.602 52.037 0.436 0.000 0.900 1099 A CB -0.208 19.092 19.000 0.500 0.000 0.937 1099 A HN 0.385 nan 8.150 nan 0.000 0.487 1100 E N 0.266 120.692 120.200 0.376 0.000 2.358 1100 E HA -0.065 4.287 4.350 0.003 0.000 0.195 1100 E C 1.851 178.557 176.600 0.177 0.000 1.010 1100 E CA 0.362 56.945 56.400 0.305 0.000 0.856 1100 E CB 0.022 29.910 29.700 0.313 0.000 0.795 1100 E HN 0.536 nan 8.360 nan 0.000 0.504 1101 R N -0.302 120.302 120.500 0.174 0.000 2.127 1101 R HA 0.065 4.406 4.340 0.003 0.000 0.217 1101 R C 1.047 177.409 176.300 0.104 0.000 1.074 1101 R CA 0.520 56.694 56.100 0.123 0.000 0.991 1101 R CB -0.021 30.352 30.300 0.121 0.000 0.895 1101 R HN 0.187 nan 8.270 nan 0.000 0.450 1102 C N 0.399 119.777 119.300 0.129 0.000 2.362 1102 C HA 0.332 4.794 4.460 0.003 0.000 0.363 1102 C C 1.205 176.255 174.990 0.100 0.000 1.220 1102 C CA -0.949 58.131 59.018 0.104 0.000 2.379 1102 C CB 1.171 28.979 27.740 0.113 0.000 2.351 1102 C HN 0.392 nan 8.230 nan 0.000 0.582 1103 N N 0.023 118.770 118.700 0.078 0.000 2.419 1103 N HA -0.023 4.719 4.740 0.003 0.000 0.216 1103 N C 0.222 175.789 175.510 0.095 0.000 1.118 1103 N CA 0.079 53.171 53.050 0.071 0.000 0.850 1103 N CB 0.188 38.699 38.487 0.040 0.000 1.292 1103 N HN 0.881 nan 8.380 nan 0.000 0.467 1104 E N 1.513 121.753 120.200 0.066 0.000 1.998 1104 E HA 0.310 4.662 4.350 0.003 0.000 0.257 1104 E C -2.421 174.201 176.600 0.036 0.000 1.038 1104 E CA -1.553 54.885 56.400 0.062 0.000 0.869 1104 E CB 1.429 31.153 29.700 0.041 0.000 1.135 1104 E HN 0.317 nan 8.360 nan 0.000 0.430 1105 P HA 0.492 nan 4.420 nan 0.000 0.282 1105 P C -1.055 176.042 177.300 -0.338 0.000 1.124 1105 P CA 0.001 63.038 63.100 -0.105 0.000 0.681 1105 P CB 0.816 32.453 31.700 -0.105 0.000 1.773 1106 A N -1.167 121.286 122.820 -0.611 0.000 2.524 1106 A HA 0.680 5.001 4.320 0.003 0.000 0.286 1106 A C -0.572 176.429 177.584 -0.972 0.000 1.203 1106 A CA -0.473 51.178 52.037 -0.642 0.000 0.736 1106 A CB 0.856 19.656 19.000 -0.333 0.000 1.322 1106 A HN 0.238 nan 8.150 nan 0.000 0.424 1107 V N -0.695 118.878 119.914 -0.568 0.000 6.125 1107 V HA -0.211 3.910 4.120 0.003 0.000 0.281 1107 V C 0.533 176.563 176.094 -0.108 0.000 0.591 1107 V CA 1.989 64.085 62.300 -0.340 0.000 0.617 1107 V CB -2.227 29.456 31.823 -0.233 0.000 0.336 1107 V HN 0.934 nan 8.190 nan 0.000 0.650 1108 W N -0.517 120.802 121.300 0.031 0.000 2.842 1108 W HA 0.105 4.767 4.660 0.003 0.000 0.267 1108 W C 2.153 178.696 176.519 0.040 0.000 1.219 1108 W CA 0.494 57.864 57.345 0.041 0.000 1.458 1108 W CB 0.338 29.818 29.460 0.033 0.000 1.006 1108 W HN 0.463 nan 8.180 nan 0.000 0.603 1109 S N -0.054 115.801 115.700 0.259 0.000 2.470 1109 S HA -0.119 4.353 4.470 0.003 0.000 0.222 1109 S C 1.625 176.278 174.600 0.088 0.000 1.024 1109 S CA 0.770 59.052 58.200 0.136 0.000 0.931 1109 S CB 0.011 63.257 63.200 0.076 0.000 0.791 1109 S HN 0.263 nan 8.310 nan 0.000 0.513 1110 Q N 0.071 119.924 119.800 0.088 0.000 2.376 1110 Q HA 0.148 4.490 4.340 0.003 0.000 0.206 1110 Q C 1.944 177.994 176.000 0.082 0.000 0.921 1110 Q CA 0.368 56.206 55.803 0.058 0.000 0.911 1110 Q CB -0.077 28.680 28.738 0.031 0.000 1.032 1110 Q HN 0.511 nan 8.270 nan 0.000 0.510 1111 L N 0.267 121.574 121.223 0.139 0.000 2.240 1111 L HA 0.109 4.451 4.340 0.003 0.000 0.211 1111 L C 1.876 178.838 176.870 0.153 0.000 1.106 1111 L CA 1.656 56.598 54.840 0.171 0.000 0.793 1111 L CB -0.802 41.428 42.059 0.285 0.000 0.927 1111 L HN 0.284 nan 8.230 nan 0.000 0.446 1112 A N -0.091 122.813 122.820 0.141 0.000 2.067 1112 A HA -0.169 4.152 4.320 0.003 0.000 0.217 1112 A C 2.335 179.944 177.584 0.042 0.000 1.156 1112 A CA 1.158 53.246 52.037 0.086 0.000 0.683 1112 A CB -0.261 18.781 19.000 0.069 0.000 0.808 1112 A HN 0.435 nan 8.150 nan 0.000 0.455 1113 K N -0.632 119.792 120.400 0.040 0.000 2.243 1113 K HA 0.160 4.481 4.320 0.003 0.000 0.201 1113 K C 1.862 178.478 176.600 0.026 0.000 1.051 1113 K CA 0.828 57.126 56.287 0.019 0.000 0.970 1113 K CB -0.098 32.408 32.500 0.011 0.000 0.755 1113 K HN 0.374 nan 8.250 nan 0.000 0.465 1114 A N 0.010 122.856 122.820 0.044 0.000 1.997 1114 A HA 0.023 4.344 4.320 0.003 0.000 0.212 1114 A C 1.718 179.333 177.584 0.051 0.000 1.178 1114 A CA 0.433 52.497 52.037 0.045 0.000 0.698 1114 A CB 0.074 19.106 19.000 0.053 0.000 0.842 1114 A HN 0.162 nan 8.150 nan 0.000 0.458 1115 Q N -0.613 119.225 119.800 0.063 0.000 2.403 1115 Q HA 0.185 4.527 4.340 0.003 0.000 0.203 1115 Q C 1.047 177.070 176.000 0.039 0.000 0.932 1115 Q CA 0.339 56.182 55.803 0.066 0.000 0.945 1115 Q CB 0.515 29.311 28.738 0.097 0.000 1.045 1115 Q HN 0.452 nan 8.270 nan 0.000 0.511 1116 L N -0.548 120.689 121.223 0.024 0.000 2.609 1116 L HA 0.124 4.465 4.340 0.003 0.000 0.230 1116 L C 1.239 178.109 176.870 0.001 0.000 1.087 1116 L CA 0.873 55.715 54.840 0.002 0.000 0.874 1116 L CB 0.226 42.277 42.059 -0.013 0.000 1.114 1116 L HN 0.204 nan 8.230 nan 0.000 0.488 1117 Q N -0.366 119.440 119.800 0.010 0.000 2.281 1117 Q HA 0.116 4.458 4.340 0.003 0.000 0.215 1117 Q C -0.135 175.873 176.000 0.013 0.000 0.867 1117 Q CA 0.207 56.015 55.803 0.008 0.000 0.940 1117 Q CB 0.989 29.733 28.738 0.009 0.000 1.111 1117 Q HN 0.226 nan 8.270 nan 0.000 0.513 1118 K N 1.029 121.441 120.400 0.020 0.000 2.579 1118 K HA 0.476 4.797 4.320 0.003 0.000 0.225 1118 K C -0.618 175.996 176.600 0.025 0.000 0.992 1118 K CA -0.337 55.964 56.287 0.023 0.000 1.018 1118 K CB 1.589 34.107 32.500 0.030 0.000 1.249 1118 K HN 0.175 nan 8.250 nan 0.000 0.489 1119 G N 2.920 111.730 108.800 0.017 0.000 2.999 1119 G HA2 -0.258 3.704 3.960 0.003 0.000 0.686 1119 G HA3 -0.258 3.704 3.960 0.003 0.000 0.686 1119 G C -0.320 174.590 174.900 0.016 0.000 1.057 1119 G CA -0.865 44.246 45.100 0.018 0.000 0.784 1119 G HN 0.644 nan 8.290 nan 0.000 0.575 1120 M N 2.838 122.443 119.600 0.008 0.000 2.356 1120 M HA 0.398 4.879 4.480 0.003 0.000 0.348 1120 M C 0.401 176.702 176.300 0.002 0.000 1.595 1120 M CA 0.471 55.770 55.300 -0.002 0.000 1.095 1120 M CB 0.294 32.888 32.600 -0.010 0.000 1.963 1120 M HN 0.640 nan 8.290 nan 0.000 0.459 1121 V N 4.445 124.357 119.914 -0.004 0.000 4.397 1121 V HA -0.074 4.048 4.120 0.003 0.000 0.158 1121 V C 1.327 177.400 176.094 -0.036 0.000 1.309 1121 V CA 0.669 62.965 62.300 -0.007 0.000 1.184 1121 V CB -0.482 31.370 31.823 0.048 0.000 1.330 1121 V HN 0.987 nan 8.190 nan 0.000 0.607 1122 K N 1.697 122.087 120.400 -0.018 0.000 2.933 1122 K HA -0.489 3.833 4.320 0.003 0.000 0.195 1122 K C 1.651 178.221 176.600 -0.050 0.000 0.846 1122 K CA 2.977 59.244 56.287 -0.032 0.000 0.868 1122 K CB -1.218 31.249 32.500 -0.054 0.000 1.530 1122 K HN 0.606 nan 8.250 nan 0.000 0.566 1123 E N 1.014 121.173 120.200 -0.069 0.000 2.187 1123 E HA -0.241 4.110 4.350 0.003 0.000 0.199 1123 E C 1.915 178.461 176.600 -0.089 0.000 1.004 1123 E CA 1.553 57.908 56.400 -0.075 0.000 0.813 1123 E CB -0.116 29.536 29.700 -0.080 0.000 0.736 1123 E HN 0.597 nan 8.360 nan 0.000 0.468 1124 A N 0.227 122.967 122.820 -0.133 0.000 1.920 1124 A HA 0.058 4.379 4.320 0.003 0.000 0.209 1124 A C 1.900 179.410 177.584 -0.123 0.000 1.229 1124 A CA 0.256 52.156 52.037 -0.229 0.000 0.671 1124 A CB -0.123 18.585 19.000 -0.487 0.000 0.886 1124 A HN 0.305 nan 8.150 nan 0.000 0.461 1125 I N -0.014 120.529 120.570 -0.045 0.000 3.444 1125 I HA -0.015 4.157 4.170 0.003 0.000 0.287 1125 I C 0.630 176.762 176.117 0.024 0.000 1.302 1125 I CA 1.086 62.411 61.300 0.043 0.000 1.368 1125 I CB -0.009 38.048 38.000 0.096 0.000 1.048 1125 I HN 0.236 nan 8.210 nan 0.000 0.487 1126 D N -1.801 118.611 120.400 0.020 0.000 2.469 1126 D HA 0.171 4.813 4.640 0.003 0.000 0.215 1126 D C 1.249 177.623 176.300 0.123 0.000 1.154 1126 D CA 0.257 54.313 54.000 0.094 0.000 0.832 1126 D CB 0.459 41.291 40.800 0.053 0.000 1.008 1126 D HN 0.071 nan 8.370 nan 0.000 0.506 1127 S N -0.894 114.829 115.700 0.040 0.000 2.846 1127 S HA 0.142 4.614 4.470 0.003 0.000 0.249 1127 S C -0.293 174.357 174.600 0.082 0.000 1.028 1127 S CA -0.409 57.812 58.200 0.036 0.000 1.043 1127 S CB -0.007 63.206 63.200 0.022 0.000 0.990 1127 S HN 0.259 nan 8.310 nan 0.000 0.564 1128 Y N 1.187 121.396 120.300 -0.151 0.000 2.888 1128 Y HA 0.398 4.950 4.550 0.003 0.000 0.260 1128 Y C 0.447 176.204 175.900 -0.239 0.000 1.113 1128 Y CA -0.438 57.575 58.100 -0.145 0.000 1.237 1128 Y CB 0.449 38.861 38.460 -0.079 0.000 1.307 1128 Y HN 0.442 nan 8.280 nan 0.000 0.580 1129 I N -5.019 115.313 120.570 -0.396 0.000 5.061 1129 I HA 0.155 4.327 4.170 0.003 0.000 0.336 1129 I C 1.647 177.258 176.117 -0.843 0.000 1.247 1129 I CA -0.095 60.713 61.300 -0.821 0.000 1.418 1129 I CB 0.099 37.223 38.000 -1.460 0.000 1.467 1129 I HN -0.259 nan 8.210 nan 0.000 0.510 1130 K N 2.874 122.883 120.400 -0.652 0.000 2.635 1130 K HA -0.370 3.952 4.320 0.003 0.000 0.203 1130 K C 1.410 177.660 176.600 -0.584 0.000 0.873 1130 K CA 3.016 58.881 56.287 -0.704 0.000 0.919 1130 K CB -1.083 30.887 32.500 -0.884 0.000 1.309 1130 K HN 0.682 nan 8.250 nan 0.000 0.542 1131 A N 1.593 124.135 122.820 -0.463 0.000 2.750 1131 A HA -0.287 4.034 4.320 0.003 0.000 0.298 1131 A C -0.071 177.555 177.584 0.070 0.000 1.500 1131 A CA 1.465 53.407 52.037 -0.159 0.000 0.891 1131 A CB -1.661 17.362 19.000 0.038 0.000 0.972 1131 A HN 0.682 nan 8.150 nan 0.000 0.531 1132 D N -1.830 118.555 120.400 -0.024 0.000 9.880 1132 D HA -0.034 4.608 4.640 0.003 0.000 0.292 1132 D C -0.469 175.900 176.300 0.115 0.000 2.792 1132 D CA 1.827 55.849 54.000 0.038 0.000 2.581 1132 D CB -0.712 40.121 40.800 0.055 0.000 1.070 1132 D HN 1.069 nan 8.370 nan 0.000 0.795 1133 D N 1.441 121.893 120.400 0.087 0.000 10.830 1133 D HA -0.117 4.524 4.640 0.003 0.000 0.342 1133 D C -2.708 173.676 176.300 0.140 0.000 3.116 1133 D CA 0.498 54.567 54.000 0.115 0.000 2.688 1133 D CB 0.049 40.924 40.800 0.124 0.000 1.183 1133 D HN 0.132 nan 8.370 nan 0.000 0.934 1134 P HA 0.219 nan 4.420 nan 0.000 0.251 1134 P C -0.791 176.575 177.300 0.110 0.000 1.718 1134 P CA -0.414 62.760 63.100 0.123 0.000 1.119 1134 P CB 0.648 32.401 31.700 0.088 0.000 1.762 1135 S N 1.286 117.036 115.700 0.084 0.000 2.632 1135 S HA 0.405 4.877 4.470 0.003 0.000 0.267 1135 S C 0.299 174.923 174.600 0.040 0.000 1.276 1135 S CA -0.655 57.591 58.200 0.077 0.000 0.998 1135 S CB 0.105 63.342 63.200 0.062 0.000 0.953 1135 S HN 0.334 nan 8.310 nan 0.000 0.547 1136 S N 0.998 116.723 115.700 0.042 0.000 2.554 1136 S HA 0.117 4.589 4.470 0.003 0.000 0.290 1136 S C -0.078 174.608 174.600 0.143 0.000 1.309 1136 S CA -0.463 57.779 58.200 0.069 0.000 1.047 1136 S CB -0.666 62.580 63.200 0.077 0.000 0.828 1136 S HN 0.849 nan 8.310 nan 0.000 0.509 1137 Y N 0.728 121.027 120.300 -0.001 0.000 2.300 1137 Y HA 0.646 5.198 4.550 0.003 0.000 0.328 1137 Y C 0.726 176.636 175.900 0.015 0.000 1.270 1137 Y CA -1.491 56.615 58.100 0.010 0.000 1.352 1137 Y CB 0.717 39.192 38.460 0.025 0.000 1.286 1137 Y HN 0.778 nan 8.280 nan 0.000 0.536 1138 M N 0.146 119.599 119.600 -0.246 0.000 1.554 1138 M HA 0.012 4.493 4.480 0.003 0.000 0.221 1138 M C 1.438 177.723 176.300 -0.025 0.000 0.956 1138 M CA 0.524 55.843 55.300 0.031 0.000 0.892 1138 M CB -0.084 32.696 32.600 0.300 0.000 1.799 1138 M HN 0.851 nan 8.290 nan 0.000 0.677 1139 E N 0.665 120.819 120.200 -0.077 0.000 2.021 1139 E HA -0.188 4.164 4.350 0.003 0.000 0.200 1139 E C 1.373 177.926 176.600 -0.079 0.000 1.015 1139 E CA 2.615 58.979 56.400 -0.061 0.000 0.824 1139 E CB -0.067 29.592 29.700 -0.068 0.000 0.762 1139 E HN 0.436 nan 8.360 nan 0.000 0.454 1140 V N 0.653 120.504 119.914 -0.105 0.000 2.307 1140 V HA -0.239 3.883 4.120 0.003 0.000 0.245 1140 V C 2.514 178.488 176.094 -0.200 0.000 1.045 1140 V CA 1.467 63.679 62.300 -0.147 0.000 1.024 1140 V CB -0.423 31.312 31.823 -0.146 0.000 0.651 1140 V HN 0.226 nan 8.190 nan 0.000 0.449 1141 V N 0.093 119.904 119.914 -0.172 0.000 2.220 1141 V HA -0.385 3.737 4.120 0.003 0.000 0.250 1141 V C 2.563 178.578 176.094 -0.132 0.000 1.053 1141 V CA 2.634 64.837 62.300 -0.162 0.000 1.019 1141 V CB -0.899 30.886 31.823 -0.064 0.000 0.646 1141 V HN 0.577 nan 8.190 nan 0.000 0.455 1142 Q N 0.179 119.940 119.800 -0.064 0.000 2.077 1142 Q HA -0.260 4.082 4.340 0.003 0.000 0.206 1142 Q C 2.288 178.239 176.000 -0.082 0.000 0.989 1142 Q CA 2.658 58.438 55.803 -0.037 0.000 0.853 1142 Q CB -0.730 28.016 28.738 0.014 0.000 0.907 1142 Q HN 0.617 nan 8.270 nan 0.000 0.418 1143 A N 1.181 123.943 122.820 -0.096 0.000 1.896 1143 A HA -0.120 4.202 4.320 0.003 0.000 0.220 1143 A C 1.449 178.932 177.584 -0.169 0.000 1.206 1143 A CA 1.883 53.851 52.037 -0.115 0.000 0.647 1143 A CB -1.176 17.757 19.000 -0.112 0.000 0.828 1143 A HN 0.532 nan 8.150 nan 0.000 0.455 1144 A N -0.474 122.213 122.820 -0.221 0.000 2.545 1144 A HA 0.481 4.803 4.320 0.003 0.000 0.297 1144 A C 0.584 177.997 177.584 -0.285 0.000 1.340 1144 A CA 0.569 52.438 52.037 -0.280 0.000 1.016 1144 A CB -0.596 18.186 19.000 -0.363 0.000 1.122 1144 A HN 0.762 nan 8.150 nan 0.000 0.537 1145 N N 0.385 118.874 118.700 -0.352 0.000 2.505 1145 N HA -0.196 4.545 4.740 0.003 0.000 0.300 1145 N C 1.588 176.800 175.510 -0.497 0.000 0.797 1145 N CA 1.022 53.829 53.050 -0.404 0.000 1.111 1145 N CB -0.522 37.850 38.487 -0.191 0.000 2.337 1145 N HN 0.571 nan 8.380 nan 0.000 1.254 1146 T N -0.654 113.724 114.554 -0.294 0.000 2.701 1146 T HA 0.059 4.411 4.350 0.003 0.000 0.263 1146 T C 1.847 176.376 174.700 -0.284 0.000 1.040 1146 T CA 1.981 63.963 62.100 -0.196 0.000 1.147 1146 T CB -0.644 68.167 68.868 -0.095 0.000 0.865 1146 T HN 0.149 nan 8.240 nan 0.000 0.426 1147 S N 1.659 117.178 115.700 -0.302 0.000 2.414 1147 S HA 0.052 4.523 4.470 0.003 0.000 0.238 1147 S C 1.716 176.106 174.600 -0.350 0.000 1.055 1147 S CA 1.909 59.948 58.200 -0.268 0.000 1.174 1147 S CB -1.028 62.026 63.200 -0.243 0.000 1.087 1147 S HN 1.162 nan 8.310 nan 0.000 0.428 1148 G N 0.161 108.559 108.800 -0.670 0.000 4.112 1148 G HA2 0.009 3.970 3.960 0.003 0.000 0.223 1148 G HA3 0.009 3.970 3.960 0.003 0.000 0.223 1148 G C -0.680 173.640 174.900 -0.967 0.000 0.883 1148 G CA -0.661 43.761 45.100 -1.130 0.000 1.195 1148 G HN 0.257 nan 8.290 nan 0.000 0.730 1149 N N 1.488 119.686 118.700 -0.835 0.000 2.949 1149 N HA 0.253 4.994 4.740 0.003 0.000 0.243 1149 N C 0.562 175.822 175.510 -0.416 0.000 1.113 1149 N CA -0.394 52.406 53.050 -0.417 0.000 0.980 1149 N CB 0.539 38.854 38.487 -0.286 0.000 1.256 1149 N HN 0.440 nan 8.380 nan 0.000 0.508 1150 W N 0.791 122.084 121.300 -0.011 0.000 2.857 1150 W HA 0.053 4.714 4.660 0.003 0.000 0.301 1150 W C 1.996 178.517 176.519 0.004 0.000 1.047 1150 W CA -0.023 57.317 57.345 -0.008 0.000 1.671 1150 W CB -0.828 28.625 29.460 -0.012 0.000 1.225 1150 W HN 0.445 nan 8.180 nan 0.000 0.501 1151 E N 0.725 121.104 120.200 0.299 0.000 2.245 1151 E HA -0.327 4.025 4.350 0.003 0.000 0.217 1151 E C 1.550 178.212 176.600 0.104 0.000 1.069 1151 E CA 2.531 59.023 56.400 0.154 0.000 0.877 1151 E CB 0.032 29.805 29.700 0.121 0.000 0.757 1151 E HN 0.096 nan 8.360 nan 0.000 0.464 1152 E N -0.268 119.996 120.200 0.107 0.000 2.250 1152 E HA -0.021 4.331 4.350 0.003 0.000 0.192 1152 E C 1.713 178.429 176.600 0.192 0.000 0.986 1152 E CA 0.475 56.943 56.400 0.115 0.000 0.849 1152 E CB -0.186 29.588 29.700 0.123 0.000 0.797 1152 E HN 0.308 nan 8.360 nan 0.000 0.482 1153 L N 0.587 121.887 121.223 0.129 0.000 1.989 1153 L HA -0.171 4.171 4.340 0.003 0.000 0.211 1153 L C 1.952 178.892 176.870 0.116 0.000 1.071 1153 L CA 1.682 56.574 54.840 0.086 0.000 0.749 1153 L CB -0.685 41.351 42.059 -0.038 0.000 0.890 1153 L HN 0.092 nan 8.230 nan 0.000 0.431 1154 V N -1.485 118.489 119.914 0.100 0.000 2.469 1154 V HA -0.274 3.847 4.120 0.003 0.000 0.251 1154 V C 2.619 178.744 176.094 0.052 0.000 1.064 1154 V CA 2.222 64.562 62.300 0.068 0.000 1.066 1154 V CB -1.323 30.536 31.823 0.060 0.000 0.667 1154 V HN 0.524 nan 8.190 nan 0.000 0.461 1155 K N -1.036 119.397 120.400 0.055 0.000 2.167 1155 K HA -0.063 4.259 4.320 0.003 0.000 0.203 1155 K C 2.101 178.692 176.600 -0.014 0.000 1.052 1155 K CA 0.925 57.212 56.287 -0.000 0.000 0.956 1155 K CB -0.249 32.228 32.500 -0.037 0.000 0.735 1155 K HN 0.489 nan 8.250 nan 0.000 0.451 1156 Y N 0.964 121.237 120.300 -0.046 0.000 2.315 1156 Y HA -0.198 4.354 4.550 0.003 0.000 0.288 1156 Y C 1.593 177.467 175.900 -0.043 0.000 1.154 1156 Y CA 1.286 59.353 58.100 -0.054 0.000 1.229 1156 Y CB 0.114 38.539 38.460 -0.059 0.000 0.980 1156 Y HN 0.037 nan 8.280 nan 0.000 0.540 1157 L N -0.867 120.419 121.223 0.106 0.000 2.307 1157 L HA -0.113 4.228 4.340 0.003 0.000 0.211 1157 L C 2.415 179.291 176.870 0.010 0.000 1.099 1157 L CA 0.789 55.660 54.840 0.051 0.000 0.816 1157 L CB -0.704 41.373 42.059 0.031 0.000 0.952 1157 L HN 0.145 nan 8.230 nan 0.000 0.455 1158 Q N 0.621 120.417 119.800 -0.007 0.000 2.242 1158 Q HA -0.314 4.028 4.340 0.003 0.000 0.211 1158 Q C 2.110 178.092 176.000 -0.029 0.000 0.992 1158 Q CA 2.177 57.964 55.803 -0.026 0.000 0.889 1158 Q CB -0.079 28.635 28.738 -0.041 0.000 0.913 1158 Q HN 0.395 nan 8.270 nan 0.000 0.422 1159 M N -0.342 119.238 119.600 -0.033 0.000 2.514 1159 M HA 0.199 4.681 4.480 0.003 0.000 0.258 1159 M C 1.549 177.843 176.300 -0.010 0.000 1.119 1159 M CA 0.834 56.117 55.300 -0.029 0.000 1.111 1159 M CB -0.504 32.068 32.600 -0.048 0.000 1.390 1159 M HN 0.291 nan 8.290 nan 0.000 0.475 1160 A N 0.974 123.795 122.820 0.001 0.000 1.885 1160 A HA -0.233 4.088 4.320 0.003 0.000 0.215 1160 A C 2.030 179.608 177.584 -0.009 0.000 1.255 1160 A CA 2.007 54.047 52.037 0.005 0.000 0.692 1160 A CB -0.814 18.191 19.000 0.009 0.000 0.842 1160 A HN 0.444 nan 8.150 nan 0.000 0.465 1161 R N 0.405 120.896 120.500 -0.015 0.000 2.332 1161 R HA -0.073 4.269 4.340 0.003 0.000 0.239 1161 R C 0.696 176.986 176.300 -0.018 0.000 1.160 1161 R CA 0.951 57.039 56.100 -0.021 0.000 1.020 1161 R CB -1.075 29.213 30.300 -0.020 0.000 0.859 1161 R HN 0.607 nan 8.270 nan 0.000 0.478 1162 K N 1.721 122.112 120.400 -0.014 0.000 2.349 1162 K HA -0.000 4.321 4.320 0.003 0.000 0.289 1162 K C -0.195 176.400 176.600 -0.007 0.000 1.064 1162 K CA 0.078 56.358 56.287 -0.012 0.000 0.947 1162 K CB 0.253 32.744 32.500 -0.014 0.000 1.007 1162 K HN -0.089 nan 8.250 nan 0.000 0.478 1163 K N 1.323 121.720 120.400 -0.005 0.000 3.148 1163 K HA -0.256 4.065 4.320 0.003 0.000 0.267 1163 K C -1.241 175.358 176.600 -0.001 0.000 0.996 1163 K CA 0.674 56.961 56.287 0.000 0.000 0.737 1163 K CB -1.361 31.142 32.500 0.005 0.000 1.308 1163 K HN 0.704 nan 8.250 nan 0.000 0.470 1164 A N 0.976 123.790 122.820 -0.010 0.000 2.538 1164 A HA 0.514 4.835 4.320 0.003 0.000 0.306 1164 A C -0.957 176.605 177.584 -0.036 0.000 0.999 1164 A CA -0.513 51.511 52.037 -0.021 0.000 0.829 1164 A CB 0.839 19.830 19.000 -0.015 0.000 1.143 1164 A HN 0.552 nan 8.150 nan 0.000 0.378 1165 R N 1.406 121.871 120.500 -0.058 0.000 2.415 1165 R HA 0.329 4.671 4.340 0.003 0.000 0.179 1165 R C -0.755 175.488 176.300 -0.094 0.000 1.242 1165 R CA 0.193 56.251 56.100 -0.070 0.000 0.754 1165 R CB -0.673 29.602 30.300 -0.042 0.000 1.411 1165 R HN 0.992 nan 8.270 nan 0.000 0.368 1166 E N 0.437 120.532 120.200 -0.175 0.000 2.446 1166 E HA 0.497 4.848 