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 2d82_1_A DATA FIRST_RESID 1077 DATA SEQUENCE GSHMRKKIFK PEELRQALMP TLEALYRQDP ESLPFRQPVD PQLLGIPDYF DATA SEQUENCE DIVKNPMDLS TIKRKLDTGQ YQEPWQYVDD VWLMFNNAWL YNRKTSRVYK DATA SEQUENCE FCSKLAEVFE QEIDPVMQSL G 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 1077 G HA2 0.000 nan 3.960 nan 0.000 0.244 1077 G HA3 0.000 3.960 3.960 0.000 0.000 0.244 1077 G C 0.000 174.928 174.900 0.046 0.000 0.946 1077 G CA 0.000 45.109 45.100 0.014 0.000 0.502 1078 S N 2.361 118.094 115.700 0.055 0.000 2.700 1078 S HA -0.040 4.471 4.470 0.069 0.000 0.321 1078 S C -0.460 174.221 174.600 0.136 0.000 1.161 1078 S CA 0.286 58.531 58.200 0.075 0.000 1.078 1078 S CB 0.287 63.519 63.200 0.054 0.000 1.302 1078 S HN 0.036 8.372 8.310 0.042 0.000 0.540 1079 H N 6.834 125.909 119.070 0.008 0.000 2.761 1079 H HA 0.093 4.656 4.556 0.011 0.000 0.284 1079 H C -1.280 174.054 175.328 0.011 0.000 1.105 1079 H CA -1.040 55.014 56.048 0.009 0.000 1.352 1079 H CB 0.710 30.476 29.762 0.006 0.000 1.423 1079 H HN -0.006 8.392 8.280 0.197 0.000 0.464 1080 M N 5.830 125.386 119.600 -0.074 0.000 2.242 1080 M HA -0.015 4.418 4.480 -0.079 0.000 0.344 1080 M C -0.505 175.635 176.300 -0.267 0.000 1.140 1080 M CA 0.409 55.636 55.300 -0.121 0.000 1.160 1080 M CB 0.408 32.989 32.600 -0.033 0.000 1.491 1080 M HN 0.191 8.505 8.290 0.039 0.000 0.459 1081 R N 0.715 121.104 120.500 -0.185 0.000 2.674 1081 R HA 0.134 4.320 4.340 -0.258 0.000 0.266 1081 R C -0.498 175.737 176.300 -0.108 0.000 1.016 1081 R CA -1.176 54.816 56.100 -0.179 0.000 1.062 1081 R CB 1.346 31.569 30.300 -0.128 0.000 1.142 1081 R HN 0.094 8.288 8.270 -0.127 0.000 0.517 1082 K N 2.521 122.874 120.400 -0.079 0.000 2.160 1082 K HA -0.191 4.122 4.320 -0.013 0.000 0.263 1082 K C -0.140 176.420 176.600 -0.068 0.000 1.120 1082 K CA 1.305 57.568 56.287 -0.040 0.000 1.115 1082 K CB -0.293 32.197 32.500 -0.017 0.000 0.971 1082 K HN 0.346 8.545 8.250 -0.085 0.000 0.400 1083 K N 5.107 125.445 120.400 -0.102 0.000 2.102 1083 K HA -0.063 4.166 4.320 -0.153 0.000 0.206 1083 K C -0.288 176.165 176.600 -0.245 0.000 1.031 1083 K CA 0.581 56.758 56.287 -0.183 0.000 0.962 1083 K CB 0.446 32.803 32.500 -0.239 0.000 0.811 1083 K HN 0.331 8.531 8.250 -0.084 0.000 0.453 1084 I N -2.943 117.445 120.570 -0.303 0.000 8.641 1084 I HA -0.312 3.780 4.170 -0.130 0.000 0.126 1084 I C -0.505 175.324 176.117 -0.480 0.000 1.749 1084 I CA 0.873 62.023 61.300 -0.250 0.000 2.183 1084 I CB -0.853 37.124 38.000 -0.038 0.000 3.671 1084 I HN 0.033 8.086 8.210 -0.262 0.000 0.212 1085 F N 1.128 121.053 119.950 -0.042 0.000 2.480 1085 F HA 0.049 4.557 4.527 -0.030 0.000 0.258 1085 F C -0.357 175.427 175.800 -0.026 0.000 0.941 1085 F CA 0.675 58.653 58.000 -0.037 0.000 1.085 1085 F CB 1.264 40.232 39.000 -0.053 0.000 1.222 1085 F HN 0.305 8.865 8.300 0.433 0.000 0.724 1086 K N -5.960 114.572 120.400 0.219 0.000 3.255 1086 K HA 0.193 4.563 4.320 0.084 0.000 0.324 1086 K C -2.112 174.530 176.600 0.070 0.000 1.085 1086 K CA -1.094 55.255 56.287 0.103 0.000 0.804 1086 K CB 1.032 33.580 32.500 0.079 0.000 1.480 1086 K HN -0.908 7.510 8.250 0.280 0.000 0.406 1087 P HA -0.016 4.423 4.420 0.032 0.000 0.218 1087 P C 0.854 178.153 177.300 -0.002 0.000 1.149 1087 P CA 2.152 65.266 63.100 0.023 0.000 0.817 1087 P CB 0.521 32.229 31.700 0.014 0.000 0.785 1088 E N -2.050 118.151 120.200 0.000 0.000 2.072 1088 E HA -0.351 3.983 4.350 -0.026 0.000 0.190 1088 E C 1.936 178.510 176.600 -0.042 0.000 0.982 1088 E CA 3.627 60.017 56.400 -0.018 0.000 0.803 1088 E CB -0.941 28.755 29.700 -0.006 0.000 0.755 1088 E HN 0.468 8.822 8.360 0.014 0.016 0.453 1089 E N -0.467 119.716 120.200 -0.027 0.000 2.047 1089 E HA -0.219 4.064 4.350 -0.112 0.000 0.191 1089 E C 2.496 178.977 176.600 -0.199 0.000 0.987 1089 E CA 2.585 58.925 56.400 -0.100 0.000 0.799 1089 E CB -0.688 29.011 29.700 -0.002 0.000 0.752 1089 E HN 0.117 8.487 8.360 0.017 0.000 0.449 1090 L N -1.749 119.386 121.223 -0.146 0.000 2.081 1090 L HA -0.427 3.743 4.340 -0.284 0.000 0.212 1090 L C 2.275 179.018 176.870 -0.212 0.000 1.080 1090 L CA 3.275 58.000 54.840 -0.191 0.000 0.754 1090 L CB -0.646 41.368 42.059 -0.074 0.000 0.893 1090 L HN 0.334 8.532 8.230 -0.053 0.000 0.433 1091 R N -1.390 119.026 120.500 -0.140 0.000 2.062 1091 R HA -0.381 3.874 4.340 -0.143 0.000 0.231 1091 R C 2.685 