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 3let_1_B DATA FIRST_RESID 77 DATA SEQUENCE TKAVFDNEQG QAQRLQTSSS VEHGQMLFKD ANLKTPSDVL NAFAKLDSKM DATA SEQUENCE VKSHAAELSQ LAERAMTEVM LETDSGKNLK ALIGDDAVKS LAVRVVKDYG DATA SEQUENCE GGVAAAQKNP EVRINQMQAV FDMEVMHLKA AQRHIEGLAS TDLNQGVYAE DATA SEQUENCE GLPEDAFNKA GVTNNVERAA AWIINASNSK GNDAENITSL LKEYATNGKD DATA SEQUENCE LLNMDNLKEL HARLVPNVER DYRGPNISGG TLPSSIGGEG MLKQHIEGFL DATA SEQUENCE KENPVADKDL GKHLFAGVIG YHGFTDGNGR MGRMLYAIAE LRNDSFNPLA DATA SEQUENCE MNAENSLHGI 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 77 T HA 0.000 4.351 4.350 0.001 0.000 0.228 77 T C 0.000 174.694 174.700 -0.011 0.000 1.109 77 T CA 0.000 62.098 62.100 -0.003 0.000 1.349 77 T CB 0.000 68.867 68.868 -0.001 0.000 0.612 78 K N 2.078 122.473 120.400 -0.009 0.000 2.343 78 K HA 0.088 4.394 4.320 -0.024 0.000 0.250 78 K C -0.729 175.844 176.600 -0.045 0.000 1.087 78 K CA -0.472 55.803 56.287 -0.021 0.000 0.853 78 K CB 0.502 32.997 32.500 -0.008 0.000 1.133 78 K HN 0.059 8.308 8.250 -0.002 0.000 0.509 79 A N -0.636 122.135 122.820 -0.082 0.000 2.445 79 A HA -0.036 4.203 4.320 -0.134 0.000 0.242 79 A C -0.929 176.547 177.584 -0.180 0.000 1.075 79 A CA 0.531 52.472 52.037 -0.160 0.000 0.777 79 A CB 0.273 19.125 19.000 -0.247 0.000 1.013 79 A HN 0.087 8.191 8.150 -0.078 0.000 0.493 80 V N 1.589 121.389 119.914 -0.191 0.000 2.540 80 V HA 0.182 4.296 4.120 -0.009 0.000 0.302 80 V C -0.539 175.468 176.094 -0.145 0.000 1.035 80 V CA -1.135 61.111 62.300 -0.091 0.000 0.873 80 V CB 2.069 33.883 31.823 -0.015 0.000 0.992 80 V HN -0.229 7.847 8.190 -0.190 0.000 0.428 81 F N 4.032 123.982 119.950 0.001 0.000 2.335 81 F HA -0.054 4.472 4.527 -0.001 0.000 0.296 81 F C 0.177 175.976 175.800 -0.001 0.000 1.091 81 F CA 1.998 59.997 58.000 -0.001 0.000 1.399 81 F CB 0.346 39.346 39.000 -0.001 0.000 1.067 81 F HN 0.349 8.879 8.300 0.383 0.000 0.520 82 D N -4.082 116.425 120.400 0.178 0.000 2.269 82 D HA -0.136 4.567 4.640 0.105 0.000 0.208 82 D C 0.220 176.553 176.300 0.056 0.000 0.963 82 D CA 1.664 55.725 54.000 0.101 0.000 0.864 82 D CB -0.233 40.614 40.800 0.077 0.000 0.936 82 D HN -0.152 8.326 8.370 0.180 0.000 0.505 83 N N -1.056 117.666 118.700 0.036 0.000 3.324 83 N HA 0.095 4.843 4.740 0.014 0.000 0.302 83 N C -0.459 175.047 175.510 -0.006 0.000 1.360 83 N CA -0.299 52.758 53.050 0.011 0.000 1.190 83 N CB -1.750 36.738 38.487 0.002 0.000 1.462 83 N HN -0.117 8.260 8.380 0.036 0.024 0.532 84 E N -1.076 119.127 120.200 0.005 0.000 2.340 84 E HA 0.092 4.424 