4.350 0.003 0.000 0.267 1166 E C -0.870 175.485 176.600 -0.407 0.000 0.955 1166 E CA -1.152 55.108 56.400 -0.233 0.000 0.842 1166 E CB 1.465 31.042 29.700 -0.205 0.000 1.504 1166 E HN 0.115 nan 8.360 nan 0.000 0.438 1167 S N -1.139 114.336 115.700 -0.375 0.000 2.633 1167 S HA 0.077 4.548 4.470 0.003 0.000 0.257 1167 S C 0.268 174.340 174.600 -0.879 0.000 1.265 1167 S CA 0.711 58.762 58.200 -0.249 0.000 0.980 1167 S CB -0.363 62.963 63.200 0.210 0.000 1.017 1167 S HN 0.843 nan 8.310 nan 0.000 0.577 1168 Y N -2.302 117.953 120.300 -0.076 0.000 4.053 1168 Y HA -0.276 4.275 4.550 0.003 0.000 0.361 1168 Y C 0.846 176.717 175.900 -0.050 0.000 1.000 1168 Y CA 1.494 59.526 58.100 -0.113 0.000 2.443 1168 Y CB -2.176 36.177 38.460 -0.179 0.000 1.032 1168 Y HN 0.180 nan 8.280 nan 0.000 0.520 1169 V N 0.446 120.076 119.914 -0.473 0.000 3.090 1169 V HA -0.004 4.117 4.120 0.003 0.000 0.237 1169 V C 2.274 178.283 176.094 -0.142 0.000 1.209 1169 V CA 1.067 63.227 62.300 -0.234 0.000 1.209 1169 V CB 0.494 32.142 31.823 -0.293 0.000 0.971 1169 V HN 0.611 nan 8.190 nan 0.000 0.477 1170 E N 0.008 120.096 120.200 -0.187 0.000 2.099 1170 E HA -0.115 4.237 4.350 0.003 0.000 0.191 1170 E C 1.876 178.453 176.600 -0.038 0.000 0.962 1170 E CA 1.392 57.738 56.400 -0.090 0.000 0.826 1170 E CB -0.440 29.204 29.700 -0.093 0.000 0.788 1170 E HN 0.366 nan 8.360 nan 0.000 0.461 1171 T N 0.821 115.344 114.554 -0.051 0.000 2.946 1171 T HA -0.099 4.252 4.350 0.003 0.000 0.271 1171 T C 1.210 175.958 174.700 0.081 0.000 1.104 1171 T CA 1.578 63.700 62.100 0.037 0.000 1.114 1171 T CB -0.104 68.790 68.868 0.043 0.000 0.867 1171 T HN 0.164 nan 8.240 nan 0.000 0.513 1172 E N 0.445 120.659 120.200 0.023 0.000 2.122 1172 E HA 0.114 4.466 4.350 0.003 0.000 0.190 1172 E C 1.857 178.523 176.600 0.110 0.000 0.977 1172 E CA 0.114 56.554 56.400 0.067 0.000 0.820 1172 E CB -0.414 29.306 29.700 0.033 0.000 0.770 1172 E HN 0.278 nan 8.360 nan 0.000 0.462 1173 L N 0.656 121.911 121.223 0.053 0.000 2.017 1173 L HA -0.119 4.223 4.340 0.003 0.000 0.208 1173 L C 1.841 178.744 176.870 0.055 0.000 1.073 1173 L CA 1.576 56.440 54.840 0.041 0.000 0.745 1173 L CB -0.500 41.563 42.059 0.007 0.000 0.894 1173 L HN 0.139 nan 8.230 nan 0.000 0.432 1174 I N -1.491 119.124 120.570 0.075 0.000 2.076 1174 I HA -0.344 3.828 4.170 0.003 0.000 0.237 1174 I C 2.327 178.522 176.117 0.131 0.000 1.059 1174 I CA 1.797 63.149 61.300 0.086 0.000 1.317 1174 I CB -0.663 37.409 38.000 0.121 0.000 1.037 1174 I HN 0.183 nan 8.210 nan 0.000 0.398 1175 F N 1.352 121.315 119.950 0.022 0.000 2.043 1175 F HA -0.370 4.159 4.527 0.003 0.000 0.297 1175 F C 2.576 178.387 175.800 0.019 0.000 1.118 1175 F CA 1.982 60.002 58.000 0.033 0.000 1.202 1175 F CB -0.687 38.337 39.000 0.039 0.000 0.965 1175 F HN 0.067 nan 8.300 nan 0.000 0.482 1176 A N 0.090 123.040 122.820 0.216 0.000 1.865 1176 A HA -0.196 4.126 4.320 0.003 0.000 0.217 1176 A C 2.310 179.908 177.584 0.025 0.000 1.191 1176 A CA 1.955 54.053 52.037 0.102 0.000 0.623 1176 A CB -1.253 17.794 19.000 0.078 0.000 0.826 1176 A HN 0.443 nan 8.150 nan 0.000 0.444 1177 L N -0.773 120.449 121.223 -0.003 0.000 2.013 1177 L HA -0.275 4.067 4.340 0.003 0.000 0.212 1177 L C 3.133 179.941 176.870 -0.102 0.000 1.073 1177 L CA 1.220 56.013 54.840 -0.079 0.000 0.753 1177 L CB -0.757 41.220 42.059 -0.135 0.000 0.890 1177 L HN 0.476 nan 8.230 nan 0.000 0.432 1178 A N 1.093 123.870 122.820 -0.071 0.000 1.971 1178 A HA -0.252 4.070 4.320 0.003 0.000 0.222 1178 A C 1.904 179.471 177.584 -0.028 0.000 1.182 1178 A CA 2.339 54.351 52.037 -0.042 0.000 0.649 1178 A CB -0.564 18.374 19.000 -0.103 0.000 0.818 1178 A HN 0.619 nan 8.150 nan 0.000 0.458 1179 K N -0.992 119.387 120.400 -0.035 0.000 2.681 1179 K HA 0.296 4.618 4.320 0.003 0.000 0.211 1179 K C 0.500 177.127 176.600 0.044 0.000 1.075 1179 K CA 0.459 56.748 56.287 0.003 0.000 1.141 1179 K CB 0.033 32.526 32.500 -0.012 0.000 0.896 1179 K HN 0.152 nan 8.250 nan 0.000 0.470 1180 T N 1.114 115.691 114.554 0.037 0.000 2.732 1180 T HA -0.083 4.268 4.350 0.003 0.000 0.261 1180 T C 0.352 175.185 174.700 0.221 0.000 1.040 1180 T CA 1.822 63.968 62.100 0.078 0.000 1.145 1180 T CB -0.187 68.687 68.868 0.010 0.000 0.866 1180 T HN 0.679 nan 8.240 nan 0.000 0.427 1181 N N -1.487 117.311 118.700 0.162 0.000 2.650 1181 N HA 0.138 4.879 4.740 0.003 0.000 0.393 1181 N C 0.387 175.911 175.510 0.022 0.000 0.637 1181 N CA -0.469 52.664 53.050 0.140 0.000 1.991 1181 N CB 0.494 39.028 38.487 0.077 0.000 0.843 1181 N HN -0.010 nan 8.380 nan 0.000 2.029 1182 R N -1.073 119.419 120.500 -0.014 0.000 2.535 1182 R HA 0.224 4.566 4.340 0.003 0.000 0.050 1182 R C 1.709 177.995 176.300 -0.023 0.000 0.816 1182 R CA 0.987 57.072 56.100 -0.027 0.000 2.949 1182 R CB -0.606 29.642 30.300 -0.087 0.000 1.256 1182 R HN 0.401 nan 8.270 nan 0.000 0.520 1183 L N -0.424 120.777 121.223 -0.037 0.000 2.027 1183 L HA 0.303 4.645 4.340 0.003 0.000 0.206 1183 L C 1.804 178.667 176.870 -0.013 0.000 1.074 1183 L CA 2.435 57.260 54.840 -0.025 0.000 0.745 1183 L CB -0.638 41.406 42.059 -0.024 0.000 0.898 1183 L HN 0.053 nan 8.230 nan 0.000 0.433 1184 A N -0.883 121.928 122.820 -0.015 0.000 2.423 1184 A HA 0.131 4.452 4.320 0.003 0.000 0.246 1184 A C 1.721 179.263 177.584 -0.069 0.000 1.278 1184 A CA -0.014 52.004 52.037 -0.031 0.000 0.903 1184 A CB -0.729 18.253 19.000 -0.031 0.000 0.997 1184 A HN 0.549 nan 8.150 nan 0.000 0.510 1185 E N 0.202 120.374 120.200 -0.046 0.000 2.335 1185 E HA 0.205 4.557 4.350 0.003 0.000 0.191 1185 E C 0.032 176.703 176.600 0.118 0.000 1.150 1185 E CA 0.203 56.567 56.400 -0.061 0.000 1.001 1185 E CB -0.124 29.602 29.700 0.042 0.000 1.127 1185 E HN 0.612 nan 8.360 nan 0.000 0.462 1186 L N -0.441 120.827 121.223 0.074 0.000 3.902 1186 L HA 0.158 4.500 4.340 0.003 0.000 0.375 1186 L C 0.934 177.848 176.870 0.075 0.000 1.252 1186 L CA -0.043 54.888 54.840 0.152 0.000 1.221 1186 L CB 0.600 42.718 42.059 0.099 0.000 1.484 1186 L HN -0.021 nan 8.230 nan 0.000 0.620 1187 E N 0.616 120.824 120.200 0.014 0.000 2.372 1187 E HA -0.052 4.299 4.350 0.003 0.000 0.201 1187 E C 1.627 178.220 176.600 -0.012 0.000 0.938 1187 E CA 0.666 57.066 56.400 0.000 0.000 0.944 1187 E CB 0.699 30.389 29.700 -0.017 0.000 0.937 1187 E HN 0.237 nan 8.360 nan 0.000 0.495 1188 E N -1.059 119.103 120.200 -0.063 0.000 2.431 1188 E HA 0.110 4.462 4.350 0.003 0.000 0.200 1188 E C 0.403 176.984 176.600 -0.031 0.000 0.995 1188 E CA 0.059 56.412 56.400 -0.079 0.000 0.915 1188 E CB -0.236 29.375 29.700 -0.149 0.000 0.930 1188 E HN 0.163 nan 8.360 nan 0.000 0.496 1189 F N 0.096 120.033 119.950 -0.022 0.000 2.773 1189 F HA 0.077 4.606 4.527 0.003 0.000 0.299 1189 F C 1.533 177.315 175.800 -0.029 0.000 1.204 1189 F CA 0.413 58.393 58.000 -0.033 0.000 1.454 1189 F CB -0.013 38.955 39.000 -0.053 0.000 1.117 1189 F HN 0.149 nan 8.300 nan 0.000 0.590 1190 I N -1.079 119.574 120.570 0.139 0.000 4.403 1190 I HA 0.173 4.345 4.170 0.003 0.000 0.331 1190 I C 0.383 176.531 176.117 0.051 0.000 1.327 1190 I CA 0.496 61.844 61.300 0.079 0.000 1.175 1190 I CB 0.222 38.255 38.000 0.055 0.000 1.165 1190 I HN -0.167 nan 8.210 nan 0.000 0.413 1191 N N 0.936 119.660 118.700 0.041 0.000 2.628 1191 N HA 0.376 5.118 4.740 0.003 0.000 0.299 1191 N C 0.021 175.541 175.510 0.016 0.000 1.834 1191 N CA 0.105 53.169 53.050 0.023 0.000 0.871 1191 N CB 1.339 39.831 38.487 0.009 0.000 1.377 1191 N HN 0.170 nan 8.380 nan 0.000 0.493 1192 G N 1.521 110.341 108.800 0.033 0.000 4.106 1192 G HA2 0.416 4.378 3.960 0.003 0.000 0.344 1192 G HA3 0.416 4.378 3.960 0.003 0.000 0.344 1192 G C -1.829 173.096 174.900 0.041 0.000 1.477 1192 G CA -0.662 44.454 45.100 0.027 0.000 1.068 1192 G HN 0.079 nan 8.290 nan 0.000 0.488 1193 P HA 0.185 nan 4.420 nan 0.000 0.211 1193 P C 0.223 177.532 177.300 0.016 0.000 0.917 1193 P CA -0.349 62.768 63.100 0.029 0.000 1.144 1193 P CB 0.439 32.155 31.700 0.026 0.000 0.802 1194 N N 3.223 121.927 118.700 0.006 0.000 2.789 1194 N HA -0.167 4.575 4.740 0.003 0.000 0.309 1194 N C -0.123 175.380 175.510 -0.011 0.000 1.174 1194 N CA 0.506 53.553 53.050 -0.005 0.000 0.740 1194 N CB -0.925 37.553 38.487 -0.013 0.000 1.019 1194 N HN 0.271 nan 8.380 nan 0.000 0.571 1195 N N 1.005 119.699 118.700 -0.010 0.000 1.433 1195 N HA -0.096 4.646 4.740 0.003 0.000 0.382 1195 N C -0.295 175.188 175.510 -0.044 0.000 1.205 1195 N CA 1.184 54.223 53.050 -0.018 0.000 0.766 1195 N CB -0.223 38.249 38.487 -0.025 0.000 0.975 1195 N HN 0.661 nan 8.380 nan 0.000 0.541 1196 A N 2.379 125.174 122.820 -0.041 0.000 2.506 1196 A HA 0.498 4.820 4.320 0.003 0.000 0.305 1196 A C -1.309 176.261 177.584 -0.025 0.000 1.166 1196 A CA -0.868 51.118 52.037 -0.085 0.000 0.638 1196 A CB 0.664 19.647 19.000 -0.027 0.000 1.336 1196 A HN 0.776 nan 8.150 nan 0.000 0.493 1197 H N 1.281 120.382 119.070 0.051 0.000 2.432 1197 H HA 0.264 4.822 4.556 0.003 0.000 0.226 1197 H C 0.550 175.917 175.328 0.064 0.000 1.634 1197 H CA -0.642 55.435 56.048 0.047 0.000 1.253 1197 H CB 0.079 29.869 29.762 0.047 0.000 1.584 1197 H HN 0.431 nan 8.280 nan 0.000 0.545 1198 I N 0.991 121.651 120.570 0.150 0.000 3.018 1198 I HA -0.269 3.903 4.170 0.003 0.000 0.277 1198 I C 1.520 177.711 176.117 0.124 0.000 1.293 1198 I CA 0.995 62.371 61.300 0.126 0.000 1.427 1198 I CB -0.507 37.547 38.000 0.090 0.000 1.091 1198 I HN 0.649 nan 8.210 nan 0.000 0.500 1199 Q N 0.442 120.319 119.800 0.129 0.000 2.368 1199 Q HA -0.215 4.127 4.340 0.003 0.000 0.210 1199 Q C 1.827 177.898 176.000 0.117 0.000 0.982 1199 Q CA 1.292 57.149 55.803 0.090 0.000 0.884 1199 Q CB -0.130 28.644 28.738 0.060 0.000 0.933 1199 Q HN 0.607 nan 8.270 nan 0.000 0.460 1200 Q N -1.142 118.767 119.800 0.182 0.000 2.392 1200 Q HA 0.053 4.394 4.340 0.003 0.000 0.219 1200 Q C 2.070 178.186 176.000 0.194 0.000 0.895 1200 Q CA 0.073 56.032 55.803 0.259 0.000 0.929 1200 Q CB 0.386 29.414 28.738 0.484 0.000 1.077 1200 Q HN 0.063 nan 8.270 nan 0.000 0.532 1201 V N 0.311 120.326 119.914 0.169 0.000 2.214 1201 V HA -0.276 3.846 4.120 0.003 0.000 0.245 1201 V C 2.150 178.316 176.094 0.121 0.000 1.047 1201 V CA 2.315 64.694 62.300 0.132 0.000 0.998 1201 V CB -1.330 30.578 31.823 0.141 0.000 0.633 1201 V HN 0.539 nan 8.190 nan 0.000 0.446 1202 G N -0.180 108.706 108.800 0.143 0.000 2.513 1202 G HA2 -0.315 3.647 3.960 0.003 0.000 0.219 1202 G HA3 -0.315 3.647 3.960 0.003 0.000 0.219 1202 G C 1.198 176.196 174.900 0.162 0.000 1.160 1202 G CA 1.357 46.569 45.100 0.187 0.000 0.767 1202 G HN 0.566 nan 8.290 nan 0.000 0.571 1203 D N 0.280 120.752 120.400 0.119 0.000 2.084 1203 D HA -0.095 4.546 4.640 0.003 0.000 0.194 1203 D C 2.508 178.887 176.300 0.131 0.000 0.990 1203 D CA 1.153 55.234 54.000 0.134 0.000 0.826 1203 D CB -0.317 40.553 40.800 0.117 0.000 0.971 1203 D HN 0.195 nan 8.370 nan 0.000 0.453 1204 R N 0.792 121.309 120.500 0.028 0.000 2.081 1204 R HA -0.044 4.298 4.340 0.003 0.000 0.235 1204 R C 2.182 178.455 176.300 -0.046 0.000 1.131 1204 R CA 1.187 57.217 56.100 -0.117 0.000 0.960 1204 R CB -1.034 29.002 30.300 -0.439 0.000 0.856 1204 R HN 0.207 nan 8.270 nan 0.000 0.436 1205 C N -0.411 118.901 119.300 0.019 0.000 2.425 1205 C HA -0.075 4.386 4.460 0.003 0.000 0.277 1205 C C 2.362 177.384 174.990 0.054 0.000 1.280 1205 C CA 0.726 59.761 59.018 0.029 0.000 1.744 1205 C CB -1.242 26.515 27.740 0.028 0.000 1.989 1205 C HN 0.555 nan 8.230 nan 0.000 0.491 1206 Y N 1.953 122.247 120.300 -0.010 0.000 2.373 1206 Y HA -0.095 4.457 4.550 0.003 0.000 0.293 1206 Y C 2.014 177.911 175.900 -0.004 0.000 1.129 1206 Y CA 2.031 60.134 58.100 0.006 0.000 1.226 1206 Y CB -0.436 38.046 38.460 0.036 0.000 1.000 1206 Y HN 0.419 nan 8.280 nan 0.000 0.549 1207 D N -0.335 120.064 120.400 -0.003 0.000 2.249 1207 D HA -0.095 4.547 4.640 0.003 0.000 0.205 1207 D C 0.111 176.353 176.300 -0.098 0.000 0.962 1207 D CA 0.672 54.628 54.000 -0.074 0.000 0.860 1207 D CB 0.128 40.919 40.800 -0.016 0.000 0.955 1207 D HN 0.102 nan 8.370 nan 0.000 0.505 1208 E N 0.146 120.301 120.200 -0.076 0.000 2.593 1208 E HA 0.198 4.549 4.350 0.003 0.000 0.232 1208 E C -1.347 175.223 176.600 -0.050 0.000 1.026 1208 E CA -0.735 55.630 56.400 -0.058 0.000 0.772 1208 E CB 0.409 30.083 29.700 -0.044 0.000 1.310 1208 E HN 0.096 nan 8.360 nan 0.000 0.413 1209 K N 2.187 122.541 120.400 -0.076 0.000 2.349 1209 K HA 0.502 4.824 4.320 0.003 0.000 0.288 1209 K C -0.267 176.311 176.600 -0.037 0.000 1.058 1209 K CA -0.435 55.813 56.287 -0.066 0.000 0.953 1209 K CB 0.791 33.237 32.500 -0.090 0.000 0.997 1209 K HN 0.233 nan 8.250 nan 0.000 0.477 1210 M N 4.086 123.656 119.600 -0.049 0.000 2.206 1210 M HA 0.218 4.700 4.480 0.003 0.000 0.272 1210 M C -1.352 174.883 176.300 -0.108 0.000 1.012 1210 M CA -0.826 54.446 55.300 -0.047 0.000 0.986 1210 M CB 1.312 33.902 32.600 -0.017 0.000 1.740 1210 M HN 0.653 nan 8.290 nan 0.000 0.472 1211 Y N 2.178 122.369 120.300 -0.183 0.000 2.509 1211 Y HA 0.040 4.591 4.550 0.003 0.000 0.293 1211 Y C 0.607 176.356 175.900 -0.251 0.000 1.133 1211 Y CA 1.976 59.947 58.100 -0.215 0.000 1.283 1211 Y CB 0.120 38.481 38.460 -0.164 0.000 1.001 1211 Y HN 0.804 nan 8.280 nan 0.000 0.555 1212 D N -0.304 119.927 120.400 -0.282 0.000 2.392 1212 D HA -0.028 4.614 4.640 0.003 0.000 0.228 1212 D C 1.421 177.430 176.300 -0.485 0.000 1.003 1212 D CA 1.047 54.859 54.000 -0.312 0.000 0.917 1212 D CB 0.035 40.742 40.800 -0.155 0.000 0.890 1212 D HN 0.359 nan 8.370 nan 0.000 0.532 1213 A N -0.132 122.247 122.820 -0.735 0.000 2.628 1213 A HA 0.597 4.919 4.320 0.003 0.000 0.267 1213 A C 1.546 178.639 177.584 -0.818 0.000 1.159 1213 A CA 0.059 51.534 52.037 -0.936 0.000 0.972 1213 A CB 0.356 18.058 19.000 -2.164 0.000 1.211 1213 A HN 0.132 nan 8.150 nan 0.000 0.576 1214 A N 0.022 122.320 122.820 -0.869 0.000 2.291 1214 A HA 0.266 4.587 4.320 0.003 0.000 0.220 1214 A C 1.664 178.783 177.584 -0.774 0.000 1.262 1214 A CA 1.223 52.631 52.037 -1.049 0.000 0.867 1214 A CB -0.175 18.223 19.000 -1.005 0.000 0.888 1214 A HN 0.286 nan 8.150 nan 0.000 0.487 1215 K N -1.170 118.940 120.400 -0.483 0.000 2.638 1215 K HA 0.115 4.436 4.320 0.003 0.000 0.207 1215 K C 1.197 177.721 176.600 -0.127 0.000 1.429 1215 K CA 0.348 56.515 56.287 -0.201 0.000 0.957 1215 K CB -0.783 31.574 32.500 -0.239 0.000 1.733 1215 K HN 0.238 nan 8.250 nan 0.000 0.474 1216 L N 2.228 123.338 121.223 -0.187 0.000 2.661 1216 L HA -0.034 4.308 4.340 0.003 0.000 0.236 1216 L C 1.579 178.420 176.870 -0.049 0.000 1.176 1216 L CA 1.009 55.789 54.840 -0.100 0.000 0.836 1216 L CB -0.127 41.866 42.059 -0.110 0.000 0.960 1216 L HN 0.349 nan 8.230 nan 0.000 0.455 1217 L N -3.479 117.705 121.223 -0.065 0.000 2.713 1217 L HA 0.058 4.400 4.340 0.003 0.000 0.223 1217 L C 1.720 178.664 176.870 0.123 0.000 1.040 1217 L CA 0.344 55.199 54.840 0.025 0.000 0.894 1217 L CB -0.635 41.425 42.059 0.002 0.000 1.361 1217 L HN 0.071 nan 8.230 nan 0.000 0.490 1218 Y N 0.762 120.990 120.300 -0.121 0.000 2.483 1218 Y HA -0.109 4.442 4.550 0.003 0.000 0.291 1218 Y C 1.984 177.846 175.900 -0.064 0.000 1.143 1218 Y CA 0.782 58.804 58.100 -0.130 0.000 1.289 1218 Y CB -0.598 37.770 38.460 -0.153 0.000 0.983 1218 Y HN 0.308 nan 8.280 nan 0.000 0.556 1219 N N 0.227 118.996 118.700 0.114 0.000 2.322 1219 N HA -0.008 4.734 4.740 0.003 0.000 0.216 1219 N C -0.192 175.349 175.510 0.053 0.000 1.144 1219 N CA 0.227 53.325 53.050 0.080 0.000 0.830 1219 N CB -0.195 38.327 38.487 0.058 0.000 1.034 1219 N HN 0.122 nan 8.380 nan 0.000 0.484 1220 N N -1.089 117.640 118.700 0.048 0.000 2.073 1220 N HA 0.101 4.843 4.740 0.003 0.000 0.227 1220 N C -1.107 174.417 175.510 0.023 0.000 1.367 1220 N CA 0.095 53.166 53.050 0.036 0.000 0.775 1220 N CB 1.250 39.762 38.487 0.041 0.000 1.234 1220 N HN -0.024 nan 8.380 nan 0.000 0.512 1221 V N -0.460 119.452 119.914 -0.004 0.000 3.333 1221 V HA 0.593 4.714 4.120 0.003 0.000 0.312 1221 V C -0.531 175.433 176.094 -0.217 0.000 1.520 1221 V CA -0.085 62.174 62.300 -0.068 0.000 0.973 1221 V CB 1.580 33.393 31.823 -0.017 0.000 1.061 1221 V HN 0.279 nan 8.190 nan 0.000 0.483 1222 S N -0.243 115.220 115.700 -0.396 0.000 4.163 1222 S HA 0.429 4.901 4.470 0.003 0.000 0.246 1222 S C 0.046 173.923 174.600 -1.206 0.000 1.069 1222 S CA 0.664 58.487 58.200 -0.629 0.000 1.544 1222 S CB 0.761 63.748 63.200 -0.355 0.000 1.166 1222 S HN 1.121 nan 8.310 nan 0.000 0.747 1223 N N 0.056 118.273 118.700 -0.806 0.000 2.735 1223 N HA -0.122 4.620 4.740 0.003 0.000 0.248 1223 N C 0.010 175.263 175.510 -0.428 0.000 1.083 1223 N CA 0.804 53.482 53.050 -0.621 0.000 0.703 1223 N CB -1.878 36.297 38.487 -0.520 0.000 1.005 1223 N HN 0.444 nan 8.380 nan 0.000 0.550 1224 F N -0.560 119.274 119.950 -0.193 0.000 2.095 1224 F HA -0.054 4.475 4.527 0.003 0.000 0.298 1224 F C 2.613 178.383 175.800 -0.049 0.000 1.104 1224 F CA 1.790 59.749 58.000 -0.070 0.000 1.232 1224 F CB -0.775 38.188 39.000 -0.060 0.000 0.987 1224 F HN 0.304 nan 8.300 nan 0.000 0.475 1225 G N -1.029 107.820 108.800 0.080 0.000 2.432 1225 G HA2 -0.238 3.724 3.960 0.003 0.000 0.219 1225 G HA3 -0.238 3.724 3.960 0.003 0.000 0.219 1225 G C 1.525 176.393 174.900 -0.053 0.000 1.135 1225 G CA 0.269 45.337 45.100 -0.052 0.000 0.767 1225 G HN 0.073 nan 8.290 nan 0.000 0.550 1226 R N -0.122 120.281 120.500 -0.161 0.000 2.391 1226 R HA 0.345 4.687 4.340 0.003 0.000 0.225 1226 R C 1.593 177.958 176.300 0.107 0.000 1.079 1226 R CA 0.041 55.844 56.100 -0.494 0.000 1.147 1226 R CB -0.498 29.235 30.300 -0.944 0.000 1.103 1226 R HN 0.531 nan 8.270 nan 0.000 0.499 1227 L N -3.107 118.256 121.223 0.233 0.000 2.758 1227 L HA 0.448 4.790 4.340 0.003 0.000 0.234 1227 L C 0.959 177.967 176.870 0.230 0.000 1.049 1227 L CA 0.312 55.357 54.840 0.343 0.000 0.908 1227 L CB 0.142 42.497 42.059 0.494 0.000 1.362 1227 L HN 0.014 nan 8.230 nan 0.000 0.499 1228 A N -0.612 122.278 122.820 0.117 0.000 2.411 1228 A HA 0.438 4.759 4.320 0.003 0.000 0.251 1228 A C 1.136 178.720 177.584 -0.000 0.000 1.317 1228 A CA 0.623 52.659 52.037 -0.002 0.000 0.904 1228 A CB -0.218 18.683 19.000 -0.166 0.000 0.993 1228 A HN 0.482 nan 8.150 nan 0.000 0.504 1229 S N -1.757 114.006 115.700 0.105 0.000 3.952 1229 S HA 0.073 4.545 4.470 0.003 0.000 0.211 1229 S C 0.664 175.312 174.600 0.079 0.000 1.098 1229 S CA 0.113 58.378 58.200 0.109 0.000 0.954 1229 S CB 0.112 63.408 63.200 0.159 0.000 1.222 1229 S HN 0.362 nan 8.310 nan 0.000 0.585 1230 T N 4.893 119.505 114.554 0.098 0.000 2.840 1230 T HA 0.516 4.868 4.350 0.003 0.000 0.276 1230 T C -0.435 174.215 174.700 -0.083 0.000 0.912 1230 T CA 0.304 62.301 62.100 -0.172 0.000 1.116 1230 T CB -1.382 67.005 68.868 -0.801 0.000 0.895 1230 T HN 0.501 nan 8.240 nan 0.000 0.570 1231 L N 1.479 122.663 121.223 -0.065 0.000 4.310 1231 L HA 0.293 4.634 4.340 0.003 0.000 0.204 1231 L C -1.163 175.688 176.870 -0.032 0.000 1.040 1231 L CA -0.928 53.888 54.840 -0.041 0.000 0.970 1231 L CB -0.658 41.391 42.059 -0.016 0.000 1.291 1231 L HN 0.258 nan 8.230 nan 0.000 0.328 1232 V N -0.824 119.081 119.914 -0.015 0.000 3.119 1232 V HA 0.687 4.809 4.120 0.003 0.000 0.309 1232 V C 0.921 177.049 176.094 0.058 0.000 1.304 1232 