178.895 176.300 -0.150 0.000 1.136 1091 R CA 3.675 59.697 56.100 -0.130 0.000 0.948 1091 R CB -0.372 29.885 30.300 -0.073 0.000 0.845 1091 R HN -0.544 7.573 8.270 -0.098 0.094 0.430 1092 Q N -0.903 118.813 119.800 -0.139 0.000 2.268 1092 Q HA -0.326 3.953 4.340 -0.102 0.000 0.210 1092 Q C 1.567 177.468 176.000 -0.165 0.000 0.988 1092 Q CA 2.942 58.664 55.803 -0.134 0.000 0.883 1092 Q CB -0.337 28.320 28.738 -0.135 0.000 0.911 1092 Q HN -0.025 8.115 8.270 -0.124 0.055 0.430 1093 A N -3.093 119.591 122.820 -0.227 0.000 1.984 1093 A HA 0.092 4.299 4.320 -0.188 0.000 0.203 1093 A C 1.442 178.867 177.584 -0.265 0.000 1.292 1093 A CA 1.762 53.655 52.037 -0.240 0.000 0.782 1093 A CB 0.628 19.440 19.000 -0.314 0.000 0.924 1093 A HN -0.530 7.331 8.150 -0.255 0.137 0.475 1094 L N -0.432 120.557 121.223 -0.389 0.000 2.056 1094 L HA -0.238 3.677 4.340 -0.708 0.000 0.207 1094 L C 2.324 179.017 176.870 -0.295 0.000 1.078 1094 L CA 2.844 57.289 54.840 -0.660 0.000 0.749 1094 L CB -0.152 41.238 42.059 -1.116 0.000 0.901 1094 L HN 0.507 8.404 8.230 -0.379 0.106 0.433 1095 M N -0.940 118.559 119.600 -0.167 0.000 2.082 1095 M HA -0.265 4.230 4.480 0.025 0.000 0.258 1095 M C -1.120 175.179 176.300 -0.002 0.000 1.071 1095 M CA 5.136 60.414 55.300 -0.037 0.000 1.103 1095 M CB -3.250 29.320 32.600 -0.051 0.000 1.307 1095 M HN 0.129 8.188 8.290 -0.196 0.114 0.409 1096 P HA -0.264 4.154 4.420 -0.003 0.000 0.215 1096 P C 1.767 179.095 177.300 0.046 0.000 1.163 1096 P CA 3.251 66.346 63.100 -0.008 0.000 0.894 1096 P CB -0.583 31.093 31.700 -0.040 0.000 0.791 1097 T N 0.039 114.628 114.554 0.059 0.000 2.720 1097 T HA -0.378 4.061 4.350 0.148 0.000 0.268 1097 T C 1.912 176.776 174.700 0.273 0.000 1.037 1097 T CA 4.194 66.403 62.100 0.182 0.000 1.144 1097 T CB -0.705 68.307 68.868 0.240 0.000 0.864 1097 T HN -0.624 7.611 8.240 -0.008 0.000 0.444 1098 L N 1.565 122.951 121.223 0.272 0.000 2.043 1098 L HA -0.410 4.100 4.340 0.283 0.000 0.212 1098 L C 1.709 178.706 176.870 0.211 0.000 1.075 1098 L CA 4.038 59.034 54.840 0.261 0.000 0.752 1098 L CB -0.056 42.144 42.059 0.234 0.000 0.891 1098 L HN 0.351 8.637 8.230 0.221 0.077 0.432 1099 E N -0.973 119.313 120.200 0.142 0.000 2.153 1099 E HA -0.503 3.924 4.350 0.129 0.000 0.194 1099 E C 1.749 178.435 176.600 0.144 0.000 0.988 1099 E CA 3.054 59.526 56.400 0.119 0.000 0.811 1099 E CB -0.071 29.658 29.700 0.048 0.000 0.746 1099 E HN 0.219 8.562 8.360 0.111 0.083 0.466 1100 A N -2.258 120.645 122.820 0.139 0.000 2.067 1100 A HA -0.123 4.254 4.320 0.096 0.000 0.219 1100 A C 1.272 178.940 177.584 0.140 0.000 1.158 1100 A CA 2.534 54.647 52.037 0.126 0.000 0.661 1100 A CB -0.417 18.663 19.000 0.133 0.000 0.801 1100 A HN -0.283 7.820 8.150 0.142 0.133 0.452 1101 L N -4.186 117.143 121.223 0.177 0.000 2.354 1101 L HA -0.128 4.275 4.340 0.105 0.000 0.212 1101 L C 1.189 178.131 176.870 0.119 0.000 1.091 1101 L CA 1.363 56.289 54.840 0.143 0.000 0.828 1101 L CB 0.603 42.760 42.059 0.163 0.000 0.973 1101 L HN -0.518 7.670 8.230 0.206 0.166 0.461 1102 Y N -0.867 119.463 120.300 0.050 0.000 2.420 1102 Y HA -0.249 4.315 4.550 0.022 0.000 0.292 1102 Y C 0.879 176.778 175.900 -0.000 0.000 1.119 1102 Y CA 2.215 60.330 58.100 0.024 0.000 1.229 1102 Y CB 0.789 39.265 38.460 0.028 0.000 1.026 1102 Y HN 0.158 8.527 8.280 0.302 0.092 0.554 1103 R N -3.099 117.526 120.500 0.209 0.000 2.170 1103 R HA -0.331 4.098 4.340 0.149 0.000 0.242 1103 R C 0.393 176.717 176.300 0.039 0.000 1.145 1103 R CA 1.306 57.479 56.100 0.121 0.000 0.984 1103 R CB -0.610 29.737 30.300 0.080 0.000 0.869 1103 R HN -0.361 8.002 8.270 0.198 0.025 0.455 1104 Q N -0.576 119.216 119.800 -0.014 0.000 2.327 1104 Q HA -0.044 4.248 4.340 -0.079 0.000 0.254 1104 Q C -0.654 175.246 176.000 -0.166 0.000 0.952 1104 Q CA 0.091 55.837 55.803 -0.096 0.000 0.884 1104 Q CB 0.617 29.285 28.738 -0.117 0.000 1.224 1104 Q HN -0.720 7.514 8.270 0.006 0.039 0.422 1105 D N 2.463 122.752 120.400 -0.187 0.000 2.355 1105 D HA 0.164 4.691 4.640 -0.188 0.000 0.233 1105 D C -0.123 175.984 176.300 -0.321 0.000 0.997 1105 D CA 3.056 56.930 54.000 -0.210 0.000 0.920 1105 D CB -0.403 40.308 40.800 -0.149 0.000 1.063 1105 D HN 0.279 8.547 8.370 -0.170 0.000 0.465 1106 P HA -0.019 4.127 4.420 -0.458 0.000 0.229 1106 P C -0.013 176.795 177.300 -0.821 0.000 1.160 1106 P CA 1.766 64.496 63.100 -0.616 0.000 0.777 1106 P