4.350 -0.030 0.000 0.198 84 E C -0.358 176.235 176.600 -0.011 0.000 0.961 84 E CA 0.192 56.588 56.400 -0.008 0.000 0.905 84 E CB 1.026 30.739 29.700 0.021 0.000 0.884 84 E HN -0.197 8.173 8.360 0.017 0.000 0.491 85 Q N 0.084 119.879 119.800 -0.009 0.000 2.332 85 Q HA -0.160 4.169 4.340 -0.018 0.000 0.263 85 Q C 0.183 176.167 176.000 -0.027 0.000 0.979 85 Q CA 0.606 56.397 55.803 -0.019 0.000 0.885 85 Q CB 0.666 29.389 28.738 -0.023 0.000 1.218 85 Q HN -0.395 7.872 8.270 -0.004 0.000 0.405 86 G N 0.922 109.702 108.800 -0.033 0.000 2.932 86 G HA2 0.377 4.323 3.960 -0.023 0.000 0.283 86 G HA3 0.377 4.322 3.960 -0.025 0.000 0.283 86 G C -0.766 174.103 174.900 -0.051 0.000 1.336 86 G CA -1.439 43.642 45.100 -0.031 0.000 1.056 86 G HN -0.053 8.526 8.290 -0.034 -0.309 0.522 87 Q N 0.420 120.198 119.800 -0.038 0.000 2.112 87 Q HA -0.492 3.801 4.340 -0.079 0.000 0.206 87 Q C 1.975 177.925 176.000 -0.083 0.000 0.987 87 Q CA 3.554 59.324 55.803 -0.054 0.000 0.858 87 Q CB -0.119 28.615 28.738 -0.006 0.000 0.905 87 Q HN 0.387 8.646 8.270 -0.019 0.000 0.420 88 A N -3.010 119.777 122.820 -0.054 0.000 1.883 88 A HA -0.269 4.023 4.320 -0.048 0.000 0.217 88 A C 2.450 179.990 177.584 -0.074 0.000 1.186 88 A CA 2.928 54.933 52.037 -0.052 0.000 0.624 88 A CB -1.124 17.857 19.000 -0.032 0.000 0.822 88 A HN 0.254 8.380 8.150 -0.040 0.000 0.444 89 Q N -2.216 117.538 119.800 -0.077 0.000 2.084 89 Q HA -0.263 4.037 4.340 -0.067 0.000 0.202 89 Q C 2.908 178.824 176.000 -0.140 0.000 0.978 89 Q CA 2.918 58.671 55.803 -0.083 0.000 0.844 89 Q CB -0.293 28.406 28.738 -0.064 0.000 0.898 89 Q HN -0.464 7.767 8.270 -0.066 0.000 0.426 90 R N -0.864 119.507 120.500 -0.215 0.000 2.115 90 R HA -0.248 3.891 4.340 -0.334 0.000 0.230 90 R C 2.002 177.969 176.300 -0.555 0.000 1.111 90 R CA 3.087 58.934 56.100 -0.421 0.000 0.976 90 R CB 0.159 30.132 30.300 -0.545 0.000 0.870 90 R HN -0.569 7.503 8.270 -0.188 0.086 0.445 91 L N -2.624 118.389 121.223 -0.350 0.000 2.313 91 L HA -0.113 4.106 4.340 -0.202 0.000 0.214 91 L C 1.126 177.944 176.870 -0.088 0.000 1.119 91 L CA 2.118 56.845 54.840 -0.189 0.000 0.809 91 L CB 0.077 42.090 42.059 -0.076 0.000 0.933 91 L HN -0.306 7.768 8.230 -0.259 0.000 0.449 92 Q N -3.225 116.520 119.800 -0.091 0.000 2.246 92 Q HA 0.011 4.333 4.340 -0.030 0.000 0.202 92 Q C 0.316 176.291 176.000 -0.042 0.000 0.883 92 Q CA -0.740 55.034 55.803 -0.048 0.000 0.952 92 Q CB -0.164 28.550 28.738 -0.039 0.000 1.078 92 Q HN -0.431 7.746 8.270 -0.113 0.025 0.493 93 T N -1.477 113.042 114.554 -0.059 0.000 