V CA 0.723 63.022 62.300 -0.003 0.000 1.057 1232 V CB 1.570 33.389 31.823 -0.007 0.000 1.150 1232 V HN 1.858 nan 8.190 nan 0.000 0.474 1233 H N -0.546 118.484 119.070 -0.067 0.000 3.641 1233 H HA -0.150 4.408 4.556 0.003 0.000 0.193 1233 H C 0.280 175.538 175.328 -0.118 0.000 1.013 1233 H CA 1.310 57.325 56.048 -0.056 0.000 1.212 1233 H CB -1.031 28.690 29.762 -0.069 0.000 1.089 1233 H HN 1.255 nan 8.280 nan 0.000 0.339 1234 L N -1.159 120.059 121.223 -0.008 0.000 7.603 1234 L HA -0.203 4.139 4.340 0.003 0.000 0.092 1234 L C 1.569 178.217 176.870 -0.370 0.000 1.252 1234 L CA 2.897 57.669 54.840 -0.112 0.000 1.482 1234 L CB -1.390 40.640 42.059 -0.049 0.000 2.830 1234 L HN 0.455 nan 8.230 nan 0.000 1.159 1235 G N -0.764 107.745 108.800 -0.485 0.000 3.141 1235 G HA2 0.448 4.410 3.960 0.003 0.000 0.218 1235 G HA3 0.448 4.410 3.960 0.003 0.000 0.218 1235 G C 0.285 174.805 174.900 -0.634 0.000 1.170 1235 G CA 1.123 45.472 45.100 -1.252 0.000 0.769 1235 G HN 0.983 nan 8.290 nan 0.000 0.546 1236 E N -2.525 117.525 120.200 -0.251 0.000 4.310 1236 E HA -0.288 4.064 4.350 0.003 0.000 0.198 1236 E C 0.193 176.839 176.600 0.077 0.000 1.405 1236 E CA 0.776 57.173 56.400 -0.006 0.000 2.225 1236 E CB -1.017 28.696 29.700 0.022 0.000 2.070 1236 E HN 0.164 nan 8.360 nan 0.000 0.518 1237 Y N 1.001 121.304 120.300 0.006 0.000 2.488 1237 Y HA 0.210 4.762 4.550 0.003 0.000 0.319 1237 Y C 0.969 176.899 175.900 0.050 0.000 1.212 1237 Y CA 0.878 58.995 58.100 0.027 0.000 1.273 1237 Y CB -0.006 38.460 38.460 0.010 0.000 1.074 1237 Y HN 0.288 nan 8.280 nan 0.000 0.503 1238 Q N 0.105 119.868 119.800 -0.063 0.000 2.188 1238 Q HA 0.433 4.775 4.340 0.003 0.000 0.212 1238 Q C 1.055 177.087 176.000 0.054 0.000 0.846 1238 Q CA 0.583 56.354 55.803 -0.054 0.000 0.989 1238 Q CB 0.768 29.561 28.738 0.093 0.000 1.114 1238 Q HN 0.449 nan 8.270 nan 0.000 0.488 1239 A N -1.176 121.663 122.820 0.032 0.000 2.600 1239 A HA 0.648 4.970 4.320 0.003 0.000 0.252 1239 A C 1.345 178.959 177.584 0.051 0.000 1.200 1239 A CA 0.548 52.642 52.037 0.095 0.000 0.981 1239 A CB 0.361 19.433 19.000 0.120 0.000 1.207 1239 A HN 0.230 nan 8.150 nan 0.000 0.577 1240 A N -0.364 122.469 122.820 0.022 0.000 1.920 1240 A HA 0.272 4.593 4.320 0.003 0.000 0.209 1240 A C 1.577 179.314 177.584 0.255 0.000 1.229 1240 A CA 1.254 53.318 52.037 0.044 0.000 0.671 1240 A CB -0.536 18.492 19.000 0.047 0.000 0.886 1240 A HN 0.445 nan 8.150 nan 0.000 0.461 1241 V N 1.069 121.054 119.914 0.119 0.000 3.284 1241 V HA -0.118 4.003 4.120 0.003 0.000 0.273 1241 V C 0.337 176.477 176.094 0.077 0.000 1.178 1241 V CA 1.908 64.264 62.300 0.094 0.000 1.177 1241 V CB -0.816 30.990 31.823 -0.028 0.000 0.793 1241 V HN 0.501 nan 8.190 nan 0.000 0.536 1242 D N -1.511 118.942 120.400 0.088 0.000 2.615 1242 D HA 0.185 4.827 4.640 0.003 0.000 0.274 1242 D C 1.215 177.506 176.300 -0.015 0.000 1.512 1242 D CA 0.829 54.854 54.000 0.042 0.000 0.803 1242 D CB 1.259 42.099 40.800 0.068 0.000 1.182 1242 D HN 0.402 nan 8.370 nan 0.000 0.473 1243 G N 0.785 109.629 108.800 0.074 0.000 2.534 1243 G HA2 0.269 4.231 3.960 0.003 0.000 0.220 1243 G HA3 0.269 4.231 3.960 0.003 0.000 0.220 1243 G C 1.316 176.333 174.900 0.196 0.000 1.699 1243 G CA 0.623 45.749 45.100 0.045 0.000 0.769 1243 G HN 0.133 nan 8.290 nan 0.000 0.632 1244 A N 0.650 123.793 122.820 0.537 0.000 2.259 1244 A HA 0.055 4.377 4.320 0.003 0.000 0.212 1244 A C 2.170 179.886 177.584 0.220 0.000 1.178 1244 A CA 1.545 53.905 52.037 0.539 0.000 0.734 1244 A CB -0.504 19.139 19.000 1.070 0.000 0.774 1244 A HN 0.408 nan 8.150 nan 0.000 0.481 1245 R N 0.360 120.959 120.500 0.164 0.000 2.091 1245 R HA -0.174 4.168 4.340 0.003 0.000 0.238 1245 R C 1.555 177.840 176.300 -0.026 0.000 1.136 1245 R CA 2.042 58.145 56.100 0.006 0.000 0.959 1245 R CB -0.255 30.046 30.300 0.001 0.000 0.856 1245 R HN 0.539 nan 8.270 nan 0.000 0.437 1246 K N -0.327 120.048 120.400 -0.043 0.000 2.099 1246 K HA 0.184 4.506 4.320 0.003 0.000 0.203 1246 K C 0.321 176.910 176.600 -0.020 0.000 1.047 1246 K CA 0.694 56.949 56.287 -0.053 0.000 0.963 1246 K CB 0.124 32.556 32.500 -0.113 0.000 0.759 1246 K HN 0.346 nan 8.250 nan 0.000 0.451 1247 A N 1.699 124.529 122.820 0.017 0.000 2.435 1247 A HA -0.093 4.228 4.320 0.003 0.000 0.686 1247 A C -0.789 176.832 177.584 0.062 0.000 0.138 1247 A CA -0.107 51.955 52.037 0.041 0.000 0.025 1247 A CB -1.077 17.912 19.000 -0.017 0.000 3.974 1247 A HN 0.381 nan 8.150 nan 0.000 0.548 1248 N N 0.039 118.822 118.700 0.137 0.000 3.369 1248 N HA 0.742 5.484 4.740 0.003 0.000 0.362 1248 N C -0.074 175.509 175.510 0.122 0.000 1.523 1248 N CA -0.045 53.084 53.050 0.133 0.000 0.684 1248 N CB 0.466 39.060 38.487 0.179 0.000 1.796 1248 N HN 0.796 nan 8.380 nan 0.000 0.641 1249 S N 0.388 116.158 115.700 0.116 0.000 2.548 1249 S HA 0.204 4.676 4.470 0.003 0.000 0.277 1249 S C 0.072 174.750 174.600 0.130 0.000 1.315 1249 S CA -0.557 57.692 58.200 0.082 0.000 1.050 1249 S CB -0.033 63.198 63.200 0.052 0.000 0.918 1249 S HN 0.544 nan 8.310 nan 0.000 0.497 1250 T N 3.057 117.649 114.554 0.065 0.000 2.905 1250 T HA 0.306 4.658 4.350 0.003 0.000 0.299 1250 T C -0.072 174.691 174.700 0.105 0.000 1.024 1250 T CA -0.443 61.697 62.100 0.066 0.000 1.151 1250 T CB -0.200 68.646 68.868 -0.037 0.000 0.987 1250 T HN 0.657 nan 8.240 nan 0.000 0.535 1251 R N 1.222 121.842 120.500 0.200 0.000 6.294 1251 R HA -0.046 4.295 4.340 0.003 0.000 0.206 1251 R C 1.064 177.386 176.300 0.036 0.000 0.853 1251 R CA 0.847 57.001 56.100 0.089 0.000 1.381 1251 R CB -1.964 28.357 30.300 0.035 0.000 1.327 1251 R HN 1.871 nan 8.270 nan 0.000 0.706 1252 T N -4.712 109.796 114.554 -0.077 0.000 7.880 1252 T HA -0.267 4.084 4.350 0.003 0.000 0.303 1252 T C 0.923 175.416 174.700 -0.345 0.000 2.087 1252 T CA 2.155 64.118 62.100 -0.229 0.000 3.396 1252 T CB -1.574 67.076 68.868 -0.364 0.000 1.703 1252 T HN 0.587 nan 8.240 nan 0.000 0.997 1253 W N 1.682 122.913 121.300 -0.116 0.000 2.630 1253 W HA 0.491 5.153 4.660 0.003 0.000 0.275 1253 W C 2.367 178.546 176.519 -0.567 0.000 1.192 1253 W CA 0.517 57.732 57.345 -0.217 0.000 1.410 1253 W CB 0.046 29.374 29.460 -0.220 0.000 1.075 1253 W HN 0.172 nan 8.180 nan 0.000 0.581 1254 K N 0.981 121.170 120.400 -0.353 0.000 2.589 1254 K HA -0.157 4.165 4.320 0.003 0.000 0.195 1254 K C 0.951 177.390 176.600 -0.268 0.000 1.042 1254 K CA 1.138 56.990 56.287 -0.725 0.000 0.940 1254 K CB -0.071 32.275 32.500 -0.257 0.000 0.776 1254 K HN 0.444 nan 8.250 nan 0.000 0.487 1255 E N -0.497 119.811 120.200 0.179 0.000 2.290 1255 E HA -0.035 4.316 4.350 0.003 0.000 0.195 1255 E C 1.940 179.021 176.600 0.803 0.000 0.938 1255 E CA 0.127 56.924 56.400 0.661 0.000 1.018 1255 E CB 0.019 29.863 29.700 0.241 0.000 1.042 1255 E HN -0.094 nan 8.360 nan 0.000 0.483 1256 V N 1.966 122.121 119.914 0.401 0.000 2.218 1256 V HA -0.385 3.737 4.120 0.003 0.000 0.251 1256 V C 2.549 178.819 176.094 0.294 0.000 1.057 1256 V CA 2.221 64.685 62.300 0.273 0.000 1.022 1256 V CB -0.645 31.245 31.823 0.111 0.000 0.645 1256 V HN 0.569 nan 8.190 nan 0.000 0.451 1257 C N -0.400 119.190 119.300 0.482 0.000 2.481 1257 C HA -0.030 4.432 4.460 0.003 0.000 0.275 1257 C C 2.534 177.563 174.990 0.065 0.000 1.419 1257 C CA 0.216 59.444 59.018 0.350 0.000 1.773 1257 C CB -1.478 26.486 27.740 0.373 0.000 1.862 1257 C HN 0.633 nan 8.230 nan 0.000 0.530 1258 F N 3.182 122.716 119.950 -0.693 0.000 2.014 1258 F HA 0.092 4.621 4.527 0.003 0.000 0.295 1258 F C 2.142 177.443 175.800 -0.831 0.000 1.145 1258 F CA 1.905 58.198 58.000 -2.846 0.000 1.178 1258 F CB -1.202 35.513 39.000 -3.809 0.000 0.972 1258 F HN 0.119 nan 8.300 nan 0.000 0.476 1259 A N -0.639 121.554 122.820 -1.046 0.000 2.272 1259 A HA -0.099 4.222 4.320 0.003 0.000 0.213 1259 A C 2.039 179.320 177.584 -0.505 0.000 1.183 1259 A CA 1.411 52.913 52.037 -0.892 0.000 0.719 1259 A CB -1.832 16.966 19.000 -0.337 0.000 0.771 1259 A HN 0.637 nan 8.150 nan 0.000 0.484 1260 C N -1.905 117.164 119.300 -0.385 0.000 2.611 1260 C HA 0.022 4.483 4.460 0.003 0.000 0.283 1260 C C 2.594 177.438 174.990 -0.243 0.000 1.340 1260 C CA 0.701 59.590 59.018 -0.215 0.000 1.716 1260 C CB -0.992 26.714 27.740 -0.055 0.000 2.134 1260 C HN 0.530 nan 8.230 nan 0.000 0.526 1261 V N 2.737 122.487 119.914 -0.274 0.000 2.313 1261 V HA -0.311 3.811 4.120 0.003 0.000 0.253 1261 V C 2.045 177.984 176.094 -0.259 0.000 1.070 1261 V CA 2.842 64.976 62.300 -0.276 0.000 1.057 1261 V CB -1.319 30.226 31.823 -0.463 0.000 0.653 1261 V HN 0.709 nan 8.190 nan 0.000 0.450 1262 D N 1.508 121.712 120.400 -0.326 0.000 2.084 1262 D HA 0.080 4.722 4.640 0.003 0.000 0.196 1262 D C 1.146 177.302 176.300 -0.240 0.000 0.985 1262 D CA 1.492 55.329 54.000 -0.272 0.000 0.826 1262 D CB -0.367 40.244 40.800 -0.316 0.000 0.978 1262 D HN 0.551 nan 8.370 nan 0.000 0.456 1263 G N -1.249 107.390 108.800 -0.268 0.000 2.448 1263 G HA2 0.480 4.442 3.960 0.003 0.000 0.324 1263 G HA3 0.480 4.442 3.960 0.003 0.000 0.324 1263 G C -1.095 173.636 174.900 -0.281 0.000 1.203 1263 G CA -0.739 44.209 45.100 -0.253 0.000 0.954 1263 G HN 0.386 nan 8.290 nan 0.000 0.480 1264 K N 1.326 121.499 120.400 -0.379 0.000 4.522 1264 K HA -0.124 4.197 4.320 0.003 0.000 0.478 1264 K C -0.036 176.273 176.600 -0.485 0.000 1.162 1264 K CA 0.390 56.333 56.287 -0.573 0.000 1.206 1264 K CB -0.940 31.380 32.500 -0.300 0.000 1.680 1264 K HN 0.711 nan 8.250 nan 0.000 0.407 1265 E N 2.534 122.418 120.200 -0.528 0.000 2.303 1265 E HA 0.006 4.357 4.350 0.003 0.000 0.211 1265 E C 0.167 176.660 176.600 -0.178 0.000 1.223 1265 E CA -0.245 55.988 56.400 -0.278 0.000 1.344 1265 E CB -0.033 29.546 29.700 -0.203 0.000 1.299 1265 E HN 0.370 nan 8.360 nan 0.000 0.441 1266 F N 0.297 120.222 119.950 -0.041 0.000 2.710 1266 F HA 0.148 4.677 4.527 0.003 0.000 0.298 1266 F C 1.201 176.984 175.800 -0.029 0.000 1.137 1266 F CA 0.031 58.007 58.000 -0.041 0.000 1.444 1266 F CB -0.082 38.890 39.000 -0.046 0.000 1.111 1266 F HN 0.017 nan 8.300 nan 0.000 0.580 1267 R N -0.113 120.463 120.500 0.127 0.000 3.527 1267 R HA -0.167 4.175 4.340 0.003 0.000 0.288 1267 R C 0.307 176.681 176.300 0.123 0.000 1.146 1267 R CA -0.030 56.128 56.100 0.097 0.000 0.778 1267 R CB -1.872 28.474 30.300 0.076 0.000 1.289 1267 R HN 0.303 nan 8.270 nan 0.000 0.454 1268 L N -0.813 120.502 121.223 0.154 0.000 2.627 1268 L HA 0.118 4.460 4.340 0.003 0.000 0.233 1268 L C 1.447 178.415 176.870 0.163 0.000 1.144 1268 L CA 0.925 55.861 54.840 0.161 0.000 0.892 1268 L CB 0.278 42.458 42.059 0.202 0.000 1.039 1268 L HN 0.375 nan 8.230 nan 0.000 0.442 1269 A N -1.352 121.567 122.820 0.165 0.000 2.676 1269 A HA 0.264 4.586 4.320 0.003 0.000 0.297 1269 A C 1.187 178.930 177.584 0.265 0.000 1.132 1269 A CA -0.224 51.941 52.037 0.214 0.000 0.972 1269 A CB 0.256 19.377 19.000 0.201 0.000 1.197 1269 A HN 0.154 nan 8.150 nan 0.000 0.524 1270 Q N -1.702 118.227 119.800 0.215 0.000 2.342 1270 Q HA 0.272 4.614 4.340 0.003 0.000 0.261 1270 Q C 1.518 177.631 176.000 0.188 0.000 0.841 1270 Q CA 0.635 56.560 55.803 0.204 0.000 0.969 1270 Q CB 0.151 28.977 28.738 0.147 0.000 1.136 1270 Q HN 0.606 nan 8.270 nan 0.000 0.528 1271 M N -0.345 119.371 119.600 0.194 0.000 2.216 1271 M HA -0.013 4.468 4.480 0.003 0.000 0.264 1271 M C 2.035 178.521 176.300 0.310 0.000 1.080 1271 M CA 1.006 56.441 55.300 0.225 0.000 1.153 1271 M CB -0.332 32.408 32.600 0.233 0.000 1.356 1271 M HN 0.259 nan 8.290 nan 0.000 0.432 1272 C N 0.501 119.966 119.300 0.275 0.000 2.466 1272 C HA 0.121 4.583 4.460 0.003 0.000 0.283 1272 C C 2.322 177.475 174.990 0.271 0.000 1.472 1272 C CA 0.473 59.646 59.018 0.258 0.000 1.765 1272 C CB -2.146 25.717 27.740 0.205 0.000 1.724 1272 C HN 0.672 nan 8.230 nan 0.000 0.560 1273 G N 1.045 109.999 108.800 0.256 0.000 2.662 1273 G HA2 -0.037 3.925 3.960 0.003 0.000 0.215 1273 G HA3 -0.037 3.925 3.960 0.003 0.000 0.215 1273 G C 1.139 176.135 174.900 0.160 0.000 1.310 1273 G CA 0.896 46.134 45.100 0.230 0.000 0.849 1273 G HN 0.409 nan 8.290 nan 0.000 0.568 1274 L N 0.726 122.030 121.223 0.135 0.000 2.351 1274 L HA -0.056 4.285 4.340 0.003 0.000 0.220 1274 L C 2.390 179.281 176.870 0.035 0.000 1.127 1274 L CA 1.127 56.005 54.840 0.063 0.000 0.786 1274 L CB -0.987 41.095 42.059 0.037 0.000 0.914 1274 L HN 0.313 nan 8.230 nan 0.000 0.443 1275 H N 1.052 120.123 119.070 0.001 0.000 2.253 1275 H HA -0.100 4.457 4.556 0.003 0.000 0.299 1275 H C 2.263 177.464 175.328 -0.211 0.000 1.064 1275 H CA 2.369 58.399 56.048 -0.031 0.000 1.264 1275 H CB -0.088 29.717 29.762 0.070 0.000 1.371 1275 H HN 0.449 nan 8.280 nan 0.000 0.493 1276 I N 0.499 120.984 120.570 -0.141 0.000 2.493 1276 I HA -0.135 4.037 4.170 0.003 0.000 0.254 1276 I C 2.472 178.259 176.117 -0.550 0.000 1.160 1276 I CA 1.310 62.065 61.300 -0.909 0.000 1.445 1276 I CB -0.574 36.813 38.000 -1.023 0.000 1.086 1276 I HN 0.100 nan 8.210 nan 0.000 0.433 1277 V N 0.413 120.225 119.914 -0.170 0.000 2.223 1277 V HA -0.144 3.978 4.120 0.003 0.000 0.244 1277 V C 1.809 177.970 176.094 0.111 0.000 1.045 1277 V CA 1.009 63.364 62.300 0.092 0.000 1.000 1277 V CB -1.698 30.175 31.823 0.083 0.000 0.635 1277 V HN 0.268 nan 8.190 nan 0.000 0.445 1278 V N 4.834 124.699 119.914 -0.081 0.000 5.596 1278 V HA -0.193 3.928 4.120 0.003 0.000 0.121 1278 V C 0.398 176.451 176.094 -0.067 0.000 0.747 1278 V CA 1.751 63.982 62.300 -0.115 0.000 0.524 1278 V CB -2.595 29.160 31.823 -0.113 0.000 0.164 1278 V HN 1.116 nan 8.190 nan 0.000 0.310 1279 H N 0.633 119.637 119.070 -0.109 0.000 2.930 1279 H HA 0.718 5.276 4.556 0.003 0.000 0.371 1279 H C 0.278 175.531 175.328 -0.125 0.000 1.169 1279 H CA -0.617 55.357 56.048 -0.123 0.000 1.157 1279 H CB 2.251 31.924 29.762 -0.149 0.000 1.789 1279 H HN 0.134 nan 8.280 nan 0.000 0.547 1280 A N 1.126 123.916 122.820 -0.049 0.000 2.278 1280 A HA 0.071 4.393 4.320 0.003 0.000 0.212 1280 A C 0.593 178.086 177.584 -0.151 0.000 1.213 1280 A CA 1.037 53.009 52.037 -0.109 0.000 0.840 1280 A CB -0.448 18.510 19.000 -0.070 0.000 0.866 1280 A HN 0.798 nan 8.150 nan 0.000 0.489 1281 D N -2.300 118.069 120.400 -0.051 0.000 2.715 1281 D HA 0.063 4.705 4.640 0.003 0.000 0.418 1281 D C 0.197 176.429 176.300 -0.113 0.000 1.290 1281 D CA 0.022 53.943 54.000 -0.132 0.000 1.005 1281 D CB 0.151 40.893 40.800 -0.097 0.000 1.631 1281 D HN 0.247 nan 8.370 nan 0.000 0.375 1282 E N -0.064 120.046 120.200 -0.150 0.000 3.188 1282 E HA 0.637 4.988 4.350 0.003 0.000 0.262 1282 E C 0.219 176.685 176.600 -0.222 0.000 1.341 1282 E CA -0.229 55.822 56.400 -0.582 0.000 1.140 1282 E CB 0.520 29.379 29.700 -1.401 0.000 1.306 1282 E HN -0.044 nan 8.360 nan 0.000 0.694 1283 L N -0.588 120.510 121.223 -0.208 0.000 2.123 1283 L HA -0.128 4.214 4.340 0.003 0.000 0.482 1283 L C 0.796 177.692 176.870 0.043 0.000 0.760 1283 L CA 0.982 55.851 54.840 0.048 0.000 2.423 1283 L CB -1.507 40.732 42.059 0.299 0.000 1.140 1283 L HN 0.656 nan 8.230 nan 0.000 0.553 1284 E N 0.552 120.742 120.200 -0.017 0.000 2.132 1284 E HA -0.013 4.338 4.350 0.003 0.000 0.193 1284 E C 1.576 178.169 176.600 -0.012 0.000 0.951 1284 E CA 1.123 57.525 56.400 0.004 0.000 0.843 1284 E CB 0.347 30.043 29.700 -0.008 0.000 0.807 1284 E HN 0.618 nan 8.360 nan 0.000 0.467 1285 E N 0.448 120.613 120.200 -0.058 0.000 2.268 1285 E HA -0.144 4.208 4.350 0.003 0.000 0.195 1285 E C 1.684 178.238 176.600 -0.078 0.000 0.995 1285 E CA 0.248 56.604 56.400 -0.072 0.000 0.836 1285 E CB 0.033 29.668 29.700 -0.108 0.000 0.763 1285 E HN 0.075 nan 8.360 nan 0.000 0.491 1286 L N 1.339 122.520 121.223 -0.070 0.000 2.693 1286 L HA 0.073 4.415 4.340 0.003 0.000 0.242 1286 L C 0.380 177.300 176.870 0.083 0.000 1.157 1286 L CA 0.528 55.336 54.840 -0.053 0.000 0.929 1286 L CB 0.114 42.146 42.059 -0.045 0.000 1.103 1286 L HN 0.218 nan 8.230 nan 0.000 0.430 1287 I N -3.513 117.119 120.570 0.105 0.000 3.007 1287 I HA 0.487 4.659 4.170 0.003 0.000 0.333 1287 I C -0.044 176.164 176.117 0.152 0.000 1.489 1287 I CA 0.093 61.496 61.300 0.173 0.000 0.906 1287 I CB -0.291 37.806 38.000 0.161 0.000 1.702 1287 I HN -0.055 nan 8.210 nan 0.000 0.548 1288 N N 0.265 119.053 118.700 0.147 0.000 2.036 1288 N HA 0.052 4.794 4.740 0.003 0.000 0.224 1288 N C 0.027 175.595 175.510 0.097 0.000 1.381 1288 N CA 0.069 53.175 53.050 0.094 0.000 0.746 1288 N CB 0.578 39.083 38.487 0.031 0.000 1.213 1288 N HN 0.553 nan 8.380 nan 0.000 0.524 1289 Y N -0.693 119.617 120.300 0.017 0.000 2.540 1289 Y HA 0.286 4.837 4.550 0.003 0.000 0.257 1289 Y C 0.030 176.090 175.900 0.267 0.000 1.090 1289 Y CA 0.081 58.217 58.100 0.060 0.000 1.242 1289 Y CB 0.517 38.945 38.460 -0.054 0.000 1.325 1289 Y HN -0.126 nan 8.280 nan 0.000 0.544 1290 Y N 0.969 121.365 120.300 0.159 0.000 2.675 1290 Y HA 0.339 4.891 4.550 0.003 0.000 0.248 1290 Y C 0.850 176.794 175.900 0.073 0.000 1.161 1290 Y CA -0.390 57.706 58.100 -0.005 0.000 1.203 1290 Y CB 0.322 38.920 38.460 0.230 0.000 1.262 1290 Y HN 0.344 nan 8.280 nan 0.000 0.544 1291 Q N -1.205 118.720 119.800 0.207 0.000 2.517 1291 Q HA 0.051 4.393 4.340 0.003 0.000 0.188 1291 Q C 1.115 177.158 176.000 0.072 0.000 0.736 1291 Q CA 0.030 55.915 55.803 0.137 0.000 0.834 1291 Q CB 0.425 29.289 28.738 0.209 0.000 1.198 1291 Q HN -0.007 nan 8.270 nan 0.000 0.596 1292 D N 1.641 122.105 120.400 0.106 0.000 2.244 1292 D HA -0.176 4.466 4.640 0.003 0.000 0.197 1292 D C 0.679 177.018 176.300 0.065 0.000 1.006 1292 D CA 1.254 55.309 54.000 0.092 0.000 0.888 1292 D CB -0.019 40.835 40.800 0.090 0.000 0.912 1292 D HN 0.137 nan 8.370 nan 0.000 0.452 1293 R N 0.511 121.036 120.500 0.042 0.000 3.534 1293 R HA 0.291 4.632 4.340 0.003 0.000 0.312 1293 R C 0.403 176.613 176.300 -0.150 0.000 1.419 1293 R CA -0.099 55.972 56.100 -0.047 0.000 1.262 1293 R CB 0.278 30.513 30.300 -0.108 0.000 1.437 1293 R HN -0.024 nan 8.270 nan 0.000 0.627 1294 G N 1.715 110.418 108.800 -0.163 0.000 2.256 1294 G HA2 -0.307 3.654 3.960 0.003 0.000 0.218 1294 G HA3 -0.307 3.654 3.960 0.003 0.000 0.218 1294 G C -0.382 174.200 174.900 -0.531 0.000 0.485 1294 G CA 0.258 45.161 45.100 -0.328 0.000 1.003 1294 G HN 0.428 nan 8.290 nan 0.000 0.360 1295 Y N 2.893 122.389 120.300 -1.339 0.000 2.698 1295 Y HA 0.702 5.254 4.550 0.003 0.000 0.185 1295 Y C 1.582 176.804 175.900 -1.131 0.000 1.078 1295 Y CA -0.227 57.252 58.100 -1.035 0.000 1.571 1295 Y CB -0.251 37.781 38.460 -0.713 0.000 1.086 1295 Y HN 0.873 nan 8.280 nan 0.000 0.487 1296 F N -1.895 117.784 119.950 -0.451 0.000 2.183 1296 F HA -0.298 4.230 4.527 0.002 0.000 0.318 1296 F C 1.537 176.971 175.800 -0.610 0.000 0.558 1296 F CA 0.109 57.813 58.000 -0.494 0.000 0.912 1296 F CB -1.860 36.906 39.000 -0.389 0.000 4.135 1296 F HN 0.272 nan 8.300 nan 0.000 0.137 1297 E N 0.629 120.747 120.200 -0.137 0.000 2.914 1297 E HA -0.330 4.022 4.350 0.003 0.000 0.218 1297 E C 1.586 178.003 176.600 -0.305 0.000 0.897 1297 E CA 2.467 58.758 56.400 -0.181 0.000 1.465 1297 E CB -1.060 28.567 29.700 -0.122 0.000 1.468 1297 E HN 0.706 nan 8.360 nan 0.000 0.462 1298 E N 0.287 120.238 120.200 -0.414 0.000 2.219 1298 E HA -0.179 4.173 4.350 0.003 0.000 0.198 1298 E C 2.205 178.415 176.600 -0.650 0.000 0.998 1298 E