CB 0.007 31.233 31.700 -0.789 0.000 0.814 1107 E N -3.319 116.487 120.200 -0.656 0.000 2.340 1107 E HA -0.007 3.977 4.350 -0.610 0.000 0.194 1107 E C -0.267 175.933 176.600 -0.666 0.000 0.996 1107 E CA 1.152 57.205 56.400 -0.578 0.000 0.869 1107 E CB 0.126 29.646 29.700 -0.300 0.000 0.835 1107 E HN -0.018 7.999 8.360 -0.509 0.038 0.493 1108 S N -3.085 112.303 115.700 -0.520 0.000 2.661 1108 S HA 0.189 4.450 4.470 -0.348 0.000 0.245 1108 S C -0.648 173.654 174.600 -0.497 0.000 1.117 1108 S CA -0.615 57.308 58.200 -0.461 0.000 1.091 1108 S CB 0.085 63.028 63.200 -0.429 0.000 0.887 1108 S HN -0.736 7.199 8.310 -0.457 0.101 0.491 1109 L N 0.125 121.075 121.223 -0.454 0.000 2.296 1109 L HA 0.180 4.353 4.340 -0.277 0.000 0.193 1109 L C -0.317 176.463 176.870 -0.150 0.000 1.123 1109 L CA 3.184 57.854 54.840 -0.282 0.000 0.805 1109 L CB -1.207 40.707 42.059 -0.242 0.000 1.004 1109 L HN -0.336 7.491 8.230 -0.577 0.058 0.478 1110 P HA -0.044 4.396 4.420 0.033 0.000 0.237 1110 P C 0.317 177.787 177.300 0.284 0.000 1.178 1110 P CA 1.796 64.933 63.100 0.063 0.000 0.766 1110 P CB -0.450 31.305 31.700 0.091 0.000 0.876 1111 F N -3.399 116.513 119.950 -0.064 0.000 2.615 1111 F HA 0.079 4.583 4.527 -0.038 0.000 0.297 1111 F C 0.368 176.122 175.800 -0.076 0.000 1.124 1111 F CA -0.105 57.857 58.000 -0.064 0.000 1.451 1111 F CB -0.940 38.018 39.000 -0.070 0.000 1.103 1111 F HN -0.139 8.196 8.300 0.036 -0.013 0.569 1112 R N -4.761 115.803 120.500 0.105 0.000 2.300 1112 R HA -0.071 4.334 4.340 0.109 0.000 0.199 1112 R C -1.537 174.813 176.300 0.083 0.000 0.920 1112 R CA 0.490 56.643 56.100 0.089 0.000 1.046 1112 R CB 0.615 30.957 30.300 0.070 0.000 0.984 1112 R HN -0.655 7.502 8.270 0.056 0.146 0.493 1113 Q N -0.659 119.182 119.800 0.069 0.000 2.375 1113 Q HA 0.373 4.744 4.340 0.051 0.000 0.271 1113 Q C -2.443 173.587 176.000 0.049 0.000 1.074 1113 Q CA -3.347 52.486 55.803 0.051 0.000 0.808 1113 Q CB 1.676 30.436 28.738 0.037 0.000 1.327 1113 Q HN -0.932 7.339 8.270 0.080 0.046 0.441 1114 P HA -0.007 4.473 4.420 0.099 0.000 0.273 1114 P C -0.773 176.556 177.300 0.048 0.000 1.258 1114 P CA -0.212 62.934 63.100 0.077 0.000 0.802 1114 P CB 0.606 32.356 31.700 0.083 0.000 1.040 1115 V N -1.817 118.145 119.914 0.080 0.000 3.048 1115 V HA -0.010 4.066 4.120 -0.073 0.000 0.241 1115 V C -1.051 174.977 176.094 -0.110 0.000 1.129 1115 V CA 0.435 62.714 62.300 -0.035 0.000 1.128 1115 V CB 0.645 32.439 31.823 -0.049 0.000 0.849 1115 V HN 0.033 8.354 8.190 0.218 0.000 0.475 1116 D N -3.492 116.791 120.400 -0.195 0.000 3.278 1116 D HA -0.181 4.196 4.640 -0.438 0.000 0.233 1116 D C -1.208 174.907 176.300 -0.308 0.000 1.149 1116 D CA 0.661 54.478 54.000 -0.306 0.000 0.957 1116 D CB -1.523 39.187 40.800 -0.150 0.000 0.913 1116 D HN -0.041 8.255 8.370 -0.122 0.000 0.409 1117 P HA -0.278 4.045 4.420 -0.162 0.000 0.222 1117 P C 0.942 178.138 177.300 -0.174 0.000 1.142 1117 P CA 2.158 65.100 63.100 -0.263 0.000 0.788 1117 P CB 0.205 31.729 31.700 -0.294 0.000 0.767 1118 Q N -1.786 117.898 119.800 -0.194 0.000 1.994 1118 Q HA -0.156 4.129 4.340 -0.092 0.000 0.198 1118 Q C 2.281 178.229 176.000 -0.088 0.000 0.976 1118 Q CA 2.905 58.637 55.803 -0.118 0.000 0.828 1118 Q CB -0.468 28.198 28.738 -0.119 0.000 0.894 1118 Q HN 0.127 8.177 8.270 -0.267 0.060 0.432 1119 L N -1.690 119.477 121.223 -0.094 0.000 2.042 1119 L HA -0.265 4.043 4.340 -0.052 0.000 0.210 1119 L C 2.245 179.079 176.870 -0.059 0.000 1.076 1119 L CA 2.477 57.277 54.840 -0.066 0.000 0.749 1119 L CB -0.186 41.834 42.059 -0.066 0.000 0.893 1119 L HN -0.444 7.716 8.230 -0.118 0.000 0.432 1120 L N -3.222 117.956 121.223 -0.075 0.000 2.046 1120 L HA -0.194 4.119 4.340 -0.045 0.000 0.208 1120 L C 0.640 177.487 176.870 -0.037 0.000 1.077 1120 L CA 2.090 56.896 54.840 -0.057 0.000 0.747 1120 L CB 0.577 42.589 42.059 -0.078 0.000 0.896 1120 L HN 0.240 8.299 8.230 -0.102 0.110 0.432 1121 G N -2.814 105.960 108.800 -0.044 0.000 2.204 1121 G HA2 -0.359 3.628 3.960 -0.030 0.000 0.244 1121 G HA3 -0.359 3.591 3.960 -0.016 0.000 0.244 1121 G C -1.104 173.795 174.900 -0.002 0.000 1.062 1121 G CA 0.069 45.155 45.100 -0.023 0.000 0.798 1121 G HN -0.040 7.986 8.290 -0.068 0.222 0.496 1122 I N 0.113 120.683 120.570 0.001 0.000 2.719 1122 I HA 0.356 4.557 4.170 0.051 0.000 0.275 1122 I C -2.662 173.494 176.117 0.066 0.000 1.228 1122 I CA -4.082 57.246 