2.795 93 T HA -0.059 4.273 4.350 -0.031 0.000 0.314 93 T C 1.440 176.139 174.700 -0.002 0.000 1.069 93 T CA -0.358 61.724 62.100 -0.031 0.000 1.071 93 T CB 1.160 70.011 68.868 -0.028 0.000 0.988 93 T HN -0.730 7.395 8.240 -0.096 0.058 0.543 94 S N 0.913 116.616 115.700 0.004 0.000 2.402 94 S HA -0.169 4.306 4.470 0.008 0.000 0.229 94 S C 0.132 174.744 174.600 0.020 0.000 1.021 94 S CA 2.322 60.528 58.200 0.010 0.000 0.974 94 S CB 0.065 63.270 63.200 0.008 0.000 0.800 94 S HN 0.391 8.702 8.310 0.001 0.000 0.484 95 S N -2.545 113.173 115.700 0.029 0.000 2.688 95 S HA 0.287 4.856 4.470 0.037 -0.077 0.275 95 S C -0.509 174.126 174.600 0.059 0.000 1.175 95 S CA -1.166 57.057 58.200 0.038 0.000 0.818 95 S CB 1.824 65.041 63.200 0.028 0.000 1.157 95 S HN -0.779 7.663 8.310 0.029 -0.115 0.482 96 S N 1.268 116.997 115.700 0.049 0.000 2.419 96 S HA -0.156 4.351 4.470 0.061 0.000 0.233 96 S C 1.804 176.425 174.600 0.034 0.000 1.016 96 S CA 2.586 60.809 58.200 0.039 0.000 0.974 96 S CB -0.255 62.948 63.200 0.005 0.000 0.786 96 S HN 0.325 9.176 8.310 0.037 -0.519 0.492 97 V N 2.970 122.905 119.914 0.036 0.000 2.261 97 V HA -0.494 3.648 4.120 0.035 0.000 0.246 97 V C 1.585 177.697 176.094 0.030 0.000 1.047 97 V CA 4.658 66.978 62.300 0.033 0.000 1.015 97 V CB -0.326 31.516 31.823 0.032 0.000 0.642 97 V HN -0.722 7.463 8.190 0.034 0.025 0.446 98 E N -1.203 119.017 120.200 0.034 0.000 2.077 98 E HA -0.322 4.206 4.350 0.017 -0.168 0.193 98 E C 2.234 178.855 176.600 0.035 0.000 0.989 98 E CA 3.038 59.453 56.400 0.024 0.000 0.800 98 E CB -0.598 29.110 29.700 0.013 0.000 0.746 98 E HN -0.185 8.197 8.360 0.035 0.000 0.452 99 H N 0.370 119.396 119.070 -0.073 0.000 2.319 99 H HA -0.364 4.128 4.556 -0.106 0.000 0.299 99 H C 1.984 177.179 175.328 -0.221 0.000 1.092 99 H CA 2.292 58.269 56.048 -0.117 0.000 1.302 99 H CB 0.360 30.066 29.762 -0.093 0.000 1.373 99 H HN -0.664 7.699 8.280 0.139 0.000 0.497 100 G N -2.646 106.100 108.800 -0.091 0.000 2.402 100 G HA2 -0.384 3.107 3.960 -0.780 0.000 0.216 100 G HA3 -0.384 3.422 3.960 -0.255 0.000 0.216 100 G C 1.300 176.070 174.900 -0.216 0.000 1.162 100 G CA 1.578 46.457 45.100 -0.369 0.000 0.777 100 G HN 0.191 8.461 8.290 -0.034 0.000 0.539 101 Q N 2.337 122.110 119.800 -0.046 0.000 2.135 101 Q HA -0.340 4.201 4.340 0.045 -0.173 0.204 101 Q C 3.040 179.036 176.000 -0.008 0.000 0.981 101 Q CA 2.993 58.801 55.803 0.007 0.000 0.856 101 Q CB -0.016 28.732 28.738 0.017 0.000 0.902 101 Q HN -0.087 8.170 8.270 -0.022 0.000 0.425 102 M N -1.315 118.263 119.600 -0.036 0.000 2.160 102 M HA -0.357 4.112 4.480 -0.019 0.000 0.264 102 M C 1.831 178.100 176.300 -0.051 0.000 1.073 102 M CA 4.180 59.459 55.300 -0.035 0.000 1.142 102 M CB 0.332 32.903 32.600 -0.049 0.000 1.358 102 M HN -0.564 7.693 8.290 -0.038 0.010 0.422 103 L N -0.801 120.349 121.223 -0.122 0.000 2.093 103 L HA -0.253 4.035 4.340 -0.088 0.000 0.208 103 L C 1.077 177.931 176.870 -0.026 0.000 1.085 103 L CA 2.882 57.624 54.840 -0.163 0.000 0.755 103 L CB 0.123 41.962 42.059 -0.367 0.000 0.904 103 L HN -0.286 7.857 8.230 -0.146 0.000 0.435 104 F N -5.246 114.666 119.950 -0.065 0.000 2.693 104 F HA 0.051 4.504 4.527 -0.123 0.000 0.303 104 F C -0.473 175.293 175.800 -0.057 0.000 1.097 104 F CA -2.357 55.590 58.000 -0.089 0.000 1.330 104 F CB -0.276 38.669 39.000 -0.091 0.000 1.067 104 F HN -0.506 7.713 8.300 -0.136 0.000 0.565 105 K N -1.101 119.368 120.400 0.115 0.000 3.730 105 K HA -0.423 3.989 4.320 0.045 -0.065 0.276 105 K C -1.276 175.366 176.600 0.071 0.000 0.904 105 K CA 1.119 57.445 56.287 0.065 0.000 0.741 105 K CB -2.107 30.419 32.500 0.043 0.000 1.542 105 K HN -0.498 7.736 8.250 0.077 0.063 0.446 106 D N -1.207 119.243 120.400 0.083 0.000 2.319 106 D HA 0.065 4.738 4.640 0.055 0.000 0.237 106 D C -0.530 175.807 176.300 0.062 0.000 1.353 106 D CA -0.067 53.978 54.000 0.075 0.000 0.992 106 D CB 1.025 41.888 40.800 0.105 0.000 1.368 106 D HN -0.446 7.974 8.370 0.082 0.000 0.564 107 A N 5.131 127.976 122.820 0.042 0.000 2.235 107 A HA -0.102 4.238 4.320 0.034 0.000 0.208 107 A C 0.182 177.786 177.584 0.034 0.000 1.172 107 A CA 1.583 53.640 52.037 0.034 0.000 0.786 107 A CB 0.309 19.323 19.000 0.024 0.000 0.804 107 A HN 0.379 8.551 8.150 0.036 0.000 0.479 108 N N -3.298 115.425 118.700 0.038 0.000 2.463 108 N HA -0.157 4.600 4.740 0.029 0.000 0.181 108 N C -0.071 175.465 175.510 0.043 0.000 1.078 108 N CA 0.726 53.797 53.050 0.035 0.000 0.902 108 N CB 0.301 38.806 38.487 0.029 0.000 0.970 108 N HN -0.593 8.016 8.380 0.040 -0.205 0.451 109 L N 0.129 121.387 121.223 0.059 0.000 2.477 109 L HA -0.228 4.154 4.340 0.070 0.000 0.272 109 L C -0.437 176.464 176.870 0.052 0.000 1.157 109 L CA 1.190 56.072 54.840 0.070 0.000 0.889 109 L CB -0.637 41.484 42.059 0.104 0.000 1.158 109 L HN -0.850 7.390 8.230 0.066 0.029 0.473 110 K N 1.757 122.184 120.400 0.045 0.000 2.474 110 K HA 0.255 4.594 4.320 0.032 0.000 0.204 110 K C -0.103 176.516 176.600 0.032 0.000 1.220 110 K CA -0.536 55.771 56.287 0.034 0.000 0.966 110 K CB 2.300 34.816 32.500 0.027 0.000 1.049 110 K HN 0.231 8.800 