CA 0.840 56.992 56.400 -0.414 0.000 0.818 1298 E CB -0.324 29.249 29.700 -0.212 0.000 0.741 1298 E HN 0.255 nan 8.360 nan 0.000 0.477 1299 L N 0.894 121.382 121.223 -1.225 0.000 2.162 1299 L HA -0.016 4.326 4.340 0.003 0.000 0.205 1299 L C 1.990 178.713 176.870 -0.245 0.000 1.086 1299 L CA 0.982 55.304 54.840 -0.863 0.000 0.778 1299 L CB -0.308 41.142 42.059 -1.016 0.000 0.928 1299 L HN 0.101 nan 8.230 nan 0.000 0.446 1300 I N -3.447 117.007 120.570 -0.194 0.000 3.680 1300 I HA 0.122 4.294 4.170 0.003 0.000 0.306 1300 I C 0.627 176.749 176.117 0.008 0.000 1.260 1300 I CA 0.925 62.221 61.300 -0.007 0.000 1.201 1300 I CB -0.926 37.086 38.000 0.020 0.000 1.009 1300 I HN 0.044 nan 8.210 nan 0.000 0.467 1301 T N -0.640 113.886 114.554 -0.048 0.000 3.087 1301 T HA 0.255 4.607 4.350 0.003 0.000 0.283 1301 T C 1.265 175.970 174.700 0.009 0.000 0.956 1301 T CA -0.075 62.016 62.100 -0.015 0.000 0.894 1301 T CB 0.248 69.091 68.868 -0.041 0.000 1.160 1301 T HN 0.283 nan 8.240 nan 0.000 0.532 1302 M N 1.914 121.528 119.600 0.025 0.000 2.276 1302 M HA 0.240 4.722 4.480 0.003 0.000 0.262 1302 M C 1.731 178.072 176.300 0.068 0.000 1.098 1302 M CA 1.347 56.696 55.300 0.080 0.000 1.167 1302 M CB -0.761 31.942 32.600 0.172 0.000 1.337 1302 M HN 0.250 nan 8.290 nan 0.000 0.446 1303 L N -0.051 121.213 121.223 0.068 0.000 2.263 1303 L HA -0.185 4.156 4.340 0.003 0.000 0.216 1303 L C 1.884 178.736 176.870 -0.031 0.000 1.111 1303 L CA 1.129 55.985 54.840 0.026 0.000 0.773 1303 L CB -1.431 40.642 42.059 0.024 0.000 0.906 1303 L HN 0.307 nan 8.230 nan 0.000 0.439 1304 E N 0.579 120.775 120.200 -0.006 0.000 2.393 1304 E HA -0.212 4.140 4.350 0.003 0.000 0.201 1304 E C 1.830 178.409 176.600 -0.035 0.000 1.025 1304 E CA 1.279 57.668 56.400 -0.019 0.000 0.856 1304 E CB 0.083 29.791 29.700 0.015 0.000 0.771 1304 E HN 0.713 nan 8.360 nan 0.000 0.526 1305 A N 0.070 122.876 122.820 -0.024 0.000 1.917 1305 A HA 0.406 4.727 4.320 0.003 0.000 0.200 1305 A C 2.156 179.721 177.584 -0.032 0.000 1.671 1305 A CA 0.536 52.560 52.037 -0.022 0.000 1.034 1305 A CB -0.215 18.788 19.000 0.005 0.000 1.057 1305 A HN 0.177 nan 8.150 nan 0.000 0.507 1306 A N 0.016 122.826 122.820 -0.016 0.000 2.032 1306 A HA -0.076 4.245 4.320 0.003 0.000 0.221 1306 A C 1.752 179.313 177.584 -0.038 0.000 1.165 1306 A CA 1.806 53.833 52.037 -0.018 0.000 0.645 1306 A CB -0.511 18.497 19.000 0.012 0.000 0.807 1306 A HN 0.404 nan 8.150 nan 0.000 0.453 1307 L N -1.003 120.168 121.223 -0.087 0.000 2.395 1307 L HA 0.089 4.430 4.340 0.003 0.000 0.218 1307 L C 2.408 179.219 176.870 -0.098 0.000 1.130 1307 L CA 1.428 56.192 54.840 -0.126 0.000 0.826 1307 L CB -0.639 41.180 42.059 -0.401 0.000 0.941 1307 L HN 0.375 nan 8.230 nan 0.000 0.451 1308 G N -1.475 107.277 108.800 -0.079 0.000 2.887 1308 G HA2 0.150 4.112 3.960 0.003 0.000 0.211 1308 G HA3 0.150 4.112 3.960 0.003 0.000 0.211 1308 G C 0.838 175.727 174.900 -0.019 0.000 1.152 1308 G CA -0.323 44.749 45.100 -0.047 0.000 0.769 1308 G HN 0.140 nan 8.290 nan 0.000 0.541 1309 L N 0.261 121.472 121.223 -0.019 0.000 2.472 1309 L HA 0.052 4.393 4.340 0.003 0.000 0.273 1309 L C 1.791 178.658 176.870 -0.006 0.000 1.254 1309 L CA -0.035 54.795 54.840 -0.017 0.000 0.823 1309 L CB 0.494 42.537 42.059 -0.028 0.000 1.096 1309 L HN 0.142 nan 8.230 nan 0.000 0.521 1310 E N 0.355 120.548 120.200 -0.012 0.000 2.516 1310 E HA -0.122 4.230 4.350 0.003 0.000 0.199 1310 E C 1.005 177.602 176.600 -0.005 0.000 1.069 1310 E CA 0.470 56.866 56.400 -0.007 0.000 0.876 1310 E CB 0.299 29.992 29.700 -0.012 0.000 0.843 1310 E HN 0.371 nan 8.360 nan 0.000 0.530 1311 R N -0.130 120.367 120.500 -0.006 0.000 2.727 1311 R HA 0.298 4.639 4.340 0.003 0.000 0.410 1311 R C -0.974 175.358 176.300 0.053 0.000 1.101 1311 R CA -0.020 56.078 56.100 -0.005 0.000 1.045 1311 R CB 0.817 31.089 30.300 -0.048 0.000 1.380 1311 R HN -0.001 nan 8.270 nan 0.000 0.587 1312 A N 1.021 123.885 122.820 0.073 0.000 2.363 1312 A HA 0.378 4.699 4.320 0.003 0.000 0.270 1312 A C -0.258 177.397 177.584 0.118 0.000 1.121 1312 A CA -0.453 51.655 52.037 0.119 0.000 0.800 1312 A CB 0.117 19.189 19.000 0.120 0.000 1.052 1312 A HN 0.604 nan 8.150 nan 0.000 0.493 1313 H N 0.939 119.976 119.070 -0.054 0.000 3.424 1313 H HA 0.481 5.039 4.556 0.003 0.000 0.249 1313 H C 1.026 176.164 175.328 -0.316 0.000 1.664 1313 H CA -0.355 55.609 56.048 -0.140 0.000 1.629 1313 H CB 0.441 30.157 29.762 -0.077 0.000 1.444 1313 H HN 0.579 nan 8.280 nan 0.000 0.927 1314 M N 0.221 119.700 119.600 -0.202 0.000 2.276 1314 M HA 0.107 4.588 4.480 0.003 0.000 0.262 1314 M C 2.146 178.303 176.300 -0.238 0.000 1.098 1314 M CA 1.782 56.872 55.300 -0.350 0.000 1.167 1314 M CB -0.596 31.897 32.600 -0.179 0.000 1.337 1314 M HN 0.729 nan 8.290 nan 0.000 0.446 1315 G N 1.374 110.146 108.800 -0.047 0.000 2.547 1315 G HA2 -0.313 3.649 3.960 0.003 0.000 0.221 1315 G HA3 -0.313 3.649 3.960 0.003 0.000 0.221 1315 G C 1.359 176.250 174.900 -0.014 0.000 1.140 1315 G CA 1.591 46.705 45.100 0.023 0.000 0.760 1315 G HN 0.509 nan 8.290 nan 0.000 0.583 1316 M N -0.139 119.365 119.600 -0.160 0.000 2.399 1316 M HA -0.082 4.400 4.480 0.003 0.000 0.263 1316 M C 2.488 178.904 176.300 0.193 0.000 1.067 1316 M CA 2.009 57.309 55.300 0.000 0.000 1.084 1316 M CB -1.091 31.493 32.600 -0.027 0.000 1.252 1316 M HN 0.282 nan 8.290 nan 0.000 0.454 1317 F N 0.315 120.179 119.950 -0.144 0.000 2.111 1317 F HA -0.290 4.239 4.527 0.003 0.000 0.300 1317 F C 2.671 178.479 175.800 0.013 0.000 1.088 1317 F CA 1.136 59.125 58.000 -0.018 0.000 1.243 1317 F CB -1.354 37.651 39.000 0.009 0.000 0.996 1317 F HN 0.293 nan 8.300 nan 0.000 0.483 1318 T N -0.096 114.574 114.554 0.192 0.000 2.569 1318 T HA -0.190 4.162 4.350 0.003 0.000 0.263 1318 T C 1.738 176.463 174.700 0.043 0.000 1.074 1318 T CA 1.624 63.776 62.100 0.085 0.000 1.176 1318 T CB -0.385 68.514 68.868 0.053 0.000 0.863 1318 T HN 0.170 nan 8.240 nan 0.000 0.410 1319 E N 1.306 121.544 120.200 0.063 0.000 2.130 1319 E HA -0.125 4.226 4.350 0.003 0.000 0.196 1319 E C 2.216 178.854 176.600 0.065 0.000 0.998 1319 E CA 0.635 57.080 56.400 0.075 0.000 0.806 1319 E CB -0.843 28.923 29.700 0.108 0.000 0.738 1319 E HN 0.326 nan 8.360 nan 0.000 0.459 1320 L N 0.963 122.208 121.223 0.036 0.000 2.081 1320 L HA -0.164 4.178 4.340 0.003 0.000 0.212 1320 L C 2.142 178.950 176.870 -0.102 0.000 1.080 1320 L CA 2.186 57.014 54.840 -0.019 0.000 0.754 1320 L CB -0.734 41.268 42.059 -0.095 0.000 0.893 1320 L HN 0.074 nan 8.230 nan 0.000 0.433 1321 A N -0.260 122.446 122.820 -0.189 0.000 1.929 1321 A HA -0.104 4.218 4.320 0.003 0.000 0.216 1321 A C 2.198 179.748 177.584 -0.057 0.000 1.176 1321 A CA 1.639 53.540 52.037 -0.226 0.000 0.628 1321 A CB -0.857 17.992 19.000 -0.251 0.000 0.816 1321 A HN 0.527 nan 8.150 nan 0.000 0.444 1322 I N -0.217 120.343 120.570 -0.016 0.000 2.502 1322 I HA -0.291 3.880 4.170 0.003 0.000 0.258 1322 I C 2.057 178.191 176.117 0.029 0.000 1.172 1322 I CA 0.937 62.231 61.300 -0.009 0.000 1.430 1322 I CB -0.355 37.678 38.000 0.054 0.000 1.086 1322 I HN 0.318 nan 8.210 nan 0.000 0.440 1323 L N -1.482 119.851 121.223 0.183 0.000 2.185 1323 L HA -0.064 4.278 4.340 0.003 0.000 0.198 1323 L C 2.382 179.464 176.870 0.354 0.000 1.079 1323 L CA 0.672 55.775 54.840 0.439 0.000 0.780 1323 L CB -0.855 41.446 42.059 0.403 0.000 0.955 1323 L HN 0.014 nan 8.230 nan 0.000 0.462 1324 Y N 1.417 121.733 120.300 0.026 0.000 2.365 1324 Y HA -0.264 4.287 4.550 0.003 0.000 0.287 1324 Y C 2.987 178.820 175.900 -0.112 0.000 1.162 1324 Y CA 0.967 59.052 58.100 -0.025 0.000 1.260 1324 Y CB -0.897 37.520 38.460 -0.072 0.000 0.976 1324 Y HN 0.338 nan 8.280 nan 0.000 0.548 1325 S N 0.849 116.509 115.700 -0.067 0.000 2.361 1325 S HA -0.158 4.313 4.470 0.003 0.000 0.214 1325 S C 1.005 175.389 174.600 -0.361 0.000 1.034 1325 S CA 1.004 59.061 58.200 -0.237 0.000 1.025 1325 S CB -0.581 62.448 63.200 -0.285 0.000 0.996 1325 S HN 0.447 nan 8.310 nan 0.000 0.422 1326 K N 0.603 120.613 120.400 -0.650 0.000 2.432 1326 K HA 0.543 4.865 4.320 0.003 0.000 0.226 1326 K C -1.306 174.504 176.600 -1.317 0.000 1.057 1326 K CA -0.527 55.354 56.287 -0.677 0.000 1.034 1326 K CB 0.250 32.321 32.500 -0.715 0.000 1.561 1326 K HN 0.403 nan 8.250 nan 0.000 0.492 1327 F N -0.007 119.869 119.950 -0.125 0.000 2.057 1327 F HA 0.163 4.691 4.527 0.003 0.000 0.235 1327 F C -0.639 175.076 175.800 -0.141 0.000 1.305 1327 F CA -0.802 57.108 58.000 -0.150 0.000 1.102 1327 F CB -0.069 38.823 39.000 -0.180 0.000 2.159 1327 F HN 0.020 nan 8.300 nan 0.000 0.112 1328 K N 3.231 123.669 120.400 0.064 0.000 2.307 1328 K HA 0.184 4.506 4.320 0.003 0.000 0.285 1328 K C -2.265 174.272 176.600 -0.104 0.000 1.073 1328 K CA -1.033 55.201 56.287 -0.088 0.000 0.996 1328 K CB 0.600 32.958 32.500 -0.237 0.000 0.994 1328 K HN -0.007 nan 8.250 nan 0.000 0.452 1329 P HA -0.256 nan 4.420 nan 0.000 0.197 1329 P C 0.904 178.180 177.300 -0.039 0.000 1.076 1329 P CA 0.654 63.726 63.100 -0.046 0.000 0.876 1329 P CB 0.024 31.708 31.700 -0.027 0.000 0.705 1330 Q N 0.403 120.185 119.800 -0.029 0.000 2.473 1330 Q HA -0.406 3.936 4.340 0.003 0.000 0.238 1330 Q C 1.668 177.665 176.000 -0.006 0.000 1.088 1330 Q CA 2.528 58.318 55.803 -0.021 0.000 0.989 1330 Q CB -1.960 26.759 28.738 -0.033 0.000 0.972 1330 Q HN 0.178 nan 8.270 nan 0.000 0.543 1331 K N 0.469 120.850 120.400 -0.031 0.000 2.160 1331 K HA -0.146 4.176 4.320 0.003 0.000 0.206 1331 K C 2.243 178.981 176.600 0.230 0.000 1.047 1331 K CA 1.651 57.963 56.287 0.041 0.000 0.930 1331 K CB -0.430 32.018 32.500 -0.088 0.000 0.720 1331 K HN 0.446 nan 8.250 nan 0.000 0.450 1332 M N 1.768 121.493 119.600 0.209 0.000 2.128 1332 M HA -0.300 4.182 4.480 0.003 0.000 0.253 1332 M C 2.057 178.476 176.300 0.198 0.000 1.079 1332 M CA 1.896 57.408 55.300 0.354 0.000 1.082 1332 M CB -0.457 32.224 32.600 0.135 0.000 1.335 1332 M HN 0.134 nan 8.290 nan 0.000 0.401 1333 R N -0.225 120.328 120.500 0.089 0.000 2.062 1333 R HA -0.174 4.168 4.340 0.003 0.000 0.229 1333 R C 2.030 178.321 176.300 -0.015 0.000 1.128 1333 R CA 1.846 57.944 56.100 -0.003 0.000 0.960 1333 R CB -0.375 29.894 30.300 -0.052 0.000 0.855 1333 R HN 0.380 nan 8.270 nan 0.000 0.432 1334 E N 0.106 120.323 120.200 0.029 0.000 2.113 1334 E HA -0.312 4.039 4.350 0.003 0.000 0.210 1334 E C 1.805 178.391 176.600 -0.024 0.000 1.040 1334 E CA 2.141 58.544 56.400 0.006 0.000 0.847 1334 E CB -0.354 29.400 29.700 0.091 0.000 0.755 1334 E HN 0.453 nan 8.360 nan 0.000 0.459 1335 H N 0.490 119.565 119.070 0.008 0.000 2.253 1335 H HA -0.130 4.428 4.556 0.003 0.000 0.299 1335 H C 2.206 177.448 175.328 -0.143 0.000 1.064 1335 H CA 2.168 58.206 56.048 -0.016 0.000 1.264 1335 H CB -0.709 29.021 29.762 -0.055 0.000 1.371 1335 H HN 0.216 nan 8.280 nan 0.000 0.493 1336 L N 0.326 121.807 121.223 0.429 0.000 1.976 1336 L HA -0.247 4.095 4.340 0.003 0.000 0.223 1336 L C 2.710 179.536 176.870 -0.072 0.000 1.081 1336 L CA 2.141 57.151 54.840 0.282 0.000 0.784 1336 L CB -1.051 41.085 42.059 0.129 0.000 0.896 1336 L HN 0.293 nan 8.230 nan 0.000 0.438 1337 E N 0.270 120.274 120.200 -0.327 0.000 2.253 1337 E HA -0.221 4.130 4.350 0.003 0.000 0.202 1337 E C 1.955 178.293 176.600 -0.436 0.000 1.014 1337 E CA 1.441 57.510 56.400 -0.552 0.000 0.823 1337 E CB -0.137 29.244 29.700 -0.532 0.000 0.736 1337 E HN 0.461 nan 8.360 nan 0.000 0.478 1338 L N -1.488 119.430 121.223 -0.509 0.000 2.185 1338 L HA 0.120 4.462 4.340 0.003 0.000 0.198 1338 L C 0.201 176.806 176.870 -0.443 0.000 1.079 1338 L CA 0.106 54.511 54.840 -0.725 0.000 0.780 1338 L CB 0.054 41.148 42.059 -1.608 0.000 0.955 1338 L HN 0.011 nan 8.230 nan 0.000 0.462 1339 F N 0.190 120.169 119.950 0.050 0.000 2.359 1339 F HA 0.138 4.667 4.527 0.003 0.000 0.355 1339 F C 0.545 176.593 175.800 0.413 0.000 1.132 1339 F CA -1.102 57.013 58.000 0.191 0.000 1.246 1339 F CB -0.177 38.769 39.000 -0.090 0.000 1.569 1339 F HN 0.202 nan 8.300 nan 0.000 0.561 1340 W N -0.654 120.764 121.300 0.197 0.000 2.866 1340 W HA 0.203 4.864 4.660 0.003 0.000 0.258 1340 W C 1.617 178.208 176.519 0.119 0.000 1.183 1340 W CA 0.667 58.118 57.345 0.178 0.000 1.451 1340 W CB -1.171 28.394 29.460 0.175 0.000 0.959 1340 W HN 0.360 nan 8.180 nan 0.000 0.622 1341 S N 1.987 117.492 115.700 -0.325 0.000 2.335 1341 S HA -0.039 4.433 4.470 0.003 0.000 0.217 1341 S C 1.105 175.599 174.600 -0.176 0.000 1.032 1341 S CA 0.742 58.706 58.200 -0.393 0.000 0.985 1341 S CB -0.398 62.487 63.200 -0.525 0.000 0.896 1341 S HN 0.182 nan 8.310 nan 0.000 0.445 1342 R N 1.138 121.567 120.500 -0.118 0.000 3.688 1342 R HA 0.458 4.800 4.340 0.003 0.000 0.194 1342 R C -0.832 175.347 176.300 -0.201 0.000 1.677 1342 R CA -0.061 55.881 56.100 -0.264 0.000 1.351 1342 R CB 0.057 30.033 30.300 -0.540 0.000 1.338 1342 R HN 0.214 nan 8.270 nan 0.000 0.731 1343 V N 0.575 120.436 119.914 -0.090 0.000 3.121 1343 V HA 0.071 4.193 4.120 0.003 0.000 0.263 1343 V C -1.375 174.721 176.094 0.003 0.000 1.795 1343 V CA -1.129 61.173 62.300 0.004 0.000 0.979 1343 V CB 2.261 34.188 31.823 0.174 0.000 1.335 1343 V HN 0.696 nan 8.190 nan 0.000 0.462 1344 N N 2.584 121.296 118.700 0.020 0.000 2.379 1344 N HA 0.503 5.244 4.740 0.003 0.000 0.260 1344 N C 0.298 175.839 175.510 0.052 0.000 1.254 1344 N CA 0.510 53.572 53.050 0.020 0.000 0.958 1344 N CB 1.562 40.063 38.487 0.024 0.000 1.208 1344 N HN 0.723 nan 8.380 nan 0.000 0.532 1345 I N -1.510 119.106 120.570 0.076 0.000 4.547 1345 I HA 0.174 4.346 4.170 0.003 0.000 0.303 1345 I C -1.258 174.975 176.117 0.193 0.000 1.188 1345 I CA -0.416 60.980 61.300 0.160 0.000 1.320 1345 I CB -0.293 37.847 38.000 0.233 0.000 1.495 1345 I HN 0.354 nan 8.210 nan 0.000 0.462 1346 P HA -0.237 nan 4.420 nan 0.000 0.214 1346 P C 1.595 178.934 177.300 0.065 0.000 1.162 1346 P CA 1.717 64.903 63.100 0.143 0.000 0.879 1346 P CB -0.064 31.717 31.700 0.134 0.000 0.786 1347 K N 0.935 121.365 120.400 0.050 0.000 2.032 1347 K HA -0.089 4.233 4.320 0.003 0.000 0.209 1347 K C 1.992 178.593 176.600 0.003 0.000 1.048 1347 K CA 1.482 57.784 56.287 0.024 0.000 0.927 1347 K CB -1.223 31.293 32.500 0.025 0.000 0.712 1347 K HN -0.035 nan 8.250 nan 0.000 0.441 1348 V N 2.374 122.291 119.914 0.005 0.000 2.380 1348 V HA -0.256 3.865 4.120 0.003 0.000 0.251 1348 V C 2.583 178.637 176.094 -0.066 0.000 1.063 1348 V CA 1.694 63.978 62.300 -0.027 0.000 1.055 1348 V CB -0.472 31.343 31.823 -0.012 0.000 0.657 1348 V HN 0.289 nan 8.190 nan 0.000 0.455 1349 L N -0.746 120.443 121.223 -0.055 0.000 2.353 1349 L HA -0.117 4.225 4.340 0.003 0.000 0.220 1349 L C 2.176 179.000 176.870 -0.077 0.000 1.133 1349 L CA 0.983 55.772 54.840 -0.085 0.000 0.798 1349 L CB -0.286 41.745 42.059 -0.046 0.000 0.922 1349 L HN 0.221 nan 8.230 nan 0.000 0.445 1350 R N -0.660 119.804 120.500 -0.060 0.000 2.466 1350 R HA 0.225 4.567 4.340 0.003 0.000 0.279 1350 R C 0.831 177.073 176.300 -0.096 0.000 0.976 1350 R CA 0.489 56.550 56.100 -0.065 0.000 1.081 1350 R CB 0.242 30.522 30.300 -0.033 0.000 1.215 1350 R HN 0.166 nan 8.270 nan 0.000 0.546 1351 A N -1.946 120.800 122.820 -0.122 0.000 2.474 1351 A HA 0.509 4.830 4.320 0.003 0.000 0.221 1351 A C 1.332 178.794 177.584 -0.204 0.000 1.298 1351 A CA 0.460 52.404 52.037 -0.155 0.000 1.008 1351 A CB 0.316 19.247 19.000 -0.115 0.000 1.217 1351 A HN 0.206 nan 8.150 nan 0.000 0.553 1352 A N 0.202 122.905 122.820 -0.195 0.000 1.944 1352 A HA 0.282 4.604 4.320 0.003 0.000 0.209 1352 A C 1.529 178.934 177.584 -0.297 0.000 1.328 1352 A CA 1.162 53.057 52.037 -0.237 0.000 0.693 1352 A CB -0.244 18.623 19.000 -0.222 0.000 0.994 1352 A HN 0.213 nan 8.150 nan 0.000 0.485 1353 E N -0.064 119.997 120.200 -0.230 0.000 2.478 1353 E HA -0.109 4.242 4.350 0.003 0.000 0.198 1353 E C 1.654 178.041 176.600 -0.356 0.000 1.046 1353 E CA 1.096 57.360 56.400 -0.226 0.000 0.870 1353 E CB -0.054 29.602 29.700 -0.072 0.000 0.818 1353 E HN 0.752 nan 8.360 nan 0.000 0.527 1354 Q N 0.051 119.655 119.800 -0.326 0.000 2.320 1354 Q HA 0.276 4.618 4.340 0.003 0.000 0.201 1354 Q C -0.644 175.099 176.000 -0.427 0.000 0.910 1354 Q CA 0.103 55.708 55.803 -0.330 0.000 0.946 1354 Q CB 0.709 29.315 28.738 -0.219 0.000 1.062 1354 Q HN 0.022 nan 8.270 nan 0.000 0.503 1355 A N 0.377 122.892 122.820 -0.509 0.000 2.480 1355 A HA 0.388 4.709 4.320 0.003 0.000 0.289 1355 A C -1.387 175.860 177.584 -0.562 0.000 1.044 1355 A CA -0.784 50.974 52.037 -0.466 0.000 0.761 1355 A CB 0.469 19.261 19.000 -0.348 0.000 1.289 1355 A HN 0.383 nan 8.150 nan 0.000 0.401 1356 H N 3.600 122.415 119.070 -0.425 0.000 2.989 1356 H HA 0.152 4.710 4.556 0.003 0.000 0.284 1356 H C 0.306 175.178 175.328 -0.760 0.000 1.440 1356 H CA -0.018 55.544 56.048 -0.810 0.000 1.209 1356 H CB -0.247 29.135 29.762 -0.634 0.000 1.453 1356 H HN 0.514 nan 8.280 nan 0.000 0.550 1357 L N 0.215 121.205 121.223 -0.389 0.000 2.930 1357 L HA -0.007 4.335 4.340 0.003 0.000 0.250 1357 L C 0.978 177.794 176.870 -0.090 0.000 1.320 1357 L CA -0.281 54.453 54.840 -0.175 0.000 1.163 1357 L CB -0.690 41.295 42.059 -0.123 0.000 1.542 1357 L HN 0.423 nan 8.230 nan 0.000 0.428 1358 W N 0.659 121.959 121.300 -0.000 0.000 2.231 1358 W HA -0.421 4.240 4.660 0.003 0.000 0.323 1358 W C 2.526 179.084 176.519 0.065 0.000 1.306 1358 W CA 1.204 58.553 57.345 0.006 0.000 1.323 1358 W CB -0.691 28.765 29.460 -0.006 0.000 1.120 1358 W HN 0.440 nan 8.180 nan 0.000 0.503 1359 A N 0.379 123.394 122.820 0.326 0.000 1.869 1359 A HA -0.293 4.028 4.320 0.003 0.000 0.218 1359 A C 1.797 179.471 177.584 0.151 0.000 1.203 1359 A CA 2.469 54.629 52.037 0.205 0.000 0.638 1359 A CB -0.792 18.292 19.000 0.139 0.000 0.831 1359 A HN 0.346 nan 8.150 nan 0.000 0.450 1360 E N -0.623 119.632 120.200 0.090 0.000 2.102 1360 E HA 0.079 4.430 4.350 0.003 0.000 0.190 1360 E C 1.930 178.561 176.600 0.052 0.000 0.971 1360 E CA 0.532 56.963 56.400 0.053 0.000 0.821 1360 E CB -0.420 29.279 29.700 -0.003 0.000 0.777 1360 E HN 0.554 nan 8.360 nan 0.000 0.460 1361 L N 0.505 121.722 121.223 -0.010 0.000 2.129 1361 L HA -0.197 4.145 4.340 0.003 0.000 0.212 1361 L C 1.691 178.504 176.870 -0.095 0.000 1.087 1361 L CA 1.043 55.804 54.840 -0.131 0.000 0.757 1361 L CB 0.021 41.968 42.059 -0.186 0.000 0.896 1361 L HN 0.059 nan 8.230 nan 0.000 0.434 1362 V N -0.653 119.374 119.914 0.188 0.000 2.346 1362 V HA -0.279 3.843 4.120 0.003 0.000 0.244 1362 V C 2.167 178.382 176.094 0.203 0.000 1.037 1362 V CA 1.870 64.373 62.300 0.339 0.000 1.029 1362 V CB -0.737 31.286 31.823 0.333 0.000 0.663 1362 V HN 0.469 nan 8.190 nan 0.000 0.454 1363 F N 0.697 120.660 119.950 0.023 0.000 2.154 1363 F HA -0.244 4.285 4.527 0.003 0.000 0.301 1363 F C 2.019 177.789 175.800 -0.051 0.000 1.087 1363 F CA 1.666 59.645 58.000 -0.034 0.000 1.274 1363 F CB -0.225 38.732 39.000 -0.072 0.000 1.009 1363 F HN 0.041 nan 8.300 nan 0.000 0.485 1364 L N -1.149 120.119 121.223 0.075 0.000 1.956 1364 L HA -0.303 4.039 4.340 0.003 0.000 0.216 1364 L C 2.422 179.263 176.870 -0.049 0.000 1.073 1364 L CA 1.782 56.614 54.840 -0.015 0.000 0.762 1364 L CB -1.546 40.402 42.059 -0.185 0.000 0.889 1364 L HN 0.102 nan 8.230 nan 0.000 0.433 1365 Y N 0.546 