61.300 0.046 0.000 1.035 1122 I CB 1.750 39.789 38.000 0.065 0.000 1.286 1122 I HN -0.469 7.726 8.210 -0.026 0.000 0.531 1123 P HA 0.104 4.554 4.420 0.050 0.000 0.263 1123 P C -1.772 175.603 177.300 0.125 0.000 1.276 1123 P CA 1.180 64.321 63.100 0.068 0.000 0.986 1123 P CB -0.356 31.373 31.700 0.047 0.000 1.105 1124 D N 0.800 121.303 120.400 0.172 0.000 1.521 1124 D HA -0.076 4.687 4.640 0.204 0.000 0.712 1124 D C -0.178 176.205 176.300 0.139 0.000 0.743 1124 D CA 1.817 55.953 54.000 0.228 0.000 1.202 1124 D CB 0.606 41.596 40.800 0.317 0.000 1.434 1124 D HN -0.180 8.297 8.370 0.177 0.000 0.482 1125 Y N 0.826 121.054 120.300 -0.119 0.000 2.497 1125 Y HA -0.399 3.270 4.550 -1.469 0.000 0.292 1125 Y C -0.686 175.146 175.900 -0.114 0.000 1.137 1125 Y CA 3.222 61.025 58.100 -0.495 0.000 1.285 1125 Y CB 0.511 38.842 38.460 -0.214 0.000 0.991 1125 Y HN -0.703 7.729 8.280 0.253 0.000 0.556 1126 F N -8.883 111.029 119.950 -0.065 0.000 2.704 1126 F HA 0.139 4.623 4.527 -0.072 0.000 0.304 1126 F C -0.352 175.423 175.800 -0.041 0.000 1.094 1126 F CA 0.229 58.201 58.000 -0.047 0.000 1.275 1126 F CB 0.979 39.981 39.000 0.003 0.000 1.073 1126 F HN -0.142 8.361 8.300 0.415 0.046 0.586 1127 D N -0.736 119.743 120.400 0.132 0.000 2.240 1127 D HA -0.037 4.656 4.640 0.089 0.000 0.206 1127 D C 1.057 177.386 176.300 0.048 0.000 0.963 1127 D CA 2.295 56.350 54.000 0.090 0.000 0.863 1127 D CB 0.511 41.377 40.800 0.110 0.000 0.973 1127 D HN -0.716 7.615 8.370 0.148 0.128 0.501 1128 I N -2.124 118.469 120.570 0.039 0.000 3.228 1128 I HA -0.087 4.112 4.170 0.048 0.000 0.279 1128 I C -0.369 175.723 176.117 -0.042 0.000 1.221 1128 I CA 1.118 62.446 61.300 0.047 0.000 1.458 1128 I CB 1.334 39.449 38.000 0.192 0.000 1.105 1128 I HN -0.773 7.455 8.210 0.030 0.000 0.445 1129 V N 0.357 120.176 119.914 -0.159 0.000 2.293 1129 V HA 0.006 4.030 4.120 -0.160 0.000 0.275 1129 V C -0.452 175.497 176.094 -0.242 0.000 1.021 1129 V CA -1.023 61.137 62.300 -0.234 0.000 0.815 1129 V CB 0.761 32.334 31.823 -0.417 0.000 1.025 1129 V HN -0.676 7.398 8.190 -0.193 0.000 0.448 1130 K N 6.326 126.633 120.400 -0.155 0.000 2.152 1130 K HA -0.261 3.998 4.320 -0.101 0.000 0.206 1130 K C -0.964 175.526 176.600 -0.184 0.000 1.048 1130 K CA 1.820 58.030 56.287 -0.129 0.000 0.933 1130 K CB 0.247 32.700 32.500 -0.079 0.000 0.721 1130 K HN 0.395 8.575 8.250 -0.117 0.000 0.447 1131 N N -2.471 116.095 118.700 -0.222 0.000 2.664 1131 N HA 0.399 5.002 4.740 -0.229 0.000 0.257 1131 N C -2.184 173.134 175.510 -0.320 0.000 1.108 1131 N CA -1.425 51.483 53.050 -0.238 0.000 0.822 1131 N CB 1.564 39.954 38.487 -0.162 0.000 1.199 1131 N HN -0.202 8.028 8.380 -0.211 0.024 0.529 1132 P HA -0.153 4.011 4.420 -0.427 0.000 0.215 1132 P C -0.484 176.652 177.300 -0.273 0.000 1.153 1132 P CA 0.690 63.527 63.100 -0.438 0.000 0.853 1132 P CB 0.566 31.863 31.700 -0.671 0.000 0.788 1133 M N -7.555 111.909 119.600 -0.227 0.000 7.319 1133 M HA -0.384 4.000 4.480 -0.159 0.000 0.157 1133 M C -2.112 174.072 176.300 -0.193 0.000 0.480 1133 M CA 0.430 55.605 55.300 -0.207 0.000 1.311 1133 M CB 0.167 32.595 32.600 -0.286 0.000 0.421 1133 M HN -0.150 8.007 8.290 -0.221 0.000 0.190 1134 D N -7.768 112.516 120.400 -0.194 0.000 2.766 1134 D HA 0.100 4.614 4.640 -0.210 0.000 0.244 1134 D C -0.128 176.094 176.300 -0.129 0.000 1.198 1134 D CA -0.496 53.413 54.000 -0.152 0.000 0.739 1134 D CB 1.442 42.214 40.800 -0.047 0.000 1.379 1134 D HN -0.263 7.985 8.370 -0.204 0.000 0.437 1135 L N 0.293 121.468 121.223 -0.081 0.000 2.197 1135 L HA -0.425 3.856 4.340 -0.099 0.000 0.215 1135 L C 1.260 178.145 176.870 0.025 0.000 1.095 1135 L CA 3.524 58.351 54.840 -0.022 0.000 0.764 1135 L CB -0.021 42.090 42.059 0.088 0.000 0.897 1135 L HN 0.781 8.880 8.230 -0.052 0.100 0.436 1136 S N -3.496 112.225 115.700 0.034 0.000 2.481 1136 S HA -0.227 4.280 4.470 0.061 0.000 0.231 1136 S C 1.952 176.556 174.600 0.007 0.000 0.996 1136 S CA 2.705 60.929 58.200 0.040 0.000 0.942 1136 S CB -0.461 62.766 63.200 0.046 0.000 0.768 1136 S HN -0.275 8.069 8.310 0.029 -0.017 0.520 1137 T N 5.949 120.489 114.554 -0.024 0.000 2.706 1137 T HA -0.261 4.080 4.350 -0.015 0.000 0.255 1137 T C 1.291 175.976 174.700 -0.025 0.000 1.048 1137 T CA 5.090 67.172 62.100 -0.030 0.000 1.153 1137 T CB 0.011 68.843 68.868 -0.060 0.000 0.865 1137 T HN 0.168 8.297 8.240 -0.043 0.086 0.414 