8.250 0.046 -0.292 0.554 111 T N -3.326 111.250 114.554 0.036 0.000 2.901 111 T HA 0.585 4.951 4.350 0.027 0.000 0.293 111 T C -1.787 172.935 174.700 0.038 0.000 1.084 111 T CA -4.050 58.068 62.100 0.031 0.000 1.008 111 T CB 2.076 70.959 68.868 0.025 0.000 1.170 111 T HN -0.807 7.614 8.240 0.042 -0.156 0.509 112 P HA 0.023 4.465 4.420 0.036 0.000 0.218 112 P C 1.160 178.478 177.300 0.029 0.000 1.149 112 P CA 1.917 65.034 63.100 0.028 0.000 0.817 112 P CB 0.005 31.712 31.700 0.012 0.000 0.785 113 S N -1.554 114.159 115.700 0.021 0.000 2.368 113 S HA -0.229 4.244 4.470 0.005 0.000 0.225 113 S C 2.344 176.970 174.600 0.043 0.000 1.030 113 S CA 3.574 61.784 58.200 0.018 0.000 0.999 113 S CB -0.798 62.407 63.200 0.008 0.000 0.844 113 S HN -0.014 8.298 8.310 0.018 0.009 0.459 114 D N 2.149 122.582 120.400 0.054 0.000 2.123 114 D HA -0.255 4.424 4.640 0.064 0.000 0.196 114 D C 2.490 178.869 176.300 0.131 0.000 0.992 114 D CA 3.329 57.374 54.000 0.075 0.000 0.833 114 D CB -0.311 40.531 40.800 0.069 0.000 0.954 114 D HN -0.522 7.876 8.370 0.046 0.000 0.455 115 V N -0.127 119.878 119.914 0.152 0.000 2.295 115 V HA -0.576 3.745 4.120 0.336 0.000 0.246 115 V C 1.680 178.004 176.094 0.382 0.000 1.049 115 V CA 4.006 66.468 62.300 0.270 0.000 1.024 115 V CB 0.001 31.939 31.823 0.193 0.000 0.648 115 V HN -0.681 7.498 8.190 0.114 0.079 0.447 116 L N -2.217 119.114 121.223 0.181 0.000 2.083 116 L HA -0.387 3.928 4.340 -0.042 0.000 0.209 116 L C 2.782 179.737 176.870 0.141 0.000 1.083 116 L CA 2.900 57.777 54.840 0.062 0.000 0.752 116 L CB -0.528 41.486 42.059 -0.076 0.000 0.899 116 L HN -0.442 7.851 8.230 0.106 0.000 0.433 117 N N -1.054 117.715 118.700 0.115 0.000 2.309 117 N HA -0.240 4.538 4.740 0.063 0.000 0.182 117 N C 1.973 177.542 175.510 0.097 0.000 1.018 117 N CA 2.534 55.634 53.050 0.084 0.000 0.876 117 N CB -0.628 37.890 38.487 0.050 0.000 0.972 117 N HN -0.050 8.390 8.380 0.100 0.000 0.434 118 A N -0.074 122.831 122.820 0.142 0.000 2.067 118 A HA -0.142 4.139 4.320 -0.064 0.000 0.219 118 A C 1.979 179.496 177.584 -0.112 0.000 1.158 118 A CA 2.465 54.494 52.037 -0.013 0.000 0.661 118 A CB -0.865 18.123 19.000 -0.020 0.000 0.801 118 A HN -0.371 7.785 8.150 0.208 0.119 0.452 119 F N -1.045 118.837 119.950 -0.113 0.000 2.216 119 F HA -0.397 4.015 4.527 -0.190 0.000 0.300 119 F C 2.042 177.772 175.800 -0.117 0.000 1.085 119 F CA 3.034 60.965 58.000 -0.115 0.000 1.326 119 F CB -0.504 38.493 39.000 -0.005 0.000 1.027 119 F HN -0.617 7.863 8.300 0.529 0.137 0.497 120 A N -3.042 119.828 