120.833 120.300 -0.021 0.000 2.102 1365 Y HA -0.349 4.202 4.550 0.003 0.000 0.280 1365 Y C 2.441 178.218 175.900 -0.204 0.000 1.178 1365 Y CA 1.648 59.679 58.100 -0.115 0.000 1.146 1365 Y CB -1.021 37.357 38.460 -0.136 0.000 0.968 1365 Y HN 0.362 nan 8.280 nan 0.000 0.504 1366 D N 0.074 120.387 120.400 -0.144 0.000 2.156 1366 D HA -0.212 4.430 4.640 0.003 0.000 0.190 1366 D C 1.932 177.971 176.300 -0.436 0.000 0.998 1366 D CA 2.076 55.823 54.000 -0.422 0.000 0.842 1366 D CB -0.015 40.493 40.800 -0.486 0.000 0.974 1366 D HN -0.023 nan 8.370 nan 0.000 0.447 1367 K N -0.725 119.438 120.400 -0.394 0.000 2.147 1367 K HA -0.165 4.157 4.320 0.003 0.000 0.205 1367 K C 2.173 178.779 176.600 0.011 0.000 1.049 1367 K CA 0.653 56.850 56.287 -0.151 0.000 0.936 1367 K CB -0.841 31.650 32.500 -0.014 0.000 0.722 1367 K HN 0.414 nan 8.250 nan 0.000 0.446 1368 Y N 1.930 122.171 120.300 -0.098 0.000 2.403 1368 Y HA -0.210 4.342 4.550 0.003 0.000 0.291 1368 Y C 0.091 175.943 175.900 -0.079 0.000 1.143 1368 Y CA 1.411 59.487 58.100 -0.040 0.000 1.257 1368 Y CB 0.074 38.530 38.460 -0.007 0.000 0.984 1368 Y HN 0.251 nan 8.280 nan 0.000 0.550 1369 E N -1.028 119.167 120.200 -0.009 0.000 3.547 1369 E HA -0.202 4.150 4.350 0.003 0.000 0.309 1369 E C -0.085 176.470 176.600 -0.076 0.000 0.855 1369 E CA 0.729 57.023 56.400 -0.176 0.000 1.122 1369 E CB -1.403 28.343 29.700 0.076 0.000 1.569 1369 E HN 0.401 nan 8.360 nan 0.000 0.429 1370 E N -0.141 120.031 120.200 -0.047 0.000 2.320 1370 E HA 0.062 4.413 4.350 0.003 0.000 0.234 1370 E C 0.322 176.865 176.600 -0.095 0.000 1.290 1370 E CA -0.075 56.303 56.400 -0.036 0.000 1.545 1370 E CB -0.279 29.334 29.700 -0.144 0.000 1.379 1370 E HN 0.419 nan 8.360 nan 0.000 0.437 1371 Y N 1.805 122.079 120.300 -0.044 0.000 2.073 1371 Y HA -0.388 4.163 4.550 0.003 0.000 0.270 1371 Y C 2.240 178.023 175.900 -0.195 0.000 1.226 1371 Y CA 1.791 59.821 58.100 -0.118 0.000 1.117 1371 Y CB -0.635 37.751 38.460 -0.124 0.000 0.939 1371 Y HN 0.292 nan 8.280 nan 0.000 0.504 1372 D N -0.465 119.946 120.400 0.018 0.000 2.200 1372 D HA -0.252 4.390 4.640 0.003 0.000 0.192 1372 D C 1.326 177.521 176.300 -0.175 0.000 1.008 1372 D CA 2.169 56.108 54.000 -0.101 0.000 0.872 1372 D CB -0.835 39.920 40.800 -0.075 0.000 0.923 1372 D HN 0.414 nan 8.370 nan 0.000 0.447 1373 N N 0.371 118.914 118.700 -0.261 0.000 2.305 1373 N HA 0.119 4.861 4.740 0.003 0.000 0.179 1373 N C 1.977 177.188 175.510 -0.500 0.000 1.019 1373 N CA 1.235 54.003 53.050 -0.469 0.000 0.869 1373 N CB -0.355 37.653 38.487 -0.799 0.000 1.000 1373 N HN 0.352 nan 8.380 nan 0.000 0.431 1374 A N 2.209 124.814 122.820 -0.358 0.000 1.883 1374 A HA -0.108 4.213 4.320 0.003 0.000 0.217 1374 A C 2.146 179.693 177.584 -0.060 0.000 1.186 1374 A CA 0.993 52.992 52.037 -0.062 0.000 0.624 1374 A CB -0.545 18.455 19.000 0.000 0.000 0.822 1374 A HN 0.099 nan 8.150 nan 0.000 0.444 1375 I N 0.197 120.666 120.570 -0.168 0.000 2.208 1375 I HA -0.238 3.934 4.170 0.003 0.000 0.245 1375 I C 2.400 178.458 176.117 -0.099 0.000 1.097 1375 I CA 1.411 62.526 61.300 -0.307 0.000 1.363 1375 I CB -1.053 36.675 38.000 -0.453 0.000 1.051 1375 I HN 0.343 nan 8.210 nan 0.000 0.413 1376 I N 0.655 121.167 120.570 -0.096 0.000 2.335 1376 I HA -0.268 3.904 4.170 0.003 0.000 0.251 1376 I C 1.917 178.044 176.117 0.017 0.000 1.129 1376 I CA 1.335 62.603 61.300 -0.054 0.000 1.402 1376 I CB -0.726 37.230 38.000 -0.073 0.000 1.069 1376 I HN 0.194 nan 8.210 nan 0.000 0.424 1377 T N 0.589 115.227 114.554 0.140 0.000 3.139 1377 T HA -0.023 4.329 4.350 0.003 0.000 0.267 1377 T C 1.230 176.053 174.700 0.205 0.000 1.164 1377 T CA 0.922 63.272 62.100 0.416 0.000 1.075 1377 T CB -0.255 68.922 68.868 0.516 0.000 0.904 1377 T HN 0.361 nan 8.240 nan 0.000 0.540 1378 M N -0.358 119.250 119.600 0.012 0.000 2.596 1378 M HA 0.427 4.909 4.480 0.003 0.000 0.364 1378 M C 1.113 177.040 176.300 -0.621 0.000 1.158 1378 M CA -0.017 55.189 55.300 -0.155 0.000 0.940 1378 M CB 0.314 33.052 32.600 0.230 0.000 1.388 1378 M HN 0.183 nan 8.290 nan 0.000 0.522 1379 M N -1.007 118.281 119.600 -0.519 0.000 2.800 1379 M HA 0.168 4.649 4.480 0.003 0.000 0.257 1379 M C 0.822 176.803 176.300 -0.531 0.000 1.309 1379 M CA 1.091 56.086 55.300 -0.508 0.000 1.202 1379 M CB 0.260 32.689 32.600 -0.284 0.000 1.273 1379 M HN 0.282 nan 8.290 nan 0.000 0.528 1380 N N -0.249 117.911 118.700 -0.900 0.000 2.200 1380 N HA 0.104 4.846 4.740 0.003 0.000 0.224 1380 N C -0.628 174.084 175.510 -1.330 0.000 1.179 1380 N CA -0.023 52.449 53.050 -0.963 0.000 0.877 1380 N CB 0.703 38.677 38.487 -0.854 0.000 1.072 1380 N HN 0.296 nan 8.380 nan 0.000 0.519 1381 H N -1.482 117.188 119.070 -0.666 0.000 2.947 1381 H HA 0.203 4.761 4.556 0.003 0.000 0.222 1381 H C -2.340 172.744 175.328 -0.407 0.000 1.414 1381 H CA -1.282 54.267 56.048 -0.832 0.000 1.224 1381 H CB 0.543 29.216 29.762 -1.815 0.000 2.100 1381 H HN 0.061 nan 8.280 nan 0.000 0.524 1382 P HA -0.172 nan 4.420 nan 0.000 0.199 1382 P C 1.858 179.230 177.300 0.120 0.000 1.085 1382 P CA 2.477 65.572 63.100 -0.008 0.000 0.924 1382 P CB -0.114 31.645 31.700 0.099 0.000 0.736 1383 T N -2.807 111.796 114.554 0.082 0.000 2.836 1383 T HA -0.242 4.109 4.350 0.003 0.000 0.268 1383 T C 1.367 176.172 174.700 0.174 0.000 1.080 1383 T CA 2.072 64.255 62.100 0.138 0.000 1.128 1383 T CB -1.269 67.641 68.868 0.071 0.000 0.839 1383 T HN 0.135 nan 8.240 nan 0.000 0.507 1384 D N 0.959 121.446 120.400 0.145 0.000 2.162 1384 D HA 0.342 4.983 4.640 0.003 0.000 0.205 1384 D C 2.093 178.527 176.300 0.223 0.000 0.964 1384 D CA 1.021 55.128 54.000 0.178 0.000 0.847 1384 D CB -0.065 40.831 40.800 0.160 0.000 0.988 1384 D HN 0.499 nan 8.370 nan 0.000 0.480 1385 A N -1.172 121.792 122.820 0.241 0.000 2.140 1385 A HA 0.166 4.487 4.320 0.003 0.000 0.199 1385 A C 0.203 177.944 177.584 0.263 0.000 1.416 1385 A CA -0.518 51.670 52.037 0.253 0.000 1.018 1385 A CB -0.607 18.575 19.000 0.302 0.000 1.117 1385 A HN 0.314 nan 8.150 nan 0.000 0.480 1386 W N 2.010 123.378 121.300 0.113 0.000 2.345 1386 W HA 0.239 4.900 4.660 0.003 0.000 0.346 1386 W C 0.025 176.638 176.519 0.156 0.000 1.243 1386 W CA 1.207 58.639 57.345 0.145 0.000 1.327 1386 W CB 0.355 29.889 29.460 0.124 0.000 1.187 1386 W HN 0.082 nan 8.180 nan 0.000 0.588 1387 K N 5.508 125.432 120.400 -0.794 0.000 3.200 1387 K HA -0.011 4.310 4.320 0.003 0.000 0.179 1387 K C 0.373 176.385 176.600 -0.980 0.000 1.153 1387 K CA 0.131 55.965 56.287 -0.755 0.000 0.836 1387 K CB 0.912 33.254 32.500 -0.264 0.000 1.051 1387 K HN 0.761 nan 8.250 nan 0.000 0.594 1388 E N 0.557 119.610 120.200 -1.912 0.000 3.567 1388 E HA -0.367 3.985 4.350 0.003 0.000 0.471 1388 E C 1.196 177.694 176.600 -0.170 0.000 1.627 1388 E CA 2.677 58.606 56.400 -0.784 0.000 1.218 1388 E CB -1.215 28.282 29.700 -0.338 0.000 1.214 1388 E HN 0.587 nan 8.360 nan 0.000 0.385 1389 G N -0.639 108.101 108.800 -0.099 0.000 2.572 1389 G HA2 -0.204 3.758 3.960 0.003 0.000 0.216 1389 G HA3 -0.204 3.758 3.960 0.003 0.000 0.216 1389 G C 1.313 176.234 174.900 0.035 0.000 1.133 1389 G CA 0.883 45.995 45.100 0.021 0.000 0.791 1389 G HN 0.448 nan 8.290 nan 0.000 0.538 1390 Q N -0.420 119.351 119.800 -0.049 0.000 2.268 1390 Q HA -0.166 4.176 4.340 0.003 0.000 0.210 1390 Q C 1.814 177.875 176.000 0.102 0.000 0.988 1390 Q CA 1.349 57.151 55.803 -0.002 0.000 0.883 1390 Q CB -0.391 28.311 28.738 -0.061 0.000 0.911 1390 Q HN 0.489 nan 8.270 nan 0.000 0.430 1391 F N -0.122 119.848 119.950 0.032 0.000 2.664 1391 F HA 0.159 4.688 4.527 0.003 0.000 0.296 1391 F C 1.419 177.261 175.800 0.071 0.000 1.125 1391 F CA 0.661 58.748 58.000 0.145 0.000 1.444 1391 F CB 0.236 39.491 39.000 0.425 0.000 1.114 1391 F HN -0.062 nan 8.300 nan 0.000 0.576 1392 K N -0.227 120.331 120.400 0.264 0.000 2.217 1392 K HA -0.090 4.232 4.320 0.003 0.000 0.202 1392 K C 0.657 177.294 176.600 0.061 0.000 1.051 1392 K CA 1.263 57.641 56.287 0.152 0.000 0.952 1392 K CB -0.063 32.499 32.500 0.105 0.000 0.736 1392 K HN 0.244 nan 8.250 nan 0.000 0.453 1393 D N 0.111 120.533 120.400 0.037 0.000 2.363 1393 D HA 0.047 4.689 4.640 0.003 0.000 0.214 1393 D C 1.255 177.551 176.300 -0.007 0.000 1.093 1393 D CA 0.284 54.293 54.000 0.014 0.000 0.837 1393 D CB 0.541 41.361 40.800 0.033 0.000 0.948 1393 D HN 0.089 nan 8.370 nan 0.000 0.507 1394 I N 0.110 120.653 120.570 -0.045 0.000 2.899 1394 I HA -0.030 4.142 4.170 0.003 0.000 0.257 1394 I C 2.371 178.304 176.117 -0.306 0.000 1.115 1394 I CA 0.054 61.347 61.300 -0.012 0.000 1.451 1394 I CB -0.846 37.196 38.000 0.069 0.000 1.251 1394 I HN -0.104 nan 8.210 nan 0.000 0.456 1395 I N 1.791 122.196 120.570 -0.276 0.000 2.143 1395 I HA -0.365 3.806 4.170 0.003 0.000 0.245 1395 I C 2.437 178.508 176.117 -0.078 0.000 1.068 1395 I CA 1.934 63.075 61.300 -0.265 0.000 1.326 1395 I CB -0.450 37.463 38.000 -0.144 0.000 1.028 1395 I HN 0.169 nan 8.210 nan 0.000 0.412 1396 T N 0.613 115.133 114.554 -0.057 0.000 2.897 1396 T HA -0.139 4.212 4.350 0.003 0.000 0.271 1396 T C 1.335 175.937 174.700 -0.163 0.000 1.084 1396 T CA 1.071 63.142 62.100 -0.048 0.000 1.123 1396 T CB -0.146 68.687 68.868 -0.059 0.000 0.865 1396 T HN 0.186 nan 8.240 nan 0.000 0.496 1397 K N 1.528 121.675 120.400 -0.422 0.000 2.577 1397 K HA 0.316 4.638 4.320 0.003 0.000 0.210 1397 K C -0.286 176.074 176.600 -0.400 0.000 1.048 1397 K CA -0.029 55.937 56.287 -0.535 0.000 1.188 1397 K CB 0.244 32.119 32.500 -1.043 0.000 0.910 1397 K HN 0.212 nan 8.250 nan 0.000 0.483 1398 V N 0.126 119.918 119.914 -0.203 0.000 2.732 1398 V HA 0.381 4.502 4.120 0.003 0.000 0.310 1398 V C 1.103 177.201 176.094 0.007 0.000 1.053 1398 V CA -0.480 61.774 62.300 -0.077 0.000 0.957 1398 V CB 1.732 33.486 31.823 -0.114 0.000 1.018 1398 V HN 0.194 nan 8.190 nan 0.000 0.452 1399 A N 2.182 125.013 122.820 0.019 0.000 2.169 1399 A HA 0.159 4.481 4.320 0.003 0.000 0.210 1399 A C 0.975 178.589 177.584 0.051 0.000 1.168 1399 A CA 0.312 52.369 52.037 0.034 0.000 0.813 1399 A CB -0.137 18.880 19.000 0.029 0.000 0.861 1399 A HN 0.728 nan 8.150 nan 0.000 0.481 1400 N N 0.837 119.565 118.700 0.047 0.000 2.437 1400 N HA 0.248 4.989 4.740 0.003 0.000 0.259 1400 N C 0.357 175.937 175.510 0.116 0.000 0.983 1400 N CA -0.061 53.021 53.050 0.053 0.000 0.937 1400 N CB 1.738 40.231 38.487 0.009 0.000 1.122 1400 N HN -0.069 nan 8.380 nan 0.000 0.499 1401 V N 2.657 122.655 119.914 0.140 0.000 3.461 1401 V HA -0.031 4.090 4.120 0.003 0.000 0.267 1401 V C 2.281 178.261 176.094 -0.189 0.000 1.186 1401 V CA 0.432 62.837 62.300 0.174 0.000 1.154 1401 V CB -0.434 31.389 31.823 -0.000 0.000 0.802 1401 V HN 0.666 nan 8.190 nan 0.000 0.474 1402 E N 1.363 121.505 120.200 -0.097 0.000 2.031 1402 E HA -0.216 4.135 4.350 0.003 0.000 0.193 1402 E C 2.217 178.654 176.600 -0.271 0.000 0.994 1402 E CA 1.282 57.618 56.400 -0.106 0.000 0.800 1402 E CB -0.359 29.401 29.700 0.099 0.000 0.752 1402 E HN 0.422 nan 8.360 nan 0.000 0.447 1403 L N 0.997 122.091 121.223 -0.214 0.000 2.064 1403 L HA -0.267 4.074 4.340 0.003 0.000 0.216 1403 L C 2.108 178.816 176.870 -0.270 0.000 1.077 1403 L CA 1.995 56.691 54.840 -0.240 0.000 0.766 1403 L CB -1.392 40.474 42.059 -0.321 0.000 0.890 1403 L HN 0.183 nan 8.230 nan 0.000 0.435 1404 Y N -0.381 119.704 120.300 -0.359 0.000 2.014 1404 Y HA -0.349 4.203 4.550 0.003 0.000 0.270 1404 Y C 2.638 178.400 175.900 -0.229 0.000 1.145 1404 Y CA 2.463 60.381 58.100 -0.304 0.000 1.106 1404 Y CB -1.472 36.725 38.460 -0.438 0.000 0.968 1404 Y HN 0.180 nan 8.280 nan 0.000 0.484 1405 Y N -0.225 120.142 120.300 0.111 0.000 2.062 1405 Y HA -0.343 4.209 4.550 0.003 0.000 0.276 1405 Y C 2.608 178.420 175.900 -0.146 0.000 1.189 1405 Y CA 1.580 59.636 58.100 -0.073 0.000 1.130 1405 Y CB -1.298 37.107 38.460 -0.092 0.000 0.959 1405 Y HN 0.090 nan 8.280 nan 0.000 0.499 1406 R N 0.815 121.345 120.500 0.050 0.000 2.120 1406 R HA -0.124 4.217 4.340 0.003 0.000 0.234 1406 R C 2.291 178.596 176.300 0.007 0.000 1.123 1406 R CA 1.044 57.139 56.100 -0.008 0.000 0.975 1406 R CB -0.399 29.903 30.300 0.004 0.000 0.866 1406 R HN 0.391 nan 8.270 nan 0.000 0.446 1407 A N 1.839 124.686 122.820 0.045 0.000 1.858 1407 A HA -0.153 4.169 4.320 0.003 0.000 0.216 1407 A C 2.021 179.721 177.584 0.194 0.000 1.190 1407 A CA 1.345 53.472 52.037 0.150 0.000 0.617 1407 A CB -0.508 18.619 19.000 0.212 0.000 0.827 1407 A HN 0.291 nan 8.150 nan 0.000 0.443 1408 I N 0.426 121.057 120.570 0.101 0.000 2.285 1408 I HA -0.367 3.805 4.170 0.003 0.000 0.253 1408 I C 2.534 178.678 176.117 0.045 0.000 1.104 1408 I CA 2.198 63.532 61.300 0.056 0.000 1.372 1408 I CB -1.523 36.421 38.000 -0.094 0.000 1.057 1408 I HN 0.633 nan 8.210 nan 0.000 0.431 1409 Q N 0.579 120.375 119.800 -0.006 0.000 1.967 1409 Q HA -0.267 4.074 4.340 0.003 0.000 0.202 1409 Q C 2.430 178.445 176.000 0.025 0.000 0.985 1409 Q CA 1.951 57.747 55.803 -0.011 0.000 0.839 1409 Q CB -0.389 28.348 28.738 -0.001 0.000 0.906 1409 Q HN 0.423 nan 8.270 nan 0.000 0.423 1410 F N -0.449 119.404 119.950 -0.161 0.000 2.307 1410 F HA -0.238 4.291 4.527 0.003 0.000 0.301 1410 F C 0.702 176.152 175.800 -0.582 0.000 1.076 1410 F CA 1.384 59.140 58.000 -0.408 0.000 1.383 1410 F CB 0.126 38.735 39.000 -0.652 0.000 1.055 1410 F HN 0.199 nan 8.300 nan 0.000 0.526 1411 Y N -2.456 117.789 120.300 -0.091 0.000 2.664 1411 Y HA 0.125 4.677 4.550 0.003 0.000 0.278 1411 Y C 1.652 177.503 175.900 -0.082 0.000 1.130 1411 Y CA 0.185 58.210 58.100 -0.124 0.000 1.260 1411 Y CB -0.595 37.837 38.460 -0.046 0.000 1.369 1411 Y HN 0.012 nan 8.280 nan 0.000 0.499 1412 L N 0.330 121.628 121.223 0.125 0.000 2.102 1412 L HA 0.028 4.370 4.340 0.003 0.000 0.202 1412 L C 2.057 178.897 176.870 -0.050 0.000 1.076 1412 L CA 1.653 56.522 54.840 0.048 0.000 0.761 1412 L CB -0.603 41.474 42.059 0.031 0.000 0.921 1412 L HN -0.000 nan 8.230 nan 0.000 0.444 1413 E N -0.120 120.020 120.200 -0.101 0.000 2.068 1413 E HA -0.271 4.080 4.350 0.003 0.000 0.207 1413 E C 1.939 178.161 176.600 -0.631 0.000 1.032 1413 E CA 2.405 58.612 56.400 -0.323 0.000 0.839 1413 E CB -0.374 29.180 29.700 -0.243 0.000 0.758 1413 E HN 0.612 nan 8.360 nan 0.000 0.457 1414 F N -0.927 118.935 119.950 -0.146 0.000 2.819 1414 F HA 0.191 4.719 4.527 0.003 0.000 0.325 1414 F C 0.781 176.471 175.800 -0.184 0.000 1.041 1414 F CA -0.594 57.303 58.000 -0.172 0.000 1.184 1414 F CB 0.402 39.261 39.000 -0.236 0.000 1.019 1414 F HN -0.259 nan 8.300 nan 0.000 0.590 1415 K N 3.507 123.872 120.400 -0.058 0.000 2.228 1415 K HA 0.228 4.549 4.320 0.003 0.000 0.284 1415 K C -2.584 174.027 176.600 0.018 0.000 1.088 1415 K CA -2.026 54.215 56.287 -0.077 0.000 0.941 1415 K CB 0.253 32.673 32.500 -0.133 0.000 1.158 1415 K HN -0.034 nan 8.250 nan 0.000 0.438 1416 P HA -0.075 nan 4.420 nan 0.000 0.273 1416 P C -0.354 176.981 177.300 0.058 0.000 1.324 1416 P CA -0.582 62.540 63.100 0.037 0.000 0.728 1416 P CB 0.174 31.888 31.700 0.023 0.000 1.614 1417 L N 1.903 123.156 121.223 0.051 0.000 2.747 1417 L HA -0.151 4.190 4.340 0.003 0.000 0.286 1417 L C 0.998 177.918 176.870 0.083 0.000 1.216 1417 L CA 1.444 56.320 54.840 0.059 0.000 0.930 1417 L CB -1.484 40.605 42.059 0.050 0.000 1.216 1417 L HN 0.353 nan 8.230 nan 0.000 0.486 1418 L N 2.667 123.942 121.223 0.087 0.000 4.696 1418 L HA -0.296 4.046 4.340 0.003 0.000 0.398 1418 L C 0.947 177.895 176.870 0.130 0.000 0.971 1418 L CA 0.593 55.500 54.840 0.111 0.000 1.427 1418 L CB -1.063 41.089 42.059 0.154 0.000 1.965 1418 L HN 0.672 nan 8.230 nan 0.000 0.593 1419 L N -1.886 119.403 121.223 0.111 0.000 2.286 1419 L HA 0.160 4.501 4.340 0.003 0.000 0.203 1419 L C 1.701 178.606 176.870 0.059 0.000 1.068 1419 L CA 1.906 56.806 54.840 0.101 0.000 0.811 1419 L CB -0.319 41.811 42.059 0.118 0.000 0.989 1419 L HN 0.218 nan 8.230 nan 0.000 0.467 1420 N N 0.196 118.933 118.700 0.062 0.000 2.120 1420 N HA -0.197 4.545 4.740 0.003 0.000 0.188 1420 N C 0.951 176.502 175.510 0.069 0.000 1.024 1420 N CA 1.542 54.626 53.050 0.057 0.000 0.852 1420 N CB -0.227 38.300 38.487 0.066 0.000 1.003 1420 N HN 0.463 nan 8.380 nan 0.000 0.424 1421 D N 1.074 121.513 120.400 0.066 0.000 2.263 1421 D HA -0.113 4.528 4.640 0.003 0.000 0.208 1421 D C 1.883 178.213 176.300 0.051 0.000 0.971 1421 D CA 0.297 54.334 54.000 0.062 0.000 0.867 1421 D CB -0.083 40.755 40.800 0.063 0.000 0.929 1421 D HN 0.181 nan 8.370 nan 0.000 0.492 1422 L N 0.385 121.629 121.223 0.034 0.000 2.141 1422 L HA -0.052 4.289 4.340 0.003 0.000 0.209 1422 L C 1.481 178.361 176.870 0.017 0.000 1.094 1422 L CA 1.387 56.221 54.840 -0.010 0.000 0.763 1422 L CB -0.542 41.465 42.059 -0.087 0.000 0.908 1422 L HN 0.141 nan 8.230 nan 0.000 0.437 1423 L N -0.865 120.382 121.223 0.041 0.000 2.376 1423 L HA -0.168 4.174 4.340 0.003 0.000 0.219 1423 L C 2.457 179.396 176.870 0.115 0.000 1.133 1423 L CA 0.240 55.122 54.840 0.070 0.000 0.816 1423 L CB -0.465 41.638 42.059 0.072 0.000 0.933 1423 L HN 0.239 nan 8.230 nan 0.000 0.449 1424 M N 0.283 119.938 119.600 0.092 0.000 2.200 1424 M HA -0.190 4.292 4.480 0.003 0.000 0.261 1424 M C 2.443 178.777 176.300 0.056 0.000 1.074 1424 M CA 2.359 57.706 55.300 0.078 0.000 1.098 1424 M CB -0.956 31.680 32.600 0.061 0.000 1.268 1424 M HN 0.164 nan 8.290 nan 0.000 0.432 1425 V N -1.028 118.912 119.914 0.043 0.000 2.233 1425 V HA -0.330 3.792 4.120 0.003 0.000 0.252 1425 V C 2.223 178.326 176.094 0.014 0.000 1.063 1425 V CA 2.397 64.715 62.300 0.030 0.000 1.032 1425 V CB -1.746 30.095 31.823 0.031 0.000 0.645 1425 V HN 0.594 nan 8.190 nan 0.000 0.446 1426 L N 0.555 121.782 121.223 0.006 0.000 2.034 1426 L HA -0.247 4.095 4.340 0.003 0.000 0.217 1426 L C 2.625 179.457 176.870 -0.063 0.000 1.077 1426 L CA 1.959 56.766 54.840 -0.055 0.000 0.769 1426 L CB -1.433 40.582 42.059 -0.073 0.000 0.890 1426 L HN 0.509 nan 8.230 nan 0.000 0.435 1427 S N -0.610 115.088 115.700 -0.003 0.000 1.978 1427 S HA -0.258 4.213 4.470 0.003 0.000 0.533 1427 S C -1.412 173.196 174.600 0.012 0.000 0.920 1427 S CA 1.736 59.958 58.200 0.037 0.000 3.354 1427 S CB -2.539 60.701 63.200 0.066 0.000 2.336 1427 S HN 0.313 nan 8.310 nan 0.000 0.579 1428 P HA 0.231 nan 4.420 nan 0.000 0.262 1428 P C 0.436 177.719 177.300 -0.027 0.000 1.199 1428 P CA 0.832 63.954 63.100 0.035 0.000 0.763 1428 P CB 0.197 31.914 31.700 0.029 0.000 0.790 1429 R N 0.785 121.276 120.500 -0.016 0.000 3.591 1429 R HA -0.151 4.191 4.340 0.003 0.000 0.323 1429 R C -1.312 174.900 176.300 -0.147 0.000 1.141 1429 R CA 0.104 56.165 56.100 -0.066 0.000 0.834 1429 R CB -1.721 28.500 30.300 -0.133 0.000 1.453 1429 R HN 0.373 nan 8.270 nan 0.000 0.479 1430 L N -0.118 121.013 121.223 -0.154 0.000 2.301 1430 L HA 0.596 4.938 4.340 0.003 0.000 0.264 1430 L C 0.156 176.933 176.870 -0.154 0.000 1.016 1430 L CA -0.099 54.625 54.840 -0.193 0.000 0.821 1430 L CB 1.928 43.783 42.059 -0.341 0.000 1.346 1430 L HN 0.101 nan 8.230 nan 0.000 0.429 1431 D N -0.389 119.949 120.400 -0.103 0.000 2.398 1431 D HA 0.132 4.774 4.640 0.003 0.000 0.210 1431 D C 0.778 177.109 176.300 0.051 0.000 1.094 1431 D CA 0.481 54.478 54.000 -0.004 0.000 0.839 1431 D CB 0.130 40.935 40.800 0.007 0.000 0.963 1431 D HN 0.606 nan 8.370 nan 