1138 I N 1.584 122.119 120.570 -0.059 0.000 2.163 1138 I HA -0.571 3.612 4.170 0.022 0.000 0.243 1138 I C 1.501 177.653 176.117 0.058 0.000 1.085 1138 I CA 4.764 66.049 61.300 -0.026 0.000 1.347 1138 I CB -0.205 37.673 38.000 -0.203 0.000 1.044 1138 I HN -0.675 7.468 8.210 -0.111 0.000 0.408 1139 K N -1.179 119.252 120.400 0.052 0.000 2.063 1139 K HA -0.434 3.950 4.320 0.106 0.000 0.208 1139 K C 1.957 178.576 176.600 0.031 0.000 1.048 1139 K CA 3.681 60.009 56.287 0.068 0.000 0.928 1139 K CB -0.187 32.349 32.500 0.059 0.000 0.713 1139 K HN -0.504 7.760 8.250 0.022 0.000 0.442 1140 R N -1.046 119.461 120.500 0.011 0.000 2.061 1140 R HA -0.272 4.062 4.340 -0.010 0.000 0.230 1140 R C 2.234 178.514 176.300 -0.034 0.000 1.140 1140 R CA 2.797 58.891 56.100 -0.011 0.000 0.940 1140 R CB -0.467 29.825 30.300 -0.013 0.000 0.839 1140 R HN -0.579 7.613 8.270 0.011 0.084 0.429 1141 K N -0.266 120.103 120.400 -0.051 0.000 2.286 1141 K HA -0.285 3.930 4.320 -0.174 0.000 0.203 1141 K C 2.552 179.092 176.600 -0.100 0.000 1.045 1141 K CA 3.383 59.588 56.287 -0.137 0.000 0.935 1141 K CB -0.628 31.762 32.500 -0.183 0.000 0.737 1141 K HN -0.087 8.144 8.250 -0.032 0.000 0.460 1142 L N -1.153 120.065 121.223 -0.009 0.000 2.102 1142 L HA -0.237 4.115 4.340 0.020 0.000 0.202 1142 L C 1.212 178.076 176.870 -0.011 0.000 1.076 1142 L CA 3.094 57.946 54.840 0.020 0.000 0.761 1142 L CB 0.177 42.287 42.059 0.085 0.000 0.921 1142 L HN -0.181 7.905 8.230 0.016 0.154 0.444 1143 D N -3.045 117.348 120.400 -0.012 0.000 2.190 1143 D HA -0.244 4.384 4.640 -0.019 0.000 0.200 1143 D C 2.069 178.351 176.300 -0.030 0.000 0.992 1143 D CA 3.171 57.159 54.000 -0.021 0.000 0.854 1143 D CB 0.632 41.421 40.800 -0.019 0.000 0.936 1143 D HN 0.084 8.277 8.370 -0.004 0.175 0.462 1144 T N -5.942 108.587 114.554 -0.042 0.000 3.021 1144 T HA -0.034 4.293 4.350 -0.038 0.000 0.245 1144 T C 1.297 175.964 174.700 -0.055 0.000 1.028 1144 T CA 0.591 62.661 62.100 -0.049 0.000 1.139 1144 T CB 1.652 70.483 68.868 -0.062 0.000 0.884 1144 T HN -0.461 7.727 8.240 -0.049 0.022 0.457 1145 G N 3.044 111.798 108.800 -0.076 0.000 3.035 1145 G HA2 -0.237 3.691 3.960 -0.053 0.000 0.214 1145 G HA3 -0.237 3.698 3.960 -0.042 0.000 0.214 1145 G C -0.511 174.313 174.900 -0.127 0.000 1.063 1145 G CA -0.025 45.033 45.100 -0.070 0.000 1.109 1145 G HN -0.322 7.801 8.290 -0.092 0.111 0.563 1146 Q N -0.275 119.359 119.800 -0.278 0.000 2.339 1146 Q HA -0.105 4.080 4.340 -0.258 0.000 0.205 1146 Q C -0.236 175.517 176.000 -0.411 0.000 0.925 1146 Q CA 1.397 56.925 55.803 -0.458 0.000 0.898 1146 Q CB 1.170 29.419 28.738 -0.816 0.000 1.013 1146 Q HN -0.100 7.989 8.270 -0.302 0.000 0.504 1147 Y N -3.153 117.175 120.300 0.047 0.000 2.509 1147 Y HA 0.153 4.736 4.550 0.055 0.000 0.341 1147 Y C -0.180 175.753 175.900 0.055 0.000 1.038 1147 Y CA -1.604 56.530 58.100 0.058 0.000 1.089 1147 Y CB 1.460 39.967 38.460 0.078 0.000 1.241 1147 Y HN -0.213 7.933 8.280 -0.224 0.000 0.468 1148 Q N -0.672 119.269 119.800 0.234 0.000 2.317 1148 Q HA -0.005 4.407 4.340 0.119 0.000 0.220 1148 Q C -0.581 175.499 176.000 0.133 0.000 0.873 1148 Q CA -0.117 55.773 55.803 0.144 0.000 0.936 1148 Q CB 1.476 30.281 28.738 0.112 0.000 1.105 1148 Q HN 0.350 8.775 8.270 0.259 0.000 0.520 1149 E N -1.986 118.305 120.200 0.152 0.000 2.202 1149 E HA 0.261 4.654 4.350 0.072 0.000 0.272 1149 E C -1.340 175.287 176.600 0.045 0.000 0.951 1149 E CA -3.110 53.350 56.400 0.100 0.000 0.813 1149 E CB 0.854 30.656 29.700 0.171 0.000 1.151 1149 E HN -0.513 7.964 8.360 0.195 0.000 0.398 1150 P HA -0.054 4.324 4.420 -0.069 0.000 0.220 1150 P C 0.827 178.065 177.300 -0.104 0.000 1.152 1150 P CA 1.882 64.852 63.100 -0.217 0.000 0.812 1150 P CB 0.298 31.703 31.700 -0.491 0.000 0.792 1151 W N -3.645 117.739 121.300 0.139 0.000 2.350 1151 W HA -0.271 4.480 4.660 0.152 0.000 0.289 1151 W C 2.008 178.581 176.519 0.089 0.000 1.215 1151 W CA 1.447 58.864 57.345 0.119 0.000 1.236 1151 W CB -0.810 28.690 29.460 0.068 0.000 1.130 1151 W HN -0.050 7.820 8.180 -0.485 0.020 0.541 1152 Q N -2.755 117.180 119.800 0.226 0.000 2.124 1152 Q HA -0.379 3.900 4.340 -0.100 0.000 0.202 1152 Q C 2.093 178.159 176.000 0.109 0.000 0.977 1152 Q CA 3.085 58.884 55.803 -0.006 0.000 0.850 1152 Q CB -0.469 28.148 28.738 -0.201 0.000 0.901 1152 Q HN -0.387 7.986 8.270 0.211 0.023 0.429 1153 Y N 1.607 121.977 120.300 