122.820 0.083 0.000 2.067 120 A HA -0.196 4.148 4.320 0.040 0.000 0.219 120 A C 0.611 178.170 177.584 -0.041 0.000 1.158 120 A CA 1.982 54.033 52.037 0.023 0.000 0.661 120 A CB -0.700 18.312 19.000 0.019 0.000 0.801 120 A HN -0.530 7.663 8.150 0.101 0.018 0.452 121 K N -4.234 116.105 120.400 -0.102 0.000 2.400 121 K HA -0.061 4.204 4.320 -0.092 0.000 0.194 121 K C 0.238 176.732 176.600 -0.176 0.000 1.033 121 K CA -0.128 56.079 56.287 -0.133 0.000 1.021 121 K CB 0.156 32.562 32.500 -0.157 0.000 0.808 121 K HN -0.556 7.456 8.250 -0.123 0.164 0.505 122 L N 1.141 122.228 121.223 -0.227 0.000 2.416 122 L HA -0.176 4.004 4.340 -0.267 0.000 0.272 122 L C -0.081 176.717 176.870 -0.120 0.000 1.161 122 L CA 0.203 54.902 54.840 -0.234 0.000 0.845 122 L CB 0.108 41.989 42.059 -0.295 0.000 1.119 122 L HN -0.797 7.254 8.230 -0.229 0.042 0.464 123 D N 2.143 122.487 120.400 -0.094 0.000 2.344 123 D HA -0.012 4.601 4.640 -0.046 0.000 0.244 123 D C 0.545 176.828 176.300 -0.027 0.000 1.134 123 D CA -0.926 53.044 54.000 -0.050 0.000 0.930 123 D CB 0.977 41.754 40.800 -0.037 0.000 1.175 123 D HN -0.186 8.120 8.370 -0.105 0.000 0.437 124 S N 0.291 115.984 115.700 -0.012 0.000 2.399 124 S HA -0.367 4.105 4.470 0.003 0.000 0.231 124 S C 1.387 175.994 174.600 0.012 0.000 1.022 124 S CA 3.187 61.387 58.200 0.001 0.000 0.983 124 S CB 0.018 63.219 63.200 0.002 0.000 0.803 124 S HN 0.266 8.568 8.310 -0.013 0.000 0.480 125 K N 1.160 121.568 120.400 0.013 0.000 2.116 125 K HA -0.153 4.179 4.320 0.019 0.000 0.203 125 K C 1.830 178.461 176.600 0.050 0.000 1.052 125 K CA 2.511 58.812 56.287 0.023 0.000 0.952 125 K CB -0.258 32.253 32.500 0.018 0.000 0.729 125 K HN -0.117 8.113 8.250 0.007 0.024 0.446 126 M N 1.371 121.007 119.600 0.059 0.000 2.086 126 M HA -0.323 4.292 4.480 0.225 0.000 0.261 126 M C 1.772 178.161 176.300 0.147 0.000 1.067 126 M CA 3.175 58.554 55.300 0.131 0.000 1.116 126 M CB -0.245 32.376 32.600 0.035 0.000 1.348 126 M HN -0.517 8.066 8.290 0.031 -0.274 0.407 127 V N -0.800 119.150 119.914 0.061 0.000 2.332 127 V HA -0.661 3.500 4.120 0.068 0.000 0.248 127 V C 1.590 177.732 176.094 0.080 0.000 1.055 127 V CA 4.213 66.551 62.300 0.063 0.000 1.038 127 V CB -0.467 31.380 31.823 0.039 0.000 0.651 127 V HN -0.395 7.812 8.190 0.029 0.000 0.450 128 K N -2.415 118.018 120.400 0.056 0.000 2.155 128 K HA -0.234 4.109 4.320 0.039 0.000 0.203 128 K C 3.183 179.793 176.600 0.016 0.000 1.052 128 K CA 2.946 59.255 56.287 0.036 0.000 0.948 128 K CB -0.334 32.178 32.500 0.020 0.000 0.728 128 K HN -0.813 7.467 