0.000 0.506 1432 H N -0.405 118.644 119.070 -0.034 0.000 5.363 1432 H HA -0.259 4.298 4.556 0.003 0.000 0.065 1432 H C 1.550 176.899 175.328 0.034 0.000 0.517 1432 H CA 2.266 58.318 56.048 0.005 0.000 1.053 1432 H CB -1.438 28.248 29.762 -0.126 0.000 0.554 1432 H HN 0.200 nan 8.280 nan 0.000 0.717 1433 T N 1.091 115.723 114.554 0.130 0.000 2.778 1433 T HA -0.174 4.178 4.350 0.003 0.000 0.269 1433 T C 1.701 176.432 174.700 0.051 0.000 1.050 1433 T CA 1.660 63.808 62.100 0.081 0.000 1.137 1433 T CB -0.203 68.698 68.868 0.055 0.000 0.860 1433 T HN 0.348 nan 8.240 nan 0.000 0.468 1434 R N 0.173 120.675 120.500 0.003 0.000 2.893 1434 R HA 0.496 4.838 4.340 0.003 0.000 0.317 1434 R C 0.811 177.083 176.300 -0.047 0.000 1.239 1434 R CA 0.038 56.095 56.100 -0.071 0.000 1.128 1434 R CB -0.131 30.040 30.300 -0.215 0.000 1.377 1434 R HN 0.327 nan 8.270 nan 0.000 0.583 1435 A N -0.950 121.937 122.820 0.112 0.000 1.808 1435 A HA 0.106 4.428 4.320 0.003 0.000 0.190 1435 A C 1.408 179.329 177.584 0.562 0.000 1.822 1435 A CA -0.005 52.201 52.037 0.282 0.000 1.090 1435 A CB -0.072 19.141 19.000 0.355 0.000 1.004 1435 A HN 0.107 nan 8.150 nan 0.000 0.602 1436 V N 2.577 122.788 119.914 0.495 0.000 2.439 1436 V HA -0.327 3.795 4.120 0.003 0.000 0.253 1436 V C 2.158 178.479 176.094 0.379 0.000 1.074 1436 V CA 2.425 65.001 62.300 0.459 0.000 1.076 1436 V CB -1.150 30.795 31.823 0.204 0.000 0.664 1436 V HN 0.576 nan 8.190 nan 0.000 0.461 1437 N N -0.665 118.177 118.700 0.237 0.000 2.166 1437 N HA -0.189 4.553 4.740 0.003 0.000 0.186 1437 N C 1.674 177.240 175.510 0.094 0.000 1.019 1437 N CA 1.592 54.719 53.050 0.128 0.000 0.856 1437 N CB -0.509 38.025 38.487 0.077 0.000 0.993 1437 N HN 0.693 nan 8.380 nan 0.000 0.426 1438 Y N -0.088 120.174 120.300 -0.063 0.000 2.516 1438 Y HA 0.029 4.581 4.550 0.003 0.000 0.291 1438 Y C 1.326 177.044 175.900 -0.304 0.000 1.131 1438 Y CA 0.858 58.817 58.100 -0.236 0.000 1.281 1438 Y CB -0.102 38.128 38.460 -0.385 0.000 1.013 1438 Y HN -0.096 nan 8.280 nan 0.000 0.554 1439 F N -1.107 118.856 119.950 0.021 0.000 2.147 1439 F HA -0.102 4.427 4.527 0.003 0.000 0.291 1439 F C 2.554 178.298 175.800 -0.093 0.000 1.093 1439 F CA 1.323 59.298 58.000 -0.041 0.000 1.263 1439 F CB -1.008 37.995 39.000 0.004 0.000 1.036 1439 F HN -0.210 nan 8.300 nan 0.000 0.481 1440 S N 0.640 116.429 115.700 0.147 0.000 2.368 1440 S HA -0.263 4.208 4.470 0.003 0.000 0.226 1440 S C 1.596 176.181 174.600 -0.025 0.000 1.044 1440 S CA 1.933 60.162 58.200 0.049 0.000 1.062 1440 S CB -0.817 62.412 63.200 0.047 0.000 0.931 1440 S HN 0.446 nan 8.310 nan 0.000 0.440 1441 K N 1.084 121.440 120.400 -0.073 0.000 2.706 1441 K HA 0.216 4.538 4.320 0.003 0.000 0.217 1441 K C 0.477 176.959 176.600 -0.196 0.000 1.019 1441 K CA 0.227 56.443 56.287 -0.118 0.000 1.181 1441 K CB 0.061 32.486 32.500 -0.124 0.000 0.940 1441 K HN 0.188 nan 8.250 nan 0.000 0.491 1442 V N 0.522 120.327 119.914 -0.182 0.000 3.562 1442 V HA 0.022 4.144 4.120 0.003 0.000 0.270 1442 V C 0.882 176.900 176.094 -0.126 0.000 1.418 1442 V CA 0.047 62.211 62.300 -0.227 0.000 1.033 1442 V CB -0.094 31.545 31.823 -0.307 0.000 0.820 1442 V HN 0.650 nan 8.190 nan 0.000 0.441 1443 K N 0.556 120.913 120.400 -0.072 0.000 3.341 1443 K HA -0.310 4.011 4.320 0.003 0.000 0.305 1443 K C 0.638 177.220 176.600 -0.030 0.000 1.270 1443 K CA 1.634 57.895 56.287 -0.044 0.000 0.897 1443 K CB -0.930 31.539 32.500 -0.052 0.000 1.264 1443 K HN 0.571 nan 8.250 nan 0.000 0.468 1444 Q N -0.007 119.786 119.800 -0.011 0.000 2.093 1444 Q HA 0.240 4.582 4.340 0.003 0.000 0.217 1444 Q C 1.298 177.342 176.000 0.074 0.000 0.785 1444 Q CA -0.041 55.772 55.803 0.016 0.000 1.038 1444 Q CB 0.493 29.223 28.738 -0.012 0.000 1.190 1444 Q HN 0.431 nan 8.270 nan 0.000 0.468 1445 L N 2.248 123.526 121.223 0.091 0.000 2.127 1445 L HA -0.083 4.259 4.340 0.003 0.000 0.211 1445 L C -0.802 176.059 176.870 -0.015 0.000 1.089 1445 L CA 1.258 56.158 54.840 0.100 0.000 0.757 1445 L CB -0.430 41.679 42.059 0.083 0.000 0.899 1445 L HN 0.155 nan 8.230 nan 0.000 0.434 1446 P HA -0.245 nan 4.420 nan 0.000 0.221 1446 P C 1.923 179.205 177.300 -0.030 0.000 1.145 1446 P CA 1.332 64.404 63.100 -0.047 0.000 0.795 1446 P CB -0.155 31.521 31.700 -0.041 0.000 0.775 1447 L N 0.768 121.989 121.223 -0.004 0.000 2.042 1447 L HA -0.122 4.220 4.340 0.003 0.000 0.210 1447 L C 2.349 179.218 176.870 -0.002 0.000 1.076 1447 L CA 1.922 56.769 54.840 0.010 0.000 0.749 1447 L CB -0.628 41.455 42.059 0.040 0.000 0.893 1447 L HN -0.065 nan 8.230 nan 0.000 0.432 1448 V N -2.354 117.527 119.914 -0.055 0.000 3.383 1448 V HA -0.206 3.916 4.120 0.003 0.000 0.272 1448 V C 2.252 178.384 176.094 0.063 0.000 1.181 1448 V CA 1.410 63.695 62.300 -0.025 0.000 1.171 1448 V CB -0.932 30.720 31.823 -0.285 0.000 0.800 1448 V HN 0.464 nan 8.190 nan 0.000 0.515 1449 K N 2.119 122.512 120.400 -0.012 0.000 2.015 1449 K HA -0.171 4.151 4.320 0.003 0.000 0.220 1449 K C 0.041 176.633 176.600 -0.014 0.000 1.055 1449 K CA 2.512 58.772 56.287 -0.045 0.000 0.951 1449 K CB -1.317 31.155 32.500 -0.046 0.000 0.725 1449 K HN 0.578 nan 8.250 nan 0.000 0.449 1450 P HA -0.161 nan 4.420 nan 0.000 0.222 1450 P C 1.284 178.602 177.300 0.029 0.000 1.153 1450 P CA 1.052 64.167 63.100 0.024 0.000 0.798 1450 P CB -0.273 31.450 31.700 0.038 0.000 0.796 1451 Y N 1.493 121.757 120.300 -0.061 0.000 2.403 1451 Y HA -0.086 4.466 4.550 0.003 0.000 0.291 1451 Y C 1.764 177.621 175.900 -0.071 0.000 1.143 1451 Y CA 1.171 59.231 58.100 -0.067 0.000 1.257 1451 Y CB -1.076 37.313 38.460 -0.118 0.000 0.984 1451 Y HN -0.188 nan 8.280 nan 0.000 0.550 1452 L N -0.458 120.589 121.223 -0.293 0.000 2.607 1452 L HA 0.107 4.449 4.340 0.003 0.000 0.228 1452 L C 2.219 178.963 176.870 -0.209 0.000 1.123 1452 L CA -0.205 54.417 54.840 -0.363 0.000 0.890 1452 L CB -0.275 41.650 42.059 -0.224 0.000 1.103 1452 L HN -0.012 nan 8.230 nan 0.000 0.468 1453 R N 0.433 120.858 120.500 -0.126 0.000 2.078 1453 R HA -0.020 4.321 4.340 0.003 0.000 0.224 1453 R C 2.252 178.511 176.300 -0.069 0.000 1.149 1453 R CA 1.581 57.645 56.100 -0.060 0.000 0.916 1453 R CB -0.925 29.363 30.300 -0.020 0.000 0.821 1453 R HN 0.175 nan 8.270 nan 0.000 0.434 1454 S N 0.647 116.310 115.700 -0.062 0.000 2.474 1454 S HA -0.012 4.460 4.470 0.003 0.000 0.235 1454 S C 1.250 175.794 174.600 -0.093 0.000 0.997 1454 S CA 0.388 58.558 58.200 -0.050 0.000 0.949 1454 S CB -0.021 63.166 63.200 -0.022 0.000 0.766 1454 S HN -0.005 nan 8.310 nan 0.000 0.517 1455 V N 0.388 120.201 119.914 -0.169 0.000 3.613 1455 V HA 0.336 4.458 4.120 0.003 0.000 0.283 1455 V C 0.795 176.713 176.094 -0.294 0.000 1.052 1455 V CA -0.746 61.408 62.300 -0.244 0.000 0.937 1455 V CB 0.516 32.093 31.823 -0.411 0.000 1.241 1455 V HN 0.389 nan 8.190 nan 0.000 0.429 1456 Q N -0.357 119.216 119.800 -0.378 0.000 2.493 1456 Q HA -0.214 4.127 4.340 0.003 0.000 0.278 1456 Q C 0.284 175.801 176.000 -0.805 0.000 1.198 1456 Q CA 1.479 56.975 55.803 -0.512 0.000 0.880 1456 Q CB -1.781 26.636 28.738 -0.536 0.000 1.260 1456 Q HN 0.904 nan 8.270 nan 0.000 0.470 1457 N N -2.096 116.317 118.700 -0.478 0.000 2.297 1457 N HA 0.070 4.812 4.740 0.003 0.000 0.208 1457 N C 0.768 176.146 175.510 -0.220 0.000 1.176 1457 N CA 0.102 52.957 53.050 -0.325 0.000 0.882 1457 N CB 0.192 38.623 38.487 -0.094 0.000 1.134 1457 N HN 0.256 nan 8.380 nan 0.000 0.489 1458 H N 1.261 120.144 119.070 -0.312 0.000 2.561 1458 H HA 0.013 4.571 4.556 0.003 0.000 0.278 1458 H C 0.740 175.961 175.328 -0.179 0.000 1.014 1458 H CA 0.875 56.776 56.048 -0.245 0.000 1.211 1458 H CB -0.012 29.515 29.762 -0.393 0.000 1.365 1458 H HN 0.196 nan 8.280 nan 0.000 0.594 1459 N N -0.273 118.346 118.700 -0.135 0.000 2.809 1459 N HA -0.291 4.451 4.740 0.003 0.000 0.244 1459 N C -0.658 174.848 175.510 -0.006 0.000 1.018 1459 N CA 0.812 53.839 53.050 -0.039 0.000 0.917 1459 N CB -1.337 37.192 38.487 0.069 0.000 1.130 1459 N HN 0.337 nan 8.380 nan 0.000 0.591 1460 N N 0.525 119.212 118.700 -0.023 0.000 2.292 1460 N HA -0.048 4.694 4.740 0.003 0.000 0.242 1460 N C 1.021 176.535 175.510 0.007 0.000 1.243 1460 N CA 0.939 53.988 53.050 -0.002 0.000 0.851 1460 N CB 0.421 38.874 38.487 -0.057 0.000 1.093 1460 N HN 0.441 nan 8.380 nan 0.000 0.450 1461 K N 0.699 121.122 120.400 0.039 0.000 2.007 1461 K HA -0.098 4.224 4.320 0.003 0.000 0.206 1461 K C 2.083 178.713 176.600 0.050 0.000 1.047 1461 K CA 1.411 57.736 56.287 0.062 0.000 0.937 1461 K CB -0.247 32.294 32.500 0.067 0.000 0.718 1461 K HN 0.637 nan 8.250 nan 0.000 0.438 1462 S N 1.181 116.907 115.700 0.043 0.000 2.407 1462 S HA -0.167 4.304 4.470 0.003 0.000 0.235 1462 S C 2.122 176.733 174.600 0.018 0.000 1.036 1462 S CA 1.446 59.673 58.200 0.044 0.000 1.013 1462 S CB -0.905 62.336 63.200 0.067 0.000 0.820 1462 S HN 0.035 nan 8.310 nan 0.000 0.476 1463 V N 3.646 123.552 119.914 -0.014 0.000 2.216 1463 V HA -0.221 3.901 4.120 0.003 0.000 0.243 1463 V C 2.675 178.743 176.094 -0.043 0.000 1.044 1463 V CA 2.125 64.386 62.300 -0.063 0.000 0.995 1463 V CB -1.071 30.675 31.823 -0.129 0.000 0.633 1463 V HN 0.538 nan 8.190 nan 0.000 0.446 1464 N N 0.041 118.727 118.700 -0.022 0.000 2.013 1464 N HA -0.217 4.524 4.740 0.003 0.000 0.195 1464 N C 1.898 177.427 175.510 0.031 0.000 1.051 1464 N CA 1.537 54.587 53.050 -0.000 0.000 0.851 1464 N CB -0.714 37.765 38.487 -0.013 0.000 1.044 1464 N HN 0.432 nan 8.380 nan 0.000 0.422 1465 E N 1.179 121.420 120.200 0.069 0.000 2.149 1465 E HA -0.190 4.161 4.350 0.003 0.000 0.215 1465 E C 1.744 178.374 176.600 0.050 0.000 1.055 1465 E CA 1.607 58.057 56.400 0.084 0.000 0.870 1465 E CB -0.184 29.561 29.700 0.075 0.000 0.764 1465 E HN 0.278 nan 8.360 nan 0.000 0.463 1466 S N -0.238 115.474 115.700 0.020 0.000 2.441 1466 S HA -0.003 4.468 4.470 0.003 0.000 0.224 1466 S C 1.826 176.391 174.600 -0.058 0.000 1.043 1466 S CA 0.342 58.538 58.200 -0.006 0.000 0.948 1466 S CB -0.110 63.086 63.200 -0.007 0.000 0.810 1466 S HN 0.173 nan 8.310 nan 0.000 0.504 1467 L N 3.334 124.512 121.223 -0.074 0.000 2.021 1467 L HA -0.207 4.135 4.340 0.003 0.000 0.215 1467 L C 1.761 178.547 176.870 -0.139 0.000 1.074 1467 L CA 1.711 56.451 54.840 -0.167 0.000 0.760 1467 L CB -0.714 41.323 42.059 -0.037 0.000 0.889 1467 L HN 0.241 nan 8.230 nan 0.000 0.433 1468 N N -0.481 118.250 118.700 0.051 0.000 2.080 1468 N HA -0.237 4.504 4.740 0.003 0.000 0.189 1468 N C 1.688 177.242 175.510 0.072 0.000 1.036 1468 N CA 1.720 54.849 53.050 0.132 0.000 0.846 1468 N CB -0.910 37.608 38.487 0.053 0.000 1.015 1468 N HN 0.564 nan 8.380 nan 0.000 0.423 1469 N N 0.985 119.704 118.700 0.033 0.000 2.184 1469 N HA -0.153 4.589 4.740 0.003 0.000 0.190 1469 N C 1.638 177.162 175.510 0.023 0.000 1.011 1469 N CA 0.646 53.720 53.050 0.041 0.000 0.867 1469 N CB 0.034 38.535 38.487 0.024 0.000 0.993 1469 N HN 0.164 nan 8.380 nan 0.000 0.433 1470 L N -0.591 120.580 121.223 -0.087 0.000 1.993 1470 L HA -0.080 4.261 4.340 0.003 0.000 0.206 1470 L C 1.821 178.639 176.870 -0.087 0.000 1.074 1470 L CA 0.942 55.673 54.840 -0.181 0.000 0.746 1470 L CB -0.857 40.941 42.059 -0.435 0.000 0.896 1470 L HN 0.099 nan 8.230 nan 0.000 0.435 1471 F N 0.344 120.332 119.950 0.063 0.000 2.346 1471 F HA -0.186 4.343 4.527 0.003 0.000 0.301 1471 F C 2.211 178.197 175.800 0.309 0.000 1.070 1471 F CA 1.009 59.076 58.000 0.112 0.000 1.407 1471 F CB -0.877 38.133 39.000 0.018 0.000 1.072 1471 F HN 0.031 nan 8.300 nan 0.000 0.543 1472 I N -1.003 119.828 120.570 0.436 0.000 2.188 1472 I HA -0.201 3.970 4.170 0.003 0.000 0.237 1472 I C 2.226 178.646 176.117 0.505 0.000 1.073 1472 I CA 1.456 63.157 61.300 0.667 0.000 1.359 1472 I CB -0.903 37.322 38.000 0.374 0.000 1.083 1472 I HN -0.079 nan 8.210 nan 0.000 0.412 1473 T N 0.561 115.276 114.554 0.267 0.000 2.995 1473 T HA -0.146 4.206 4.350 0.003 0.000 0.269 1473 T C 1.580 176.338 174.700 0.098 0.000 1.091 1473 T CA 1.362 63.548 62.100 0.144 0.000 1.128 1473 T CB -0.338 68.581 68.868 0.085 0.000 0.891 1473 T HN 0.550 nan 8.240 nan 0.000 0.492 1474 E N 1.554 121.832 120.200 0.130 0.000 2.371 1474 E HA -0.057 4.295 4.350 0.003 0.000 0.194 1474 E C 0.489 177.157 176.600 0.113 0.000 1.012 1474 E CA 0.727 57.184 56.400 0.096 0.000 0.860 1474 E CB -0.262 29.488 29.700 0.082 0.000 0.811 1474 E HN 0.502 nan 8.360 nan 0.000 0.502 1475 E N 0.358 120.661 120.200 0.173 0.000 3.687 1475 E HA -0.166 4.186 4.350 0.003 0.000 0.319 1475 E C -0.647 176.111 176.600 0.263 0.000 0.821 1475 E CA 0.720 57.165 56.400 0.075 0.000 1.195 1475 E CB -1.596 28.096 29.700 -0.012 0.000 1.605 1475 E HN 0.434 nan 8.360 nan 0.000 0.419 1476 D N -0.033 120.605 120.400 0.397 0.000 2.312 1476 D HA 0.114 4.756 4.640 0.003 0.000 0.252 1476 D C 0.489 176.981 176.300 0.321 0.000 1.150 1476 D CA 0.135 54.271 54.000 0.227 0.000 0.870 1476 D CB 0.515 41.530 40.800 0.358 0.000 1.153 1476 D HN 0.250 nan 8.370 nan 0.000 0.457 1477 Y N 1.776 122.216 120.300 0.233 0.000 2.638 1477 Y HA 0.214 4.765 4.550 0.003 0.000 0.275 1477 Y C 2.265 178.130 175.900 -0.059 0.000 1.122 1477 Y CA -0.212 57.974 58.100 0.145 0.000 1.266 1477 Y CB -0.406 38.222 38.460 0.281 0.000 1.317 1477 Y HN 0.267 nan 8.280 nan 0.000 0.501 1478 Q N 1.514 121.145 119.800 -0.281 0.000 2.002 1478 Q HA -0.176 4.165 4.340 0.003 0.000 0.204 1478 Q C 2.511 178.369 176.000 -0.236 0.000 0.988 1478 Q CA 2.116 57.836 55.803 -0.138 0.000 0.843 1478 Q CB -0.371 28.240 28.738 -0.213 0.000 0.908 1478 Q HN 0.633 nan 8.270 nan 0.000 0.420 1479 A N 0.892 123.488 122.820 -0.374 0.000 1.835 1479 A HA -0.209 4.113 4.320 0.003 0.000 0.215 1479 A C 2.068 179.147 177.584 -0.842 0.000 1.199 1479 A CA 1.454 53.159 52.037 -0.553 0.000 0.615 1479 A CB -1.071 17.568 19.000 -0.603 0.000 0.838 1479 A HN 0.380 nan 8.150 nan 0.000 0.444 1480 L N -0.157 120.339 121.223 -1.212 0.000 2.054 1480 L HA -0.271 4.071 4.340 0.003 0.000 0.220 1480 L C 2.427 179.028 176.870 -0.448 0.000 1.081 1480 L CA 2.820 57.110 54.840 -0.916 0.000 0.780 1480 L CB -0.767 41.019 42.059 -0.455 0.000 0.893 1480 L HN 0.486 nan 8.230 nan 0.000 0.438 1481 R N -1.275 119.042 120.500 -0.305 0.000 2.070 1481 R HA -0.120 4.222 4.340 0.003 0.000 0.233 1481 R C 2.133 178.316 176.300 -0.194 0.000 1.137 1481 R CA 2.222 58.206 56.100 -0.194 0.000 0.945 1481 R CB -0.750 29.480 30.300 -0.117 0.000 0.845 1481 R HN 0.465 nan 8.270 nan 0.000 0.430 1482 T N -0.729 113.701 114.554 -0.206 0.000 2.951 1482 T HA -0.071 4.280 4.350 0.003 0.000 0.268 1482 T C 1.652 176.266 174.700 -0.143 0.000 1.073 1482 T CA 1.239 63.242 62.100 -0.161 0.000 1.134 1482 T CB -0.201 68.586 68.868 -0.135 0.000 0.884 1482 T HN 0.258 nan 8.240 nan 0.000 0.479 1483 S N 1.309 116.873 115.700 -0.226 0.000 2.537 1483 S HA -0.051 4.421 4.470 0.003 0.000 0.240 1483 S C 1.429 176.006 174.600 -0.038 0.000 0.981 1483 S CA 0.799 58.922 58.200 -0.129 0.000 0.948 1483 S CB -0.379 62.631 63.200 -0.317 0.000 0.759 1483 S HN 0.639 nan 8.310 nan 0.000 0.531 1484 I N -3.412 117.081 120.570 -0.127 0.000 4.390 1484 I HA 0.502 4.673 4.170 0.003 0.000 0.334 1484 I C 0.237 176.270 176.117 -0.141 0.000 1.379 1484 I CA -0.158 61.046 61.300 -0.160 0.000 1.197 1484 I CB 0.317 38.140 38.000 -0.295 0.000 1.396 1484 I HN -0.190 nan 8.210 nan 0.000 0.511 1485 D N 2.039 122.351 120.400 -0.147 0.000 2.378 1485 D HA 0.233 4.875 4.640 0.003 0.000 0.227 1485 D C 1.445 177.625 176.300 -0.200 0.000 1.012 1485 D CA 1.251 55.164 54.000 -0.146 0.000 0.905 1485 D CB 0.859 41.574 40.800 -0.141 0.000 0.895 1485 D HN 0.654 nan 8.370 nan 0.000 0.532 1486 A N -0.691 121.946 122.820 -0.306 0.000 1.696 1486 A HA 0.078 4.400 4.320 0.003 0.000 0.184 1486 A C -0.468 176.883 177.584 -0.388 0.000 1.658 1486 A CA -0.418 51.349 52.037 -0.450 0.000 1.194 1486 A CB -0.244 18.279 19.000 -0.796 0.000 1.036 1486 A HN 0.071 nan 8.150 nan 0.000 0.579 1487 Y N 3.092 123.357 120.300 -0.058 0.000 2.697 1487 Y HA 0.291 4.843 4.550 0.003 0.000 0.349 1487 Y C 0.377 176.245 175.900 -0.053 0.000 1.120 1487 Y CA 0.092 58.163 58.100 -0.048 0.000 1.468 1487 Y CB -0.367 38.057 38.460 -0.060 0.000 1.182 1487 Y HN 0.577 nan 8.280 nan 0.000 0.525 1488 D N -0.157 120.314 120.400 0.119 0.000 2.460 1488 D HA -0.014 4.628 4.640 0.003 0.000 0.229 1488 D C -0.095 176.431 176.300 0.375 0.000 1.170 1488 D CA -0.376 53.742 54.000 0.197 0.000 0.827 1488 D CB -0.345 40.564 40.800 0.182 0.000 0.973 1488 D HN 0.531 nan 8.370 nan 0.000 0.496 1489 N N 1.088 119.967 118.700 0.298 0.000 2.645 1489 N HA 0.318 5.060 4.740 0.003 0.000 0.233 1489 N C -1.234 174.519 175.510 0.404 0.000 1.058 1489 N CA -0.620 52.596 53.050 0.277 0.000 0.942 1489 N CB 0.190 38.770 38.487 0.156 0.000 1.210 1489 N HN 0.213 nan 8.380 nan 0.000 0.512 1490 F N 0.491 120.450 119.950 0.015 0.000 3.194 1490 F HA 0.281 4.810 4.527 0.003 0.000 0.327 1490 F C -1.706 174.093 175.800 -0.002 0.000 1.141 1490 F CA -1.574 56.430 58.000 0.006 0.000 0.862 1490 F CB 0.385 39.387 39.000 0.004 0.000 1.447 1490 F HN -0.018 nan 8.300 nan 0.000 0.479 1491 D N 1.598 121.858 120.400 -0.234 0.000 2.517 1491 D HA 0.203 4.845 4.640 0.003 0.000 0.220 1491 D C -0.699 175.247 176.300 -0.589 0.000 1.158 1491 D CA -0.104 53.694 54.000 -0.337 0.000 0.992 1491 D CB -0.635 40.104 40.800 -0.102 0.000 1.058 1491 D HN 0.491 nan 8.370 nan 0.000 0.516 1492 N N 4.417 122.538 118.700 -0.966 0.000 2.670 1492 N HA 0.142 4.883 4.740 0.003 0.000 0.296 1492 N C 0.309 175.666 175.510 -0.255 0.000 1.216 1492 N CA 0.363 52.958 53.050 -0.757 0.000 1.123 1492 N CB 0.120 38.221 38.487 -0.642 0.000 1.459 1492 N HN 0.565 nan 8.380 nan 0.000 0.509 1493 I N -1.632 118.855 120.570 -0.138 0.000 1.266 1493 I HA -0.098 4.073 4.170 0.003 0.000 0.343 1493 I C 1.435 177.614 176.117 0.102 0.000 0.395 1493 I CA -0.291 61.059 61.300 0.084 0.000 3.296 1493 I CB -0.569 37.458 38.000 0.045 0.000 1.588 1493 I HN -0.034 nan 8.210 nan 0.000 0.544 1494 S N 1.747 117.491 115.700 0.073 0.000 2.409 1494 S HA -0.257 4.214 4.470 0.003 0.000 0.237 1494 S C 1.755 176.371 174.600 0.027 0.000 1.060 1494 S CA 2.361 60.603 58.200 0.071 0.000 1.052 1494 S CB -0.563 62.661 63.200 0.041 0.000 0.871 1494 S HN 0.405 nan 8.310 nan 0.000 0.465 1495 L N 1.834 123.048 121.223 -0.015 0.000 2.021 1495 L HA -0.183 4.158 4.340 0.003 0.000 0.215 1495 L C 2.248 179.028 176.870 -0.150 0.000 1.074 1495 L CA 2.285 57.105 54.840 -0.033 0.000 0.760 1495 L CB -1.015 41.074 42.059 0.049 0.000 0.889 1495 L HN 0.293 nan 8.230 nan 0.000 0.433 1496 A N -1.850 120.740 122.820 -0.384 0.000 2.206 1496 A HA -0.101 4.221 4.320 0.003 0.000 0.211 1496 A C 2.043 179.481 177.584 -0.243 0.000 1.158 1496 A CA 0.959 52.567 52.037 -0.715 0.000 0.761 1496 A CB -0.435 17.261 19.000 -2.173 0.000 0.801 1496 A HN 0.709 nan 8.150 nan 0.000 0.473 1497 Q N -0.699 119.133 119.800 0.053 0.000 2.123 1497 Q HA -0.108 4.233 4.340 0.003 0.000 0.199 1497 Q C 2.240 178.297 176.000 0.095 0.000 0.966 1497 Q CA 1.410 57.332 55.803 0.198 0.000 0.845 1497 Q CB -0.134 28.709 28.738 0.174 0.000 0.907 1497 Q HN 0.727 nan 8.270 nan 0.000 0.439 1498 R N 0.825 121.349 120.500 0.040 0.000 2.193 1498 R HA -0.030 4.312 4.340 0.003 0.000 0.213 1498 R C 1.913 178.187 176.300 -0.044 0.000 1.055 1498 R CA 0.468 56.598 56.100 0.050 0.000 0.995 1498 R CB 0.055 30.397 30.300 0.070 0.000 0.893 1498 R HN 0.202 nan 8.270 nan 0.000 0.459 1499 L N 0.206 121.339 121.223 -0.150 0.000 2.072 1499 L HA -0.044 4.298 4.340 0.003 0.000 0.205 1499 L C 2.543 179.310 176.870 -0.172 0.000 1.079 1499 L CA 1.417 56.051 54.840 -0.343 0.000 0.752 1499 L CB -0.703 41.239 42.059 -0.195 0.000 0.906 1499 L HN 0.310 nan 8.230 nan 0.000 0.436 1500 E N 1.417 121.620 120.200 0.005 0.000 2.118 1500 E HA -0.228 4.124 4.350 0.003 0.000 0.195 1500 E C 1.650 178.311 176.600 0.101 0.000 0.992 1500 E CA 1.141 57.593 56.400 0.087 0.000 0.804 1500 E CB 0.115 29.907 29.700 0.154 0.000 0.741 1500 E HN 0.416 nan 8.360 nan 0.000 0.458 1501 K N 0.043 120.513 120.400 0.116 0.000 2.616 1501 K HA -0.009 4.313 4.320 0.003 0.000 0.192 1501 K C 0.385 177.131 176.600 0.243 0.000 1.031 1501 K CA 0.144 56.523 56.287 0.153 0.000 1.004 1501 K CB -0.132 32.454 32.500 0.144 0.000 0.810 1501 K HN 0.335 nan 8.250 nan 0.000 0.497 1502 H N 0.033 119.137 119.070 0.058 0.000 2.490 1502 H HA 0.024 4.581 4.556 0.003 0.000 0.354 1502 H C 1.153 176.489 175.328 0.015 0.000 1.365 1502 H CA -0.271 55.797 56.048 0.033 0.000 1.413 1502 H CB 1.231 31.015 29.762 0.037 0.000 1.631 1502 H HN 0.202 nan 8.280 nan 0.000 0.607 1503 E N 0.109 120.359 120.200 0.084 0.000 2.332 1503 E HA 0.097 4.448 4.350 0.003 0.000 0.202 1503 E C 0.175 176.789 176.600 0.023 0.000 0.877 1503 E CA -0.078 56.339 56.400 0.028 0.000 0.979 1503 E CB 0.569 30.258 29.700 -0.019 0.000 0.969 1503 E HN 0.234 nan 8.360 nan 0.000 0.495 1504 L N 4.198 125.422 121.223 0.001 0.000 2.462 1504 L HA 0.206 4.548 4.340 0.003 0.000 0.283 1504 L C 1.274 178.163 176.870 0.031 0.000 1.166 1504 L CA 0.059 54.887 54.840 -0.019 0.000 0.964 1504 L CB 0.294 42.297 42.059 -0.094 0.000 1.294 1504 L HN 0.428 nan 8.230 nan 0.000 0.449 1505 I N 0.061 120.651 120.570 0.033 0.000 2.576 1505 I HA -0.337 3.835 4.170 0.003 0.000 0.263 1505 I C 1.659 177.823 176.117 0.079 0.000 1.183 1505 I CA 1.119 62.452 61.300 0.054 0.000 1.432 1505 I CB -0.330 37.686 38.000 0.026 0.000 1.100 1505 I HN 0.605 nan 8.210 nan 0.000 0.452 1506 E N 1.444 121.670 120.200 0.044 0.000 2.086 1506 E HA -0.252 4.100 4.350 0.003 0.000 0.205 1506 E C 2.001 178.833 176.600 0.387 0.000 1.027 1506 E CA 2.236 58.697 56.400 0.100 0.000 0.830 1506 E CB -0.395 29.304 29.700 -0.002 0.000 0.751 1506 E HN 0.729 nan 8.360 nan 0.000 0.456 1507 F N -0.541 119.444 119.950 0.058 0.000 2.698 1507 F HA 0.133 4.662 4.527 0.003 0.000 0.295 1507 F C 2.353 178.131 175.800 -0.037 0.000 1.124 1507 F CA -0.319 57.681 58.000 -0.000 0.000 1.426 1507 F CB 0.203 39.162 39.000 -0.068 0.000 1.120 1507 F HN -0.170 nan 8.300 nan 0.000 0.583 1508 R N 0.200 120.813 120.500 0.188 0.000 2.276 1508 R HA -0.016 4.326 4.340 0.003 0.000 0.203 1508 R C 2.021 178.380 176.300 0.098 0.000 1.017 1508 R CA 0.337 56.504 56.100 0.112 0.000 1.010 1508 R CB -0.011 30.349 30.300 0.099 0.000 0.900 1508 R HN 0.195 nan 8.270 nan 0.000 0.469 1509 R N -0.198 120.370 120.500 0.115 0.000 2.175 1509 R HA 0.060 4.402 4.340 0.003 0.000 0.202 1509 R C 1.223 177.591 176.300 0.114 0.000 1.018 1509 R CA 0.519 56.676 56.100 0.096 0.000 1.029 1509 R CB 0.374 30.718 30.300 0.073 0.000 0.959 1509 R HN 0.025 nan 8.270 nan 0.000 0.480 1510 I N 0.366 121.007 120.570 0.119 0.000 2.867 1510 I HA 0.122 4.294 4.170 0.003 0.000 0.265 1510 I C 2.188 178.337 176.117 0.053 0.000 1.162 1510 I CA 0.568 61.939 61.300 0.118 0.000 1.471 1510 I CB -0.988 37.036 38.000 0.040 0.000 1.123 1510 I HN 0.081 nan 8.210 nan 0.000 0.440 1511 A N 0.961 123.770 122.820 -0.018 0.000 1.972 1511 A HA -0.094 4.228 4.320 0.003 0.000 0.219 1511 A C 2.531 180.091 177.584 -0.039 0.000 1.169 1511 A CA 1.831 53.772 52.037 -0.160 0.000 0.635 1511 A CB -0.747 18.192 19.000 -0.102 0.000 0.810 1511 A HN 0.369 nan 8.150 nan 0.000 0.446 1512 A N -1.063 121.805 122.820 0.079 0.000 1.877 1512 A HA -0.057 4.265 4.320 0.003 0.000 0.216 1512 A C 2.147 179.784 177.584 0.088 0.000 1.186 1512 A CA 1.683 53.785 52.037 0.107 0.000 0.620 1512 A CB -0.832 18.218 19.000 0.084 0.000 0.822 1512 A HN 0.785 nan 8.150 nan 0.000 0.443 1513 Y N 0.190 120.493 120.300 0.006 0.000 2.092 1513 Y HA -0.153 4.398 4.550 0.003 0.000 0.282 1513 Y C 2.032 177.933 175.900 0.002 0.000 1.126 1513 Y CA 1.664 59.765 58.100 0.002 0.000 1.111 1513 Y CB -0.820 37.635 38.460 -0.009 0.000 0.987 1513 Y HN 0.227 nan 8.280 nan 0.000 0.489 1514 L N -0.810 120.151 121.223 -0.436 0.000 2.085 1514 L HA -0.336 4.005 4.340 0.003 0.000 0.218 1514 L C 2.213 178.870 176.870 -0.355 0.000 1.080 1514 L CA 2.060 56.611 54.840 -0.482 0.000 0.776 1514 L CB -0.600 41.258 42.059 -0.336 0.000 0.891 1514 L HN 0.294 nan 8.230 nan 0.000 0.437 1515 F N 0.386 120.220 119.950 -0.192 0.000 2.206 1515 F HA -0.177 4.352 4.527 0.003 0.000 0.298 1515 F C 2.554 178.257 175.800 -0.162 0.000 1.090 1515 F CA 1.749 59.663 58.000 -0.144 0.000 1.323 1515 F CB -0.589 38.349 39.000 -0.104 0.000 1.028 1515 F HN 0.230 nan 8.300 nan 0.000 0.492 1516 K N 0.452 120.839 120.400 -0.020 0.000 2.031 1516 K HA 0.075 4.396 4.320 0.003 0.000 0.205 1516 K C 1.347 177.878 176.600 -0.116 0.000 1.049 1516 K CA 0.905 57.157 56.287 -0.057 0.000 0.939 1516 K CB -1.172 31.293 32.500 -0.057 0.000 0.717 1516 K HN 0.130 nan 8.250 nan 0.000 0.438 1517 G N 2.923 111.510 108.800 -0.355 0.000 2.491 1517 G HA2 -0.309 3.653 3.960 0.003 0.000 0.246 1517 G HA3 -0.309 3.653 3.960 0.003 0.000 0.246 1517 G C 0.005 174.874 174.900 -0.052 0.000 0.174 1517 G CA 0.927 45.837 45.100 -0.316 0.000 1.114 1517 G HN 0.791 nan 8.290 nan 0.000 0.515 1518 N N -0.044 118.686 118.700 0.051 0.000 2.650 1518 N HA -0.234 4.507 4.740 0.003 0.000 0.249 1518 N C -0.018 175.513 175.510 0.035 0.000 1.155 1518 N CA 1.761 54.847 53.050 0.060 0.000 0.747 1518 N CB -0.602 37.914 38.487 0.049 0.000 1.132 1518 N HN 0.693 nan 8.380 nan 0.000 0.564 1519 N N -0.358 118.359 118.700 0.029 0.000 2.675 1519 N HA 0.222 4.963 4.740 0.003 0.000 0.254 1519 N C 0.110 175.658 175.510 0.062 0.000 1.224 1519 N CA -0.420 52.657 53.050 0.044 0.000 0.777 1519 N CB 0.768 39.279 38.487 0.039 0.000 1.256 1519 N HN 0.160 nan 8.380 nan 0.000 0.531 1520 R N 0.117 120.656 120.500 0.065 0.000 2.159 1520 R HA -0.099 4.243 4.340 0.003 0.000 0.237 1520 R C 1.713 178.023 176.300 0.016 0.000 1.131 1520 R CA 1.082 57.203 56.100 0.036 0.000 0.982 1520 R CB -0.252 30.078 30.300 0.049 0.000 0.868 1520 R HN 0.597 nan 8.270 nan 0.000 0.453 1521 W N 2.044 123.290 121.300 -0.090 0.000 2.335 1521 W HA -0.219 4.443 4.660 0.003 0.000 0.311 1521 W C 1.255 177.692 176.519 -0.137 0.000 1.213 1521 W CA 1.519 58.803 57.345 -0.102 0.000 1.274 1521 W CB 0.048 29.459 29.460 -0.082 0.000 1.148 1521 W HN -0.130 nan 8.180 nan 0.000 0.498 1522 K N 0.327 120.800 120.400 0.121 0.000 1.977 1522 K HA -0.310 4.012 4.320 0.003 0.000 0.218 1522 K C 1.919 178.288 176.600 -0.385 0.000 1.051 1522 K CA 2.183 58.382 56.287 -0.146 0.000 0.953 1522 K CB -1.611 30.916 32.500 0.045 0.000 0.727 1522 K HN 0.424 nan 8.250 nan 0.000 0.445 1523 Q N 1.019 120.641 119.800 -0.297 0.000 2.182 1523 Q HA -0.246 4.095 4.340 0.003 0.000 0.213 1523 Q C 2.023 177.634 176.000 -0.649 0.000 1.000 1523 Q CA 3.016 58.569 55.803 -0.416 0.000 0.889 1523 Q CB -0.066 28.394 28.738 -0.463 0.000 0.932 1523 Q HN 0.457 nan 8.270 nan 0.000 0.415 1524 S N -0.792 114.463 115.700 -0.743 0.000 2.348 1524 S HA -0.060 4.411 4.470 0.003 0.000 0.219 1524 S C 1.820 176.105 174.600 -0.525 0.000 1.033 1524 S CA 0.807 58.634 58.200 -0.621 0.000 0.974 1524 S CB -0.663 62.312 63.200 -0.375 0.000 0.868 1524 S HN 0.302 nan 8.310 nan 0.000 0.459 1525 V N 1.523 121.013 119.914 -0.706 0.000 3.440 1525 V HA 0.097 4.219 4.120 0.003 0.000 0.274 1525 V C -0.080 175.671 176.094 -0.572 0.000 1.207 1525 V CA 1.231 63.078 62.300 -0.755 0.000 1.183 1525 V CB -1.033 29.954 31.823 -1.393 0.000 0.837 1525 V HN 0.476 nan 8.190 nan 0.000 0.532 1526 E N -0.753 119.160 120.200 -0.479 0.000 3.132 1526 E HA 0.377 4.728 4.350 0.003 0.000 0.241 1526 E C -0.266 176.161 176.600 -0.289 0.000 1.196 1526 E CA -0.123 56.065 56.400 -0.352 0.000 0.869 1526 E CB 1.198 30.700 29.700 -0.329 0.000 1.387 1526 E HN 0.239 nan 8.360 nan 0.000 0.393 1527 L N -0.264 120.780 121.223 -0.299 0.000 3.223 1527 L HA 0.464 4.806 4.340 0.003 0.000 0.168 1527 L C 0.675 177.404 176.870 -0.236 0.000 1.239 1527 L CA 0.232 54.908 54.840 -0.273 0.000 0.856 1527 L CB -0.443 41.396 42.059 -0.366 0.000 1.415 1527 L HN 0.572 nan 8.230 nan 0.000 0.562 1528 C N -0.493 118.625 119.300 -0.303 0.000 0.168 1528 C HA -0.264 4.198 4.460 0.003 0.000 0.017 1528 C C 2.322 177.221 174.990 -0.152 0.000 0.171 1528 C CA 0.022 58.908 59.018 -0.219 0.000 0.499 1528 C CB -1.250 26.396 27.740 -0.156 0.000 3.212 1528 C HN 0.741 nan 8.230 nan 0.000 1.118 1529 K N 1.153 121.510 120.400 -0.072 0.000 1.990 1529 K HA -0.227 4.094 4.320 0.003 0.000 0.225 1529 K C 1.080 177.646 176.600 -0.057 0.000 1.053 1529 K CA 2.355 58.627 56.287 -0.025 0.000 0.982 1529 K CB -0.417 32.077 32.500 -0.009 0.000 0.734 1529 K HN 0.729 nan 8.250 nan 0.000 0.448 1530 K N 1.081 121.447 120.400 -0.056 0.000 2.344 1530 K HA -0.132 4.190 4.320 0.003 0.000 0.260 1530 K C -0.274 176.281 176.600 -0.075 0.000 0.988 1530 K CA 0.690 56.943 56.287 -0.057 0.000 0.909 1530 K CB 0.376 32.853 32.500 -0.038 0.000 0.968 1530 K HN 0.197 nan 8.250 nan 0.000 0.505 1531 D N -0.228 120.135 120.400 -0.061 0.000 2.997 1531 D HA -0.185 4.457 4.640 0.003 0.000 0.226 1531 D C -0.614 175.645 176.300 -0.068 0.000 1.189 1531 D CA 1.354 55.325 54.000 -0.049 0.000 0.834 1531 D CB -1.214 39.560 40.800 -0.044 0.000 1.105 1531 D HN 0.356 nan 8.370 nan 0.000 0.415 1532 S N -0.013 115.619 115.700 -0.114 0.000 2.404 1532 S HA 0.478 4.949 4.470 0.003 0.000 0.309 1532 S C -0.585 173.895 174.600 -0.200 0.000 1.076 1532 S CA -0.860 57.263 58.200 -0.130 0.000 1.095 1532 S CB 0.549 63.683 63.200 -0.110 0.000 0.972 1532 S HN 0.231 nan 8.310 nan 0.000 0.484 1533 L N 6.882 128.023 121.223 -0.137 0.000 2.287 1533 L HA 0.494 4.836 4.340 0.003 0.000 0.287 1533 L C -0.191 176.613 176.870 -0.111 0.000 1.022 1533 L CA -0.433 54.301 54.840 -0.177 0.000 0.814 1533 L CB 0.565 42.585 42.059 -0.064 0.000 1.217 1533 L HN 0.730 nan 8.230 nan 0.000 0.420 1534 Y N 3.708 124.032 120.300 0.039 0.000 2.736 1534 Y HA -0.140 4.412 4.550 0.003 0.000 0.298 1534 Y C 1.503 177.361 175.900 -0.069 0.000 1.156 1534 Y CA 0.605 58.720 58.100 0.025 0.000 1.384 1534 Y CB -0.613 37.845 38.460 -0.004 0.000 0.976 1534 Y HN 0.553 nan 8.280 nan 0.000 0.556 1535 K N -0.333 120.084 120.400 0.028 0.000 2.183 1535 K HA 0.004 4.326 4.320 0.003 0.000 0.218 1535 K C 1.506 178.047 176.600 -0.098 0.000 1.025 1535 K CA 0.833 57.087 56.287 -0.054 0.000 0.944 1535 K CB -0.883 31.599 32.500 -0.030 0.000 0.936 1535 K HN 0.060 nan 8.250 nan 0.000 0.460 1536 D N 1.178 121.528 120.400 -0.084 0.000 2.309 1536 D HA -0.044 4.598 4.640 0.003 0.000 0.212 1536 D C 1.441 177.439 176.300 -0.503 0.000 0.968 1536 D CA 0.786 54.717 54.000 -0.116 0.000 0.882 1536 D CB 0.112 40.935 40.800 0.038 0.000 0.918 1536 D HN 0.323 nan 8.370 nan 0.000 0.503 1537 A N -0.230 122.265 122.820 -0.541 0.000 2.066 1537 A HA -0.063 4.259 4.320 0.003 0.000 0.218 1537 A C 1.711 178.961 177.584 -0.556 0.000 1.157 1537 A CA 0.740 52.165 52.037 -1.019 0.000 0.670 1537 A CB -0.141 18.736 19.000 -0.205 0.000 0.804 1537 A HN 0.158 nan 8.150 nan 0.000 0.453 1538 M N -0.560 118.935 119.600 -0.176 0.000 2.505 1538 M HA 0.142 4.624 4.480 0.003 0.000 0.230 1538 M C 0.817 177.173 176.300 0.093 0.000 1.153 1538 M CA 0.593 55.956 55.300 0.105 0.000 0.997 1538 M CB 0.135 32.796 32.600 0.102 0.000 1.606 1538 M HN 0.373 nan 8.290 nan 0.000 0.481 1539 Q N -1.226 118.522 119.800 -0.088 0.000 2.279 1539 Q HA 0.108 4.450 4.340 0.003 0.000 0.261 1539 Q C 1.389 177.433 176.000 0.073 0.000 0.796 1539 Q CA 0.545 56.366 55.803 0.031 0.000 0.971 1539 Q CB -0.032 28.730 28.738 0.041 0.000 1.179 1539 Q HN 0.653 nan 8.270 nan 0.000 0.505 1540 Y N -0.753 119.600 120.300 0.089 0.000 2.546 1540 Y HA 0.531 5.083 4.550 0.003 0.000 0.287 1540 Y C 1.731 177.644 175.900 0.022 0.000 1.158 1540 Y CA 0.096 58.228 58.100 0.054 0.000 1.307 1540 Y CB -0.840 37.647 38.460 0.044 0.000 1.036 1540 Y HN -0.020 nan 8.280 nan 0.000 0.532 1541 A N 0.382 123.382 122.820 0.299 0.000 1.878 1541 A HA -0.082 4.240 4.320 0.003 0.000 0.213 1541 A C 2.490 180.077 177.584 0.004 0.000 1.192 1541 A CA 1.295 53.423 52.037 0.150 0.000 0.619 1541 A CB -1.281 17.749 19.000 0.050 0.000 0.837 1541 A HN 0.428 nan 8.150 nan 0.000 0.446 1542 S N 0.327 116.026 115.700 -0.002 0.000 2.406 1542 S HA -0.333 4.139 4.470 0.003 0.000 0.242 1542 S C 1.723 176.170 174.600 -0.255 0.000 1.079 1542 S CA 2.336 60.483 58.200 -0.089 0.000 1.133 1542 S CB -0.564 62.674 63.200 0.063 0.000 1.005 1542 S HN 0.660 nan 8.310 nan 0.000 0.443 1543 E N 0.954 121.081 120.200 -0.121 0.000 2.338 1543 E HA 0.029 4.381 4.350 0.003 0.000 0.197 1543 E C 0.995 177.538 176.600 -0.095 0.000 1.007 1543 E CA 0.287 56.614 56.400 -0.121 0.000 0.849 1543 E CB -0.078 29.615 29.700 -0.012 0.000 0.774 1543 E HN 0.461 nan 8.360 nan 0.000 0.506 1544 S N 0.452 116.113 115.700 -0.065 0.000 2.589 1544 S HA -0.015 4.457 4.470 0.003 0.000 0.256 1544 S C 0.982 175.548 174.600 -0.056 0.000 1.383 1544 S CA 0.318 58.499 58.200 -0.031 0.000 0.983 1544 S CB 0.654 63.845 63.200 -0.014 0.000 0.908 1544 S HN 0.150 nan 8.310 nan 0.000 0.572 1545 K N -0.492 119.897 120.400 -0.018 0.000 2.567 1545 K HA 0.115 4.436 4.320 0.003 0.000 0.218 1545 K C -0.268 176.330 176.600 -0.004 0.000 1.440 1545 K CA 0.034 56.308 56.287 -0.023 0.000 0.995 1545 K CB 0.364 32.854 32.500 -0.017 0.000 1.186 1545 K HN 0.442 nan 8.250 nan 0.000 0.593 1546 D N 1.856 122.270 120.400 0.023 0.000 3.008 1546 D HA 0.030 4.672 4.640 0.003 0.000 0.242 1546 D C 0.448 176.768 176.300 0.032 0.000 1.222 1546 D CA 0.478 54.503 54.000 0.041 0.000 0.883 1546 D CB 0.023 40.884 40.800 0.103 0.000 1.110 1546 D HN 0.063 nan 8.370 nan 0.000 0.455 1547 T N 0.407 114.965 114.554 0.007 0.000 2.142 1547 T HA -0.398 3.954 4.350 0.003 0.000 0.179 1547 T C 1.555 176.265 174.700 0.017 0.000 1.682 1547 T CA 2.134 64.235 62.100 0.001 0.000 0.955 1547 T CB -0.563 68.312 68.868 0.013 0.000 0.784 1547 T HN 0.423 nan 8.240 nan 0.000 0.441 1548 E N 1.376 121.599 120.200 0.039 0.000 2.236 1548 E HA -0.158 4.194 4.350 0.003 0.000 0.205 1548 E C 2.088 178.733 176.600 0.075 0.000 1.028 1548 E CA 0.748 57.184 56.400 0.059 0.000 0.827 1548 E CB -0.746 28.988 29.700 0.057 0.000 0.735 1548 E HN 0.402 nan 8.360 nan 0.000 0.470 1549 L N 0.327 121.589 121.223 0.066 0.000 2.351 1549 L HA -0.134 4.207 4.340 0.003 0.000 0.220 1549 L C 2.172 179.083 176.870 0.069 0.000 1.127 1549 L CA 1.414 56.296 54.840 0.070 0.000 0.786 1549 L CB -1.231 40.864 42.059 0.059 0.000 0.914 1549 L HN 0.113 nan 8.230 nan 0.000 0.443 1550 A N -0.446 122.390 122.820 0.026 0.000 1.873 1550 A HA -0.196 4.125 4.320 0.003 0.000 0.215 1550 A C 2.147 179.941 177.584 0.350 0.000 1.186 1550 A CA 1.286 53.329 52.037 0.009 0.000 0.616 1550 A CB -0.336 18.626 19.000 -0.064 0.000 0.823 1550 A HN 0.454 nan 8.150 nan 0.000 0.442 1551 E N -0.356 119.990 120.200 0.244 0.000 2.153 1551 E HA -0.180 4.172 4.350 0.003 0.000 0.194 1551 E C 1.975 178.727 176.600 0.254 0.000 0.988 1551 E CA 1.001 57.544 56.400 0.239 0.000 0.811 1551 E CB -0.124 29.661 29.700 0.142 0.000 0.746 1551 E HN 0.617 nan 8.360 nan 0.000 0.466 1552 E N 0.802 121.130 120.200 0.212 0.000 2.012 1552 E HA -0.191 4.161 4.350 0.003 0.000 0.197 1552 E C 2.361 179.138 176.600 0.295 0.000 1.007 1552 E CA 0.857 57.371 56.400 0.190 0.000 0.816 1552 E CB -0.267 29.501 29.700 0.113 0.000 0.762 1552 E HN 0.243 nan 8.360 nan 0.000 0.451 1553 L N 0.481 121.922 121.223 0.364 0.000 1.971 1553 L HA -0.254 4.088 4.340 0.003 0.000 0.215 1553 L C 2.755 180.142 176.870 0.862 0.000 1.072 1553 L CA 0.855 56.046 54.840 0.584 0.000 0.758 1553 L CB -0.554 41.933 42.059 0.712 0.000 0.889 1553 L HN 0.166 nan 8.230 nan 0.000 0.433 1554 L N -0.089 121.708 121.223 0.957 0.000 1.990 1554 L HA -0.294 4.048 4.340 0.003 0.000 0.213 1554 L C 2.640 179.770 176.870 0.434 0.000 1.072 1554 L CA 1.952 57.224 54.840 0.719 0.000 0.755 1554 L CB -0.712 41.583 42.059 0.393 0.000 0.889 1554 L HN 0.275 nan 8.230 nan 0.000 0.432 1555 Q N -1.330 118.675 119.800 0.342 0.000 2.173 1555 Q HA -0.303 4.039 4.340 0.003 0.000 0.208 1555 Q C 1.957 178.105 176.000 0.246 0.000 0.989 1555 Q CA 2.637 58.589 55.803 0.248 0.000 0.872 1555 Q CB -0.739 28.128 28.738 0.215 0.000 0.909 1555 Q HN 0.679 nan 8.270 nan 0.000 0.420 1556 W N -0.449 120.927 121.300 0.127 0.000 2.407 1556 W HA -0.094 4.568 4.660 0.003 0.000 0.305 1556 W C 1.323 177.866 176.519 0.039 0.000 1.196 1556 W CA 1.076 58.440 57.345 0.031 0.000 1.311 1556 W CB -0.819 28.592 29.460 -0.082 0.000 1.135 1556 W HN 0.143 nan 8.180 nan 0.000 0.514 1557 F N 0.972 120.459 119.950 -0.770 0.000 2.085 1557 F HA -0.307 4.221 4.527 0.003 0.000 0.299 1557 F C 2.395 177.852 175.800 -0.572 0.000 1.096 1557 F CA 2.268 59.634 58.000 -1.056 0.000 1.227 1557 F CB -1.596 37.094 39.000 -0.517 0.000 0.983 1557 F HN -0.007 nan 8.300 nan 0.000 0.482 1558 L N 0.205 121.383 121.223 -0.076 0.000 1.989 1558 L HA -0.234 4.108 4.340 0.003 0.000 0.211 1558 L C 2.120 178.953 176.870 -0.062 0.000 1.071 1558 L CA 1.949 56.775 54.840 -0.024 0.000 0.749 1558 L CB -0.909 41.195 42.059 0.075 0.000 0.890 1558 L HN 0.199 nan 8.230 nan 0.000 0.431 1559 Q N -1.339 118.426 119.800 -0.058 0.000 2.482 1559 Q HA -0.053 4.289 4.340 0.003 0.000 0.209 1559 Q C 1.011 176.997 176.000 -0.023 0.000 0.961 1559 Q CA 0.613 56.399 55.803 -0.027 0.000 0.945 1559 Q CB 0.313 29.063 28.738 0.020 0.000 1.012 1559 Q HN 0.535 nan 8.270 nan 0.000 0.515 1560 E N -0.751 119.384 120.200 -0.109 0.000 2.633 1560 E HA 0.090 4.441 4.350 0.003 0.000 0.214 1560 E C -0.406 176.156 176.600 -0.063 0.000 0.898 1560 E CA 0.293 56.679 56.400 -0.023 0.000 1.422 1560 E CB 1.163 30.982 29.700 0.197 0.000 1.398 1560 E HN 0.035 nan 8.360 nan 0.000 0.752 1561 E N -0.338 119.731 120.200 -0.219 0.000 2.456 1561 E HA 0.347 4.698 4.350 0.003 0.000 0.276 1561 E C 0.022 176.575 176.600 -0.078 0.000 0.981 1561 E CA -0.295 56.039 56.400 -0.110 0.000 0.814 1561 E CB 1.205 30.815 29.700 -0.150 0.000 1.382 1561 E HN -0.317 nan 8.360 nan 0.000 0.459 1562 K N 0.596 120.972 120.400 -0.041 0.000 2.425 1562 K HA 0.234 4.555 4.320 0.003 0.000 0.201 1562 K C 1.094 177.657 176.600 -0.061 0.000 1.128 1562 K CA -0.049 56.208 56.287 -0.050 0.000 1.000 1562 K CB 0.377 32.845 32.500 -0.053 0.000 0.961 1562 K HN 0.376 nan 8.250 nan 0.000 0.555 1563 R N 2.580 123.051 120.500 -0.047 0.000 2.366 1563 R HA -0.073 4.268 4.340 0.003 0.000 0.201 1563 R C 1.382 177.598 176.300 -0.140 0.000 1.057 1563 R CA 0.413 56.477 56.100 -0.059 0.000 1.086 1563 R CB -0.040 30.246 30.300 -0.024 0.000 0.914 1563 R HN 0.296 nan 8.270 nan 0.000 0.476 1564 E N -0.766 119.325 120.200 -0.181 0.000 2.236 1564 E HA -0.330 4.022 4.350 0.003 0.000 0.205 1564 E C 1.416 