0.115 0.000 2.130 1153 Y HA -0.300 4.326 4.550 0.128 0.000 0.287 1153 Y C 1.718 177.730 175.900 0.186 0.000 1.124 1153 Y CA 3.601 61.783 58.100 0.137 0.000 1.118 1153 Y CB 0.142 38.676 38.460 0.124 0.000 0.994 1153 Y HN -0.491 7.886 8.280 0.351 0.114 0.497 1154 V N -1.421 118.817 119.914 0.541 0.000 2.546 1154 V HA -0.648 3.952 4.120 0.800 0.000 0.254 1154 V C 1.975 178.344 176.094 0.459 0.000 1.076 1154 V CA 4.138 66.810 62.300 0.621 0.000 1.087 1154 V CB -0.515 31.705 31.823 0.661 0.000 0.674 1154 V HN -0.503 8.049 8.190 0.603 0.000 0.470 1155 D N -0.820 119.753 120.400 0.288 0.000 2.162 1155 D HA -0.204 4.576 4.640 0.233 0.000 0.203 1155 D C 1.843 178.152 176.300 0.015 0.000 0.967 1155 D CA 3.485 57.587 54.000 0.170 0.000 0.840 1155 D CB 0.218 41.083 40.800 0.107 0.000 0.972 1155 D HN 0.029 8.544 8.370 0.290 0.029 0.482 1156 D N 0.303 120.646 120.400 -0.095 0.000 2.123 1156 D HA -0.154 4.380 4.640 -0.176 0.000 0.200 1156 D C 2.564 178.609 176.300 -0.425 0.000 0.976 1156 D CA 3.185 57.054 54.000 -0.218 0.000 0.831 1156 D CB 0.063 40.753 40.800 -0.183 0.000 0.974 1156 D HN -0.343 7.905 8.370 -0.060 0.087 0.469 1157 V N 0.602 120.156 119.914 -0.600 0.000 2.233 1157 V HA -0.471 2.979 4.120 -1.117 0.000 0.247 1157 V C 1.593 176.959 176.094 -1.214 0.000 1.050 1157 V CA 5.040 66.704 62.300 -1.061 0.000 1.010 1157 V CB -0.117 30.940 31.823 -1.277 0.000 0.637 1157 V HN 0.273 8.146 8.190 -0.527 0.000 0.444 1158 W N -2.289 118.686 121.300 -0.542 0.000 2.363 1158 W HA -0.346 4.278 4.660 -0.060 0.000 0.296 1158 W C 2.175 178.459 176.519 -0.391 0.000 1.212 1158 W CA 3.213 60.397 57.345 -0.267 0.000 1.260 1158 W CB 0.032 29.531 29.460 0.065 0.000 1.131 1158 W HN -0.703 7.409 8.180 -0.113 0.000 0.530 1159 L N -1.026 120.114 121.223 -0.138 0.000 2.127 1159 L HA -0.437 3.849 4.340 -0.090 0.000 0.211 1159 L C 1.175 177.831 176.870 -0.356 0.000 1.089 1159 L CA 3.311 58.039 54.840 -0.186 0.000 0.757 1159 L CB -0.321 41.632 42.059 -0.176 0.000 0.899 1159 L HN -0.136 7.925 8.230 -0.123 0.095 0.434 1160 M N -1.131 118.100 119.600 -0.616 0.000 2.099 1160 M HA -0.393 3.773 4.480 -0.523 0.000 0.262 1160 M C 2.031 177.909 176.300 -0.703 0.000 1.067 1160 M CA 3.782 58.649 55.300 -0.721 0.000 1.124 1160 M CB -0.016 31.980 32.600 -1.007 0.000 1.353 1160 M HN -0.596 7.126 8.290 -0.726 0.132 0.410 1161 F N -2.523 117.049 119.950 -0.631 0.000 2.269 1161 F HA -0.050 3.853 4.527 -1.039 0.000 0.301 1161 F C 2.514 177.757 175.800 -0.929 0.000 1.082 1161 F CA 0.429 57.844 58.000 -0.973 0.000 1.360 1161 F CB -1.599 36.767 39.000 -1.057 0.000 1.041 1161 F HN -0.506 6.861 8.300 -1.438 0.070 0.512 1162 N N -0.072 118.445 118.700 -0.306 0.000 2.058 1162 N HA -0.453 4.314 4.740 0.046 0.000 0.191 1162 N C 1.914 177.362 175.510 -0.103 0.000 1.037 1162 N CA 3.831 56.821 53.050 -0.100 0.000 0.848 1162 N CB 0.131 38.591 38.487 -0.045 0.000 1.021 1162 N HN 0.162 8.250 8.380 -0.267 0.132 0.422 1163 N N -0.445 118.142 118.700 -0.188 0.000 2.061 1163 N HA -0.362 4.297 4.740 -0.135 0.000 0.193 1163 N C 1.433 176.881 175.510 -0.102 0.000 1.030 1163 N CA 2.999 55.942 53.050 -0.178 0.000 0.856 1163 N CB -0.337 37.984 38.487 -0.277 0.000 1.023 1163 N HN -0.570 7.663 8.380 -0.245 0.000 0.424 1164 A N 0.318 123.036 122.820 -0.170 0.000 1.859 1164 A HA -0.301 4.097 4.320 0.130 0.000 0.217 1164 A C 2.222 179.968 177.584 0.269 0.000 1.198 1164 A CA 2.957 54.991 52.037 -0.005 0.000 0.629 1164 A CB -0.504 18.356 19.000 -0.233 0.000 0.830 1164 A HN -0.469 7.494 8.150 -0.311 0.000 0.446 1165 W N -7.288 114.105 121.300 0.155 0.000 2.825 1165 W HA 0.094 5.085 4.660 0.553 0.000 0.243 1165 W C 1.142 177.785 176.519 0.207 0.000 1.293 1165 W CA -0.361 57.155 57.345 0.285 0.000 1.403 1165 W CB -1.106 28.479 29.460 0.209 0.000 1.134 1165 W HN -0.103 7.934 8.180 -0.239 0.000 0.666 1166 L N -2.254 119.151 121.223 0.304 0.000 2.463 1166 L HA -0.061 4.390 4.340 0.186 0.000 0.219 1166 L C 0.109 177.076 176.870 0.161 0.000 1.088 1166 L CA 1.609 56.559 54.840 0.183 0.000 0.849 1166 L CB -0.020 42.093 42.059 0.091 0.000 1.012 1166 L HN -0.594 7.549 8.230 0.220 0.219 0.468 1167 Y N -1.780 118.527 120.300 0.011 0.000 2.512 1167 Y HA 0.032 4.558 4.550 -0.040 0.000 0.268 1167 Y C 0.649 176.591 175.900 0.069 0.000 1.102 1167 Y CA 0.740 58.814 58.100 -0.043 0.000 1.261 1167 Y CB 2.290 40.579 38.460 -0.285 0.000 1.250 1167 Y HN -0.009 8.421 8.280 0.250 0.000 0.506 1168 N N -1.332 117.519 118.700 0.251 0.000 2.405 1168 N HA -0.021 4.809 4.740 0.150 0.000 0.175 1168 N C -0.102 175.499 175.510 0.152 0.000 1.051 1168 N CA 1.055 54.246 53.050 0.235 0.000 0.899 1168 N CB 1.437 40.168 38.487 0.406 0.000 1.000 1168 N HN 0.012 8.494 8.380 0.340 0.102 0.451 1169 R N -3.233 117.386 120.500 0.199 0.000 3.724 1169 R HA -0.453 3.920 4.340 0.054 0.000 0.526 1169 R C -1.278 174.820 176.300 -0.337 0.000 0.241 1169 R CA 1.809 57.908 56.100 -0.001 0.000 1.638 1169 R CB -0.068 30.188 30.300 -0.073 0.000 0.980 1169 R HN -0.694 7.758 8.270 0.304 0.000 0.575 1170 K N -3.181 116.908 120.400 -0.518 0.000 2.410 1170 K HA 0.012 3.606 4.320 -1.211 0.000 0.200 1170 K C 0.211 176.631 176.600 -0.301 0.000 1.023 1170 K CA 0.783 56.650 56.287 -0.700 0.000 1.149 1170 K CB -0.020 32.123 32.500 -0.595 0.000 0.859 1170 K HN 0.213 8.253 8.250 -0.350 0.000 0.514 1171 T N -2.262 112.185 114.554 -0.178 0.000 3.240 1171 T HA 0.099 4.387 4.350 -0.103 0.000 0.248 1171 T C -0.405 174.264 174.700 -0.051 0.000 0.929 1171 T CA -0.145 61.895 62.100 -0.100 0.000 0.939 1171 T CB -0.143 68.674 68.868 -0.085 0.000 1.114 1171 T HN -0.670 7.393 8.240 -0.167 0.077 0.558 1172 S N -0.137 115.542 115.700 -0.035 0.000 2.543 1172 S HA 0.159 4.617 4.470 -0.019 0.000 0.274 1172 S C -0.100 174.472 174.600 -0.047 0.000 1.149 1172 S CA -0.877 57.321 58.200 -0.003 0.000 0.866 1172 S CB 1.824 65.069 63.200 0.075 0.000 1.111 1172 S HN -0.730 7.464 8.310 -0.060 0.080 0.457 1173 R N 4.580 124.978 120.500 -0.170 0.000 2.237 1173 R HA -0.137 3.966 4.340 -0.397 0.000 0.219 1173 R C 0.776 176.635 176.300 -0.735 0.000 1.080 1173 R CA 2.645 58.444 56.100 -0.502 0.000 0.995 1173 R CB -0.429 29.514 30.300 -0.595 0.000 0.875 1173 R HN 0.617 8.811 8.270 -0.126 0.000 0.462 1174 V N -2.735 117.034 119.914 -0.241 0.000 2.358 1174 V HA -0.361 3.798 4.120 0.065 0.000 0.246 1174 V C 0.964 177.226 176.094 0.279 0.000 1.047 1174 V CA 3.687 66.032 62.300 0.075 0.000 1.035 1174 V CB -0.138 31.854 31.823 0.282 0.000 0.658 1174 V HN -0.729 7.361 8.190 -0.090 0.046 0.452 1175 Y N 1.064 121.469 120.300 0.175 0.000 2.256 1175 Y HA -0.498 4.395 4.550 0.572 0.000 0.288 1175 Y C 1.135 177.196 175.900 0.268 0.000 1.155 1175 Y CA 3.754 62.053 58.100 0.332 0.000 1.203 1175 Y CB -0.187 38.392 38.460 0.200 0.000 0.980 1175 Y HN -0.761 7.720 8.280 0.335 0.000 0.530 1176 K N -0.329 120.241 120.400 0.283 0.000 1.984 1176 K HA -0.376 4.091 4.320 0.244 0.000 0.209 1176 K C 2.303 179.060 176.600 0.262 0.000 1.046 1176 K CA 3.372 59.771 56.287 0.187 0.000 0.934 1176 K CB -0.306 32.198 32.500 0.007 0.000 0.717 1176 K HN -0.848 7.391 8.250 0.168 0.112 0.438 1177 F N -1.179 118.852 119.950 0.135 0.000 2.120 1177 F HA -0.284 4.249 4.527 0.009 0.000 0.300 1177 F C 2.443 178.312 175.800 0.115 0.000 1.095 1177 F CA 1.543 59.573 58.000 0.050 0.000 1.249 1177 F CB -1.278 37.694 39.000 -0.047 0.000 0.995 1177 F HN 0.060 8.253 8.300 -0.178 0.000 0.480 1178 C N -2.522 117.064 119.300 0.477 0.000 2.432 1178 C HA -0.413 4.365 4.460 0.529 0.000 0.280 1178 C C 1.562 176.682 174.990 0.216 0.000 1.353 1178 C CA 4.059 63.317 59.018 0.399 0.000 1.766 1178 C CB -0.264 27.690 27.740 0.356 0.000 1.924 1178 C HN 0.564 8.979 8.230 0.497 0.112 0.509 1179 S N 1.368 117.231 115.700 0.271 0.000 2.338 1179 S HA -0.425 4.286 4.470 0.401 0.000 0.218 1179 S C 1.856 176.523 174.600 0.112 0.000 1.032 1179 S CA 3.296 61.612 58.200 0.193 0.000 0.999 1179 S CB -0.414 62.801 63.200 0.025 0.000 0.905 1179 S HN -0.166 8.141 8.310 0.256 0.157 0.439 1180 K N 2.231 122.692 120.400 0.101 0.000 2.063 1180 K HA -0.310 4.047 4.320 0.063 0.000 0.208 1180 K C 2.467 179.066 176.600 -0.002 0.000 1.048 1180 K CA 3.114 59.437 56.287 0.061 0.000 0.928 1180 K CB -0.106 32.441 32.500 0.078 0.000 0.713 1180 K HN -0.724 7.613 8.250 0.145 0.000 0.442 1181 L N -1.682 119.510 121.223 -0.052 0.000 1.989 1181 L HA -0.409 3.891 4.340 -0.066 0.000 0.211 1181 L C 2.138 178.781 176.870 -0.380 0.000 1.071 1181 L CA 2.894 57.632 54.840 -0.170 0.000 0.749 1181 L CB -0.195 41.765 42.059 -0.165 0.000 0.890 1181 L HN -0.548 7.684 8.230 0.010 0.004 0.431 1182 A N -1.949 120.485 122.820 -0.643 0.000 1.873 1182 A HA -0.503 3.037 4.320 -1.301 0.000 0.218 1182 A C 1.430 178.986 177.584 -0.048 0.000 1.193 1182 A CA 3.353 54.988 52.037 -0.670 0.000 0.629 1182 A CB -0.955 17.933 19.000 -0.186 0.000 0.826 1182 A HN -0.169 7.659 8.150 -0.536 0.000 0.447 1183 E N -0.591 119.655 120.200 0.077 0.000 2.097 1183 E HA -0.356 4.285 4.350 0.207 -0.167 0.196 1183 E C 2.642 179.306 176.600 0.108 0.000 1.000 1183 E CA 2.856 59.338 56.400 0.136 0.000 0.804 1183 E CB 0.026 29.786 29.700 0.101 0.000 0.740 1183 E HN -0.512 7.884 8.360 0.059 0.000 0.454 1184 V N -1.627 118.329 119.914 0.070 0.000 3.078 1184 V HA -0.295 3.949 4.120 0.076 -0.078 0.265 1184 V C 1.768 177.954 176.094 0.152 0.000 1.122 1184 V CA 3.015 65.367 62.300 0.086 0.000 1.141 1184 V CB -0.385 31.476 31.823 0.062 0.000 0.735 1184 V HN 0.279 8.306 8.190 0.031 0.181 0.498 1185 F N 3.460 123.384 119.950 -0.044 0.000 2.164 1185 F HA -0.099 4.447 4.527 0.032 0.000 0.287 1185 F C -0.001 175.859 175.800 0.100 0.000 1.086 1185 F CA 2.368 60.362 58.000 -0.010 0.000 1.249 1185 F CB 0.857 39.750 39.000 -0.178 0.000 1.059 1185 F HN 0.107 8.283 8.300 0.168 0.225 0.490 1186 E N -1.426 118.833 120.200 0.098 0.000 2.273 1186 E HA -0.403 3.964 4.350 0.028 0.000 0.198 1186 E C 2.140 178.763 176.600 0.039 0.000 1.002 1186 E CA 2.927 59.401 56.400 0.122 0.000 0.828 1186 E CB -0.860 29.083 29.700 0.406 0.000 0.747 1186 E HN 0.002 8.543 8.360 0.301 0.000 0.491 1187 Q N -2.646 117.181 119.800 0.046 0.000 2.259 1187 Q HA -0.081 4.281 4.340 0.037 0.000 0.201 1187 Q C 1.270 177.270 176.000 -0.001 0.000 0.938 1187 Q CA 1.789 57.612 55.803 0.033 0.000 0.872 1187 Q CB 0.681 29.452 28.738 0.055 0.000 0.971 1187 Q HN -0.570 7.697 8.270 0.076 0.049 0.494 1188 E N -0.393 119.801 120.200 -0.009 0.000 2.112 1188 E HA -0.127 4.224 4.350 0.001 0.000 0.190 1188 E C 1.822 178.376 176.600 -0.076 0.000 0.979 1188 E CA 2.084 58.477 56.400 -0.011 0.000 0.814 1188 E CB 0.373 30.107 29.700 0.055 0.000 0.762 1188 E HN -0.562 7.720 8.360 0.011 0.084 0.460 1189 I N -0.754 119.696 120.570 -0.200 0.000 3.578 1189 I HA -0.148 3.917 4.170 -0.176 0.000 0.295 1189 I C -0.058 175.968 176.117 -0.152 0.000 1.280 1189 I CA -0.113 61.034 61.300 -0.255 0.000 1.347 1189 I CB 0.565 38.177 38.000 -0.646 0.000 1.051 1189 I HN 0.489 8.420 8.210 -0.271 0.116 0.460 1190 D N 1.189 121.532 120.400 -0.095 0.000 2.106 1190 D HA -0.196 4.441 4.640 -0.005 0.000 0.191 1190 D C -0.329 175.956 176.300 -0.025 0.000 0.997 1190 D CA 5.677 59.661 54.000 -0.028 0.000 0.834 1190 D CB -2.293 38.507 40.800 -0.001 0.000 0.956 1190 D HN -0.025 8.135 8.370 -0.096 0.153 0.448 1191 P HA -0.072 4.615 4.420 -0.017 -0.277 0.216 1191 P C 1.403 178.667 177.300 -0.060 0.000 1.153 1191 P CA 2.137 65.216 63.100 -0.034 0.000 0.848 1191 P CB 0.082 31.761 31.700 -0.035 0.000 0.787 1192 V N -1.370 118.489 119.914 -0.093 0.000 2.223 1192 V HA -0.487 3.537 4.120 -0.160 0.000 0.244 1192 V C 2.007 178.018 176.094 -0.139 0.000 1.045 1192 V CA 4.263 66.477 62.300 -0.144 0.000 1.000 1192 V CB -0.580 31.139 31.823 -0.172 0.000 0.635 1192 V HN -0.695 7.364 8.190 -0.092 0.076 0.445 1193 M N -2.268 117.266 119.600 -0.111 0.000 2.202 1193 M HA -0.403 4.015 4.480 -0.193 -0.055 0.262 1193 M C 3.117 179.414 176.300 -0.005 0.000 1.063 1193 M CA 2.551 57.800 55.300 -0.085 0.000 1.097 1193 M CB -1.520 31.089 32.600 0.015 0.000 1.382 1193 M HN 0.164 8.391 8.290 -0.105 0.000 0.413 1194 Q N -0.627 119.177 119.800 0.007 0.000 2.084 1194 Q HA -0.263 4.117 4.340 0.068 0.000 0.202 1194 Q C 2.026 178.051 176.000 0.041 0.000 0.978 1194 Q CA 2.810 58.636 55.803 0.038 0.000 0.844 1194 Q CB 0.033 28.784 28.738 0.021 0.000 0.898 1194 Q HN -0.203 7.947 8.270 -0.014 0.111 0.426 1195 S N -2.749 112.958 115.700 0.011 0.000 2.502 1195 S HA 0.011 4.529 4.470 0.080 0.000 0.215 1195 S C 0.064 174.725 174.600 0.101 0.000 1.009 1195 S CA 2.231 60.460 58.200 0.047 0.000 0.908 1195 S CB 1.113 64.313 63.200 -0.001 0.000 0.801 1195 S HN -0.555 7.738 8.310 -0.028 0.000 0.505 1196 L N -0.680 120.526 121.223 -0.027 0.000 2.189 1196 L HA 0.146 4.455 4.340 -0.052 0.000 0.199 1196 L C -0.392 176.513 176.870 0.059 0.000 1.074 1196 L CA 0.859 55.661 54.840 -0.063 0.000 0.783 1196 L CB 0.914 42.769 42.059 -0.341 0.000 0.955 1196 L HN 0.105 8.097 8.230 -0.077 0.192 0.460 1197 G N 0.000 108.721 108.800 -0.131 0.000 5.446 1197 G HA2 0.000 nan 3.960 nan 0.000 0.244 1197 G HA3 0.000 3.908 3.960 -0.126 -0.024 0.244 1197 G CA 0.000 45.000 45.100 -0.166 0.000 0.502 1197 G HN 0.000 8.068 8.290 -0.145 0.135 0.925