177.780 176.600 -0.393 0.000 1.028 1564 E CA 1.734 57.914 56.400 -0.366 0.000 0.827 1564 E CB -0.718 28.878 29.700 -0.173 0.000 0.735 1564 E HN 0.373 nan 8.360 nan 0.000 0.470 1565 C N 0.740 119.910 119.300 -0.217 0.000 2.437 1565 C HA -0.198 4.264 4.460 0.003 0.000 0.284 1565 C C 2.401 177.226 174.990 -0.275 0.000 1.208 1565 C CA 1.032 59.934 59.018 -0.193 0.000 1.764 1565 C CB -1.487 26.195 27.740 -0.097 0.000 2.039 1565 C HN 0.513 nan 8.230 nan 0.000 0.444 1566 F N 1.929 121.700 119.950 -0.299 0.000 2.236 1566 F HA -0.028 4.500 4.527 0.003 0.000 0.302 1566 F C 2.081 177.630 175.800 -0.418 0.000 1.073 1566 F CA 1.398 59.231 58.000 -0.278 0.000 1.336 1566 F CB -0.766 38.134 39.000 -0.167 0.000 1.040 1566 F HN 0.269 nan 8.300 nan 0.000 0.507 1567 G N -0.410 108.094 108.800 -0.494 0.000 2.679 1567 G HA2 -0.176 3.785 3.960 0.003 0.000 0.214 1567 G HA3 -0.176 3.785 3.960 0.003 0.000 0.214 1567 G C 1.765 175.811 174.900 -1.423 0.000 1.315 1567 G CA 0.777 45.180 45.100 -1.161 0.000 0.836 1567 G HN 0.468 nan 8.290 nan 0.000 0.580 1568 A N -0.989 121.097 122.820 -1.224 0.000 2.255 1568 A HA -0.059 4.263 4.320 0.003 0.000 0.218 1568 A C 2.303 179.371 177.584 -0.861 0.000 1.175 1568 A CA 1.931 53.389 52.037 -0.964 0.000 0.682 1568 A CB -0.772 17.940 19.000 -0.480 0.000 0.784 1568 A HN 0.418 nan 8.150 nan 0.000 0.482 1569 C N -2.377 116.381 119.300 -0.904 0.000 2.587 1569 C HA 0.200 4.662 4.460 0.003 0.000 0.287 1569 C C 2.346 176.936 174.990 -0.666 0.000 1.374 1569 C CA 0.502 58.827 59.018 -1.156 0.000 1.770 1569 C CB -1.265 25.940 27.740 -0.892 0.000 2.137 1569 C HN 0.696 nan 8.230 nan 0.000 0.550 1570 L N 0.398 121.359 121.223 -0.437 0.000 2.261 1570 L HA -0.126 4.216 4.340 0.003 0.000 0.216 1570 L C 2.158 179.096 176.870 0.113 0.000 1.114 1570 L CA 1.566 56.302 54.840 -0.172 0.000 0.777 1570 L CB -0.374 41.652 42.059 -0.054 0.000 0.910 1570 L HN 0.186 nan 8.230 nan 0.000 0.440 1571 F N 0.412 120.240 119.950 -0.204 0.000 2.031 1571 F HA -0.236 4.293 4.527 0.003 0.000 0.295 1571 F C 2.841 178.599 175.800 -0.070 0.000 1.133 1571 F CA 1.825 59.769 58.000 -0.092 0.000 1.188 1571 F CB -1.611 37.323 39.000 -0.111 0.000 0.974 1571 F HN 0.243 nan 8.300 nan 0.000 0.473 1572 T N -1.895 112.689 114.554 0.050 0.000 2.607 1572 T HA -0.310 4.042 4.350 0.003 0.000 0.267 1572 T C 2.192 176.947 174.700 0.092 0.000 1.049 1572 T CA 1.795 63.935 62.100 0.067 0.000 1.162 1572 T CB -1.573 67.372 68.868 0.128 0.000 0.863 1572 T HN 0.327 nan 8.240 nan 0.000 0.424 1573 C N -0.081 119.242 119.300 0.037 0.000 2.391 1573 C HA -0.110 4.352 4.460 0.003 0.000 0.276 1573 C C 1.354 176.300 174.990 -0.072 0.000 1.191 1573 C CA -0.167 58.839 59.018 -0.020 0.000 1.808 1573 C CB -1.802 25.894 27.740 -0.074 0.000 2.095 1573 C HN 0.561 nan 8.230 nan 0.000 0.478 1574 Y N 2.126 122.405 120.300 -0.035 0.000 2.587 1574 Y HA 0.168 4.720 4.550 0.003 0.000 0.344 1574 Y C 0.905 176.781 175.900 -0.038 0.000 1.061 1574 Y CA 0.506 58.588 58.100 -0.031 0.000 1.370 1574 Y CB -0.576 37.876 38.460 -0.013 0.000 1.163 1574 Y HN 0.452 nan 8.280 nan 0.000 0.527 1575 D N 1.170 121.630 120.400 0.099 0.000 4.092 1575 D HA -0.326 4.315 4.640 0.003 0.000 0.241 1575 D C -1.093 175.224 176.300 0.028 0.000 0.686 1575 D CA 2.120 56.145 54.000 0.042 0.000 0.904 1575 D CB -0.566 40.293 40.800 0.098 0.000 0.399 1575 D HN 0.347 nan 8.370 nan 0.000 0.335 1576 L N -0.482 120.779 121.223 0.064 0.000 2.588 1576 L HA 0.415 4.757 4.340 0.003 0.000 0.263 1576 L C -0.683 176.230 176.870 0.071 0.000 0.935 1576 L CA -0.371 54.511 54.840 0.070 0.000 0.891 1576 L CB 1.596 43.693 42.059 0.064 0.000 1.318 1576 L HN 0.481 nan 8.230 nan 0.000 0.409 1577 L N 1.055 122.323 121.223 0.075 0.000 2.993 1577 L HA 0.600 4.941 4.340 0.003 0.000 0.264 1577 L C 0.746 177.664 176.870 0.079 0.000 1.154 1577 L CA -0.331 54.542 54.840 0.056 0.000 0.972 1577 L CB 0.148 42.221 42.059 0.023 0.000 1.373 1577 L HN 0.415 nan 8.230 nan 0.000 0.564 1578 R N 2.527 123.094 120.500 0.111 0.000 2.755 1578 R HA 0.459 4.801 4.340 0.003 0.000 0.268 1578 R C -2.413 173.958 176.300 0.119 0.000 1.295 1578 R CA -1.775 54.410 56.100 0.141 0.000 1.379 1578 R CB 0.579 30.994 30.300 0.191 0.000 1.170 1578 R HN 0.130 nan 8.270 nan 0.000 0.584 1579 P HA 0.135 nan 4.420 nan 0.000 0.323 1579 P C 0.352 177.689 177.300 0.062 0.000 1.319 1579 P CA -0.327 62.816 63.100 0.071 0.000 0.741 1579 P CB 0.750 32.480 31.700 0.050 0.000 1.545 1580 D N -1.072 119.354 120.400 0.044 0.000 2.117 1580 D HA -0.103 4.539 4.640 0.003 0.000 0.198 1580 D C 2.001 178.251 176.300 -0.083 0.000 0.982 1580 D CA 0.954 54.966 54.000 0.020 0.000 0.828 1580 D CB -1.115 39.709 40.800 0.040 0.000 0.967 1580 D HN -0.086 nan 8.370 nan 0.000 0.464 1581 V N 1.081 120.961 119.914 -0.058 0.000 2.277 1581 V HA -0.288 3.834 4.120 0.003 0.000 0.255 1581 V C 2.596 178.608 176.094 -0.137 0.000 1.074 1581 V CA 1.614 63.860 62.300 -0.090 0.000 1.058 1581 V CB -0.741 31.063 31.823 -0.031 0.000 0.656 1581 V HN 0.090 nan 8.190 nan 0.000 0.449 1582 V N -0.766 119.108 119.914 -0.068 0.000 2.446 1582 V HA -0.093 4.028 4.120 0.003 0.000 0.244 1582 V C 2.203 178.239 176.094 -0.097 0.000 1.039 1582 V CA 1.326 63.599 62.300 -0.045 0.000 1.045 1582 V CB -0.500 31.367 31.823 0.073 0.000 0.681 1582 V HN 0.439 nan 8.190 nan 0.000 0.459 1583 L N 0.253 121.450 121.223 -0.043 0.000 2.261 1583 L HA -0.216 4.125 4.340 0.003 0.000 0.216 1583 L C 2.472 178.996 176.870 -0.578 0.000 1.114 1583 L CA 1.931 56.842 54.840 0.117 0.000 0.777 1583 L CB -0.404 41.820 42.059 0.275 0.000 0.910 1583 L HN 0.496 nan 8.230 nan 0.000 0.440 1584 E N -0.335 119.115 120.200 -1.249 0.000 2.099 1584 E HA -0.116 4.235 4.350 0.003 0.000 0.191 1584 E C 1.942 177.806 176.600 -1.228 0.000 0.962 1584 E CA 0.885 55.835 56.400 -2.417 0.000 0.826 1584 E CB 0.180 28.943 29.700 -1.561 0.000 0.788 1584 E HN 0.245 nan 8.360 nan 0.000 0.461 1585 T N 0.939 115.104 114.554 -0.647 0.000 2.755 1585 T HA -0.275 4.076 4.350 0.003 0.000 0.266 1585 T C 1.666 176.069 174.700 -0.495 0.000 1.041 1585 T CA 1.504 63.349 62.100 -0.424 0.000 1.147 1585 T CB -0.303 68.434 68.868 -0.217 0.000 0.847 1585 T HN 0.328 nan 8.240 nan 0.000 0.478 1586 A N -0.095 122.420 122.820 -0.508 0.000 2.123 1586 A HA 0.073 4.395 4.320 0.003 0.000 0.214 1586 A C 1.924 179.306 177.584 -0.336 0.000 1.152 1586 A CA 0.504 52.322 52.037 -0.365 0.000 0.728 1586 A CB -0.470 18.394 19.000 -0.226 0.000 0.814 1586 A HN 0.569 nan 8.150 nan 0.000 0.464 1587 W N -0.273 120.734 121.300 -0.488 0.000 2.463 1587 W HA 0.057 4.719 4.660 0.003 0.000 0.316 1587 W C 2.079 178.447 176.519 -0.250 0.000 1.170 1587 W CA 0.289 57.402 57.345 -0.387 0.000 1.355 1587 W CB -1.368 27.918 29.460 -0.290 0.000 1.159 1587 W HN 0.199 nan 8.180 nan 0.000 0.487 1588 R N 0.318 120.797 120.500 -0.035 0.000 2.301 1588 R HA -0.248 4.094 4.340 0.003 0.000 0.250 1588 R C 1.538 177.857 176.300 0.032 0.000 1.102 1588 R CA 2.355 58.408 56.100 -0.079 0.000 0.933 1588 R CB -1.526 28.593 30.300 -0.302 0.000 0.955 1588 R HN 0.480 nan 8.270 nan 0.000 0.439 1589 H N -0.272 118.801 119.070 0.005 0.000 3.441 1589 H HA 0.106 4.664 4.556 0.003 0.000 0.214 1589 H C 0.745 176.069 175.328 -0.006 0.000 1.455 1589 H CA -0.127 55.920 56.048 -0.002 0.000 1.762 1589 H CB -0.517 29.239 29.762 -0.009 0.000 1.361 1589 H HN 0.292 nan 8.280 nan 0.000 0.736 1590 N N 3.767 122.553 118.700 0.144 0.000 2.513 1590 N HA -0.187 4.554 4.740 0.003 0.000 0.296 1590 N C 1.125 176.638 175.510 0.004 0.000 1.164 1590 N CA 0.395 53.478 53.050 0.054 0.000 1.156 1590 N CB -0.485 38.028 38.487 0.044 0.000 1.389 1590 N HN 0.611 nan 8.380 nan 0.000 0.521 1591 I N -0.797 119.776 120.570 0.005 0.000 2.181 1591 I HA -0.340 3.832 4.170 0.003 0.000 0.240 1591 I C 1.097 177.210 176.117 -0.007 0.000 1.006 1591 I CA 1.625 62.913 61.300 -0.019 0.000 1.284 1591 I CB 0.060 38.056 38.000 -0.006 0.000 0.990 1591 I HN 0.502 nan 8.210 nan 0.000 0.408 1592 M N 1.456 121.067 119.600 0.018 0.000 2.444 1592 M HA 0.230 4.712 4.480 0.003 0.000 0.319 1592 M C -1.261 175.079 176.300 0.067 0.000 1.183 1592 M CA 0.121 55.443 55.300 0.036 0.000 1.032 1592 M CB 0.853 33.472 32.600 0.031 0.000 1.569 1592 M HN 0.544 nan 8.290 nan 0.000 0.468 1593 D N 3.106 123.562 120.400 0.093 0.000 4.535 1593 D HA -0.160 4.481 4.640 0.003 0.000 0.236 1593 D C -0.828 175.650 176.300 0.297 0.000 1.142 1593 D CA 0.489 54.573 54.000 0.140 0.000 1.102 1593 D CB -1.245 39.627 40.800 0.120 0.000 0.703 1593 D HN 0.677 nan 8.370 nan 0.000 0.331 1594 F N 0.305 120.279 119.950 0.040 0.000 2.533 1594 F HA 0.238 4.767 4.527 0.003 0.000 0.450 1594 F C 0.378 176.213 175.800 0.058 0.000 0.879 1594 F CA 0.496 58.538 58.000 0.070 0.000 0.718 1594 F CB -0.394 38.666 39.000 0.099 0.000 1.366 1594 F HN 0.577 nan 8.300 nan 0.000 0.529 1595 A N 1.798 124.682 122.820 0.107 0.000 2.522 1595 A HA 0.493 4.815 4.320 0.003 0.000 0.256 1595 A C 0.335 177.911 177.584 -0.013 0.000 1.086 1595 A CA 1.327 53.370 52.037 0.010 0.000 0.763 1595 A CB -0.081 18.932 19.000 0.022 0.000 1.024 1595 A HN 0.537 nan 8.150 nan 0.000 0.502 1596 M N 0.427 120.006 119.600 -0.035 0.000 1.465 1596 M HA 0.260 4.742 4.480 0.003 0.000 0.172 1596 M C -2.339 173.991 176.300 0.050 0.000 1.045 1596 M CA -0.071 55.236 55.300 0.012 0.000 0.720 1596 M CB -1.650 30.971 32.600 0.035 0.000 1.652 1596 M HN 0.266 nan 8.290 nan 0.000 0.631 1597 P HA -0.181 nan 4.420 nan 0.000 0.260 1597 P C -1.084 176.271 177.300 0.091 0.000 1.088 1597 P CA 1.343 64.289 63.100 -0.257 0.000 0.748 1597 P CB 0.002 31.486 31.700 -0.360 0.000 0.660 1598 Y N 2.311 122.558 120.300 -0.088 0.000 3.006 1598 Y HA 0.089 4.640 4.550 0.003 0.000 0.236 1598 Y C 1.880 177.749 175.900 -0.052 0.000 1.088 1598 Y CA 0.360 58.469 58.100 0.014 0.000 1.307 1598 Y CB -0.566 37.944 38.460 0.085 0.000 1.445 1598 Y HN 0.293 nan 8.280 nan 0.000 0.433 1599 F N -0.383 119.557 119.950 -0.017 0.000 2.179 1599 F HA 0.099 4.628 4.527 0.003 0.000 0.292 1599 F C 1.833 177.590 175.800 -0.072 0.000 1.089 1599 F CA 1.034 58.994 58.000 -0.066 0.000 1.295 1599 F CB -1.596 37.365 39.000 -0.065 0.000 1.041 1599 F HN -0.100 nan 8.300 nan 0.000 0.487 1600 I N 0.412 120.399 120.570 -0.972 0.000 2.381 1600 I HA -0.294 3.877 4.170 0.003 0.000 0.255 1600 I C 1.834 177.792 176.117 -0.266 0.000 1.140 1600 I CA 1.390 62.358 61.300 -0.554 0.000 1.404 1600 I CB -0.592 37.003 38.000 -0.675 0.000 1.075 1600 I HN 0.283 nan 8.210 nan 0.000 0.433 1601 Q N -0.395 119.252 119.800 -0.255 0.000 2.376 1601 Q HA 0.043 4.385 4.340 0.003 0.000 0.206 1601 Q C 2.221 178.169 176.000 -0.087 0.000 0.921 1601 Q CA 0.507 56.222 55.803 -0.146 0.000 0.911 1601 Q CB -0.197 28.448 28.738 -0.155 0.000 1.032 1601 Q HN 0.286 nan 8.270 nan 0.000 0.510 1602 V N 1.477 121.332 119.914 -0.098 0.000 2.392 1602 V HA -0.290 3.832 4.120 0.003 0.000 0.249 1602 V C 2.034 178.102 176.094 -0.042 0.000 1.059 1602 V CA 2.179 64.439 62.300 -0.068 0.000 1.051 1602 V CB -0.715 31.054 31.823 -0.090 0.000 0.658 1602 V HN 0.552 nan 8.190 nan 0.000 0.455 1603 M N -1.638 117.931 119.600 -0.051 0.000 2.447 1603 M HA 0.054 4.536 4.480 0.003 0.000 0.264 1603 M C 1.961 178.314 176.300 0.089 0.000 1.095 1603 M CA 1.402 56.704 55.300 0.004 0.000 1.125 1603 M CB -0.459 32.137 32.600 -0.007 0.000 1.389 1603 M HN 0.053 nan 8.290 nan 0.000 0.459 1604 K N 1.483 121.903 120.400 0.034 0.000 1.967 1604 K HA -0.054 4.267 4.320 0.003 0.000 0.212 1604 K C 1.866 178.495 176.600 0.049 0.000 1.044 1604 K CA 1.748 58.051 56.287 0.027 0.000 0.942 1604 K CB -0.185 32.303 32.500 -0.020 0.000 0.726 1604 K HN 0.424 nan 8.250 nan 0.000 0.440 1605 E N -0.381 119.847 120.200 0.046 0.000 2.478 1605 E HA -0.138 4.214 4.350 0.003 0.000 0.198 1605 E C 1.540 178.182 176.600 0.069 0.000 1.046 1605 E CA 0.361 56.784 56.400 0.038 0.000 0.870 1605 E CB 0.107 29.815 29.700 0.014 0.000 0.818 1605 E HN 0.287 nan 8.360 nan 0.000 0.527 1606 Y N 0.450 120.737 120.300 -0.021 0.000 2.184 1606 Y HA -0.071 4.481 4.550 0.003 0.000 0.290 1606 Y C 1.624 177.521 175.900 -0.004 0.000 1.129 1606 Y CA 1.112 59.206 58.100 -0.011 0.000 1.144 1606 Y CB 0.238 38.696 38.460 -0.004 0.000 0.995 1606 Y HN -0.055 nan 8.280 nan 0.000 0.513 1607 L N -0.247 121.072 121.223 0.159 0.000 2.715 1607 L HA 0.086 4.428 4.340 0.003 0.000 0.238 1607 L C 0.633 177.524 176.870 0.034 0.000 1.212 1607 L CA 0.514 55.404 54.840 0.084 0.000 1.017 1607 L CB -0.180 41.934 42.059 0.092 0.000 1.269 1607 L HN 0.142 nan 8.230 nan 0.000 0.452 1608 T N -2.900 111.662 114.554 0.013 0.000 3.046 1608 T HA 0.087 4.439 4.350 0.003 0.000 0.270 1608 T C 1.615 176.297 174.700 -0.031 0.000 0.920 1608 T CA -0.182 61.915 62.100 -0.005 0.000 0.874 1608 T CB 0.750 69.618 68.868 0.001 0.000 1.214 1608 T HN 0.088 nan 8.240 nan 0.000 0.536 1609 K N 0.727 121.090 120.400 -0.062 0.000 2.262 1609 K HA 0.259 4.581 4.320 0.003 0.000 0.200 1609 K C 2.045 178.577 176.600 -0.112 0.000 1.058 1609 K CA 0.381 56.609 56.287 -0.098 0.000 0.974 1609 K CB 0.086 32.496 32.500 -0.149 0.000 0.910 1609 K HN 0.039 nan 8.250 nan 0.000 0.484 1610 V N 2.859 122.691 119.914 -0.136 0.000 2.720 1610 V HA -0.233 3.889 4.120 0.003 0.000 0.256 1610 V C 1.688 177.747 176.094 -0.058 0.000 1.082 1610 V CA 2.556 64.790 62.300 -0.109 0.000 1.101 1610 V CB -0.270 31.498 31.823 -0.091 0.000 0.693 1610 V HN 0.386 nan 8.190 nan 0.000 0.479 1611 D N -0.717 119.657 120.400 -0.044 0.000 2.194 1611 D HA -0.163 4.479 4.640 0.003 0.000 0.204 1611 D C 2.028 178.311 176.300 -0.029 0.000 0.964 1611 D CA 1.353 55.338 54.000 -0.026 0.000 0.846 1611 D CB -0.229 40.562 40.800 -0.015 0.000 0.962 1611 D HN 0.456 nan 8.370 nan 0.000 0.490 1612 K N 0.166 120.543 120.400 -0.039 0.000 1.978 1612 K HA -0.091 4.231 4.320 0.003 0.000 0.214 1612 K C 2.330 178.909 176.600 -0.034 0.000 1.049 1612 K CA 1.545 57.810 56.287 -0.036 0.000 0.939 1612 K CB -0.426 32.048 32.500 -0.044 0.000 0.721 1612 K HN 0.214 nan 8.250 nan 0.000 0.441 1613 L N 1.290 122.487 121.223 -0.043 0.000 2.127 1613 L HA -0.233 4.109 4.340 0.003 0.000 0.211 1613 L C 1.968 178.822 176.870 -0.028 0.000 1.089 1613 L CA 0.996 55.814 54.840 -0.037 0.000 0.757 1613 L CB -0.616 41.416 42.059 -0.046 0.000 0.899 1613 L HN 0.235 nan 8.230 nan 0.000 0.434 1614 D N 0.479 120.863 120.400 -0.027 0.000 2.097 1614 D HA -0.125 4.516 4.640 0.003 0.000 0.197 1614 D C 2.306 178.597 176.300 -0.014 0.000 0.984 1614 D CA 1.559 55.548 54.000 -0.018 0.000 0.826 1614 D CB -0.042 40.748 40.800 -0.015 0.000 0.973 1614 D HN 0.297 nan 8.370 nan 0.000 0.460 1615 A N 0.766 123.577 122.820 -0.015 0.000 1.940 1615 A HA -0.162 4.160 4.320 0.003 0.000 0.219 1615 A C 2.452 180.029 177.584 -0.012 0.000 1.176 1615 A CA 1.762 53.791 52.037 -0.012 0.000 0.631 1615 A CB -0.537 18.455 19.000 -0.012 0.000 0.814 1615 A HN 0.132 nan 8.150 nan 0.000 0.446 1616 S N -0.766 114.925 115.700 -0.015 0.000 2.353 1616 S HA -0.208 4.263 4.470 0.003 0.000 0.222 1616 S C 1.976 176.569 174.600 -0.012 0.000 1.035 1616 S CA 1.684 59.876 58.200 -0.015 0.000 1.025 1616 S CB -0.273 62.917 63.200 -0.018 0.000 0.902 1616 S HN 0.801 nan 8.310 nan 0.000 0.440 1617 E N 0.798 120.991 120.200 -0.012 0.000 2.208 1617 E HA -0.063 4.288 4.350 0.003 0.000 0.193 1617 E C 1.871 178.466 176.600 -0.007 0.000 0.988 1617 E CA 0.967 57.361 56.400 -0.010 0.000 0.828 1617 E CB -0.042 29.653 29.700 -0.010 0.000 0.763 1617 E HN 0.356 nan 8.360 nan 0.000 0.478 1618 S N 0.872 116.568 115.700 -0.007 0.000 2.348 1618 S HA -0.132 4.340 4.470 0.003 0.000 0.221 1618 S C 1.755 176.352 174.600 -0.006 0.000 1.033 1618 S CA 0.868 59.065 58.200 -0.006 0.000 1.010 1618 S CB -0.186 63.011 63.200 -0.006 0.000 0.891 1618 S HN 0.296 nan 8.310 nan 0.000 0.442 1619 L N 1.470 122.689 121.223 -0.007 0.000 2.083 1619 L HA -0.004 4.338 4.340 0.003 0.000 0.209 1619 L C 2.508 179.375 176.870 -0.006 0.000 1.083 1619 L CA 1.320 56.156 54.840 -0.006 0.000 0.752 1619 L CB -1.270 40.784 42.059 -0.007 0.000 0.899 1619 L HN 0.325 nan 8.230 nan 0.000 0.433 1620 R N 0.562 121.058 120.500 -0.006 0.000 2.132 1620 R HA -0.274 4.068 4.340 0.003 0.000 0.233 1620 R C 2.310 178.607 176.300 -0.005 0.000 1.125 1620 R CA 2.221 58.317 56.100 -0.006 0.000 0.914 1620 R CB -0.050 30.246 30.300 -0.006 0.000 0.845 1620 R HN 0.130 nan 8.270 nan 0.000 0.431 1621 K N 0.487 120.885 120.400 -0.004 0.000 2.015 1621 K HA -0.274 4.048 4.320 0.003 0.000 0.220 1621 K C 1.921 178.519 176.600 -0.003 0.000 1.055 1621 K CA 2.304 58.589 56.287 -0.003 0.000 0.951 1621 K CB -0.496 32.002 32.500 -0.003 0.000 0.725 1621 K HN 0.356 nan 8.250 nan 0.000 0.449 1622 E N 0.725 120.923 120.200 -0.003 0.000 2.045 1622 E HA -0.373 3.979 4.350 0.003 0.000 0.212 1622 E C 2.089 178.687 176.600 -0.003 0.000 1.039 1622 E CA 2.090 58.488 56.400 -0.003 0.000 0.860 1622 E CB -0.217 29.481 29.700 -0.003 0.000 0.776 1622 E HN 0.398 nan 8.360 nan 0.000 0.467 1623 E N 0.105 120.303 120.200 -0.004 0.000 2.068 1623 E HA -0.312 4.040 4.350 0.003 0.000 0.207 1623 E C 2.134 178.732 176.600 -0.003 0.000 1.032 1623 E CA 2.107 58.505 56.400 -0.004 0.000 0.839 1623 E CB -0.112 29.585 29.700 -0.004 0.000 0.758 1623 E HN 0.399 nan 8.360 nan 0.000 0.457 1624 E N -0.157 120.041 120.200 -0.003 0.000 2.051 1624 E HA -0.230 4.122 4.350 0.003 0.000 0.192 1624 E C 2.348 178.947 176.600 -0.002 0.000 0.991 1624 E CA 1.339 57.738 56.400 -0.003 0.000 0.799 1624 E CB -0.075 29.623 29.700 -0.003 0.000 0.748 1624 E HN 0.380 nan 8.360 nan 0.000 0.449 1625 Q N 0.539 120.338 119.800 -0.002 0.000 1.956 1625 Q HA -0.240 4.101 4.340 0.003 0.000 0.208 1625 Q C 2.362 178.361 176.000 -0.002 0.000 0.998 1625 Q CA 1.685 57.487 55.803 -0.002 0.000 0.855 1625 Q CB -0.442 28.295 28.738 -0.002 0.000 0.928 1625 Q HN 0.254 nan 8.270 nan 0.000 0.418 1626 A N 0.834 123.653 122.820 -0.002 0.000 1.927 1626 A HA -0.278 4.044 4.320 0.003 0.000 0.220 1626 A C 2.283 179.866 177.584 -0.002 0.000 1.185 1626 A CA 2.315 54.351 52.037 -0.002 0.000 0.639 1626 A CB -1.266 17.732 19.000 -0.002 0.000 0.820 1626 A HN 0.469 nan 8.150 nan 0.000 0.451 1627 T N -0.698 113.855 114.554 -0.002 0.000 2.564 1627 T HA -0.182 4.170 4.350 0.003 0.000 0.259 1627 T C 1.798 176.497 174.700 -0.002 0.000 1.087 1627 T CA 1.439 63.537 62.100 -0.002 0.000 1.184 1627 T CB -0.398 68.469 68.868 -0.002 0.000 0.864 1627 T HN 0.678 nan 8.240 nan 0.000 0.403 1628 E N 0.888 121.087 120.200 -0.002 0.000 2.331 1628 E HA -0.093 4.259 4.350 0.003 0.000 0.199 1628 E C -0.390 176.209 176.600 -0.001 0.000 1.008 1628 E CA 0.708 57.107 56.400 -0.001 0.000 0.843 1628 E CB 0.192 29.891 29.700 -0.001 0.000 0.761 1628 E HN 0.390 nan 8.360 nan 0.000 0.507 1629 T N -0.713 113.841 114.554 -0.001 0.000 2.932 1629 T HA 0.331 4.683 4.350 0.003 0.000 0.318 1629 T C -1.178 173.522 174.700 -0.001 0.000 1.265 1629 T CA -0.785 61.315 62.100 -0.001 0.000 1.036 1629 T CB 2.283 71.151 68.868 -0.001 0.000 1.209 1629 T HN 0.045 nan 8.240 nan 0.000 0.484 1630 Q N 0.000 119.799 119.800 -0.001 0.000 2.315 1630 Q HA 0.000 4.342 4.340 0.003 0.000 0.214 1630 Q CA 0.000 55.802 55.803 -0.001 0.000 1.022 1630 Q CB 0.000 28.737 28.738 -0.001 0.000 1.108 1630 Q HN 0.000 nan 8.270 nan 0.000 0.481