8.250 0.049 0.000 0.448 129 S N -0.251 115.453 115.700 0.007 0.000 2.414 129 S HA -0.132 4.274 4.470 -0.107 0.000 0.227 129 S C 1.218 175.673 174.600 -0.241 0.000 1.022 129 S CA 2.280 60.409 58.200 -0.118 0.000 0.958 129 S CB 0.222 63.325 63.200 -0.162 0.000 0.797 129 S HN -0.465 7.873 8.310 0.046 0.000 0.493 130 H N -0.668 118.415 119.070 0.023 0.000 2.488 130 H HA 0.229 4.804 4.556 0.032 0.000 0.294 130 H C -0.472 174.882 175.328 0.043 0.000 1.088 130 H CA -0.910 55.157 56.048 0.033 0.000 1.086 130 H CB -0.315 29.470 29.762 0.038 0.000 1.569 130 H HN -0.370 8.018 8.280 0.180 0.000 0.548 131 A N 0.315 123.196 122.820 0.103 0.000 1.892 131 A HA -0.347 4.106 4.320 0.115 -0.064 0.218 131 A C 0.837 178.480 177.584 0.098 0.000 1.188 131 A CA 3.632 55.727 52.037 0.096 0.000 0.631 131 A CB -0.208 18.828 19.000 0.059 0.000 0.822 131 A HN -0.767 7.354 8.150 0.058 0.065 0.447 132 A N -1.850 121.015 122.820 0.075 0.000 1.858 132 A HA -0.384 3.974 4.320 0.062 0.000 0.216 132 A C 1.982 179.622 177.584 0.093 0.000 1.190 132 A CA 2.996 55.075 52.037 0.069 0.000 0.617 132 A CB -0.936 18.093 19.000 0.047 0.000 0.827 132 A HN 0.286 8.471 8.150 0.058 0.000 0.443 133 E N -0.224 120.047 120.200 0.118 0.000 2.106 133 E HA -0.207 4.412 4.350 0.135 -0.188 0.192 133 E C 2.483 179.157 176.600 0.125 0.000 0.984 133 E CA 2.425 58.908 56.400 0.140 0.000 0.806 133 E CB -0.233 29.573 29.700 0.177 0.000 0.750 133 E HN -0.097 8.338 8.360 0.124 0.000 0.458 134 L N -1.469 119.843 121.223 0.147 0.000 2.141 134 L HA -0.340 4.102 4.340 0.170 0.000 0.209 134 L C 1.915 178.940 176.870 0.258 0.000 1.094 134 L CA 2.911 57.873 54.840 0.204 0.000 0.763 134 L CB -0.277 41.905 42.059 0.205 0.000 0.908 134 L HN -0.012 8.313 8.230 0.158 0.000 0.437 135 S N -0.759 115.038 115.700 0.162 0.000 2.368 135 S HA -0.403 4.137 4.470 0.118 0.000 0.224 135 S C 2.260 176.905 174.600 0.075 0.000 1.029 135 S CA 3.265 61.531 58.200 0.111 0.000 0.988 135 S CB -0.362 62.884 63.200 0.076 0.000 0.838 135 S HN -0.198 8.182 8.310 0.140 0.014 0.462 136 Q N 1.524 121.369 119.800 0.075 0.000 2.079 136 Q HA -0.304 4.062 4.340 0.043 0.000 0.200 136 Q C 2.516 178.526 176.000 0.016 0.000 0.974 136 Q CA 2.951 58.787 55.803 0.055 0.000 0.840 136 Q CB 0.130 28.923 28.738 0.092 0.000 0.898 136 Q HN -0.729 7.515 8.270 0.088 0.079 0.430 137 L N -0.611 120.596 121.223 -0.027 0.000 2.093 137 L HA -0.197 3.978 4.340 -0.276 0.000 0.208 137 L C 1.100 177.965 176.870 -0.008 0.000 1.085 137 L CA 2.553 57.302 54.840 -0.152 0.000 0.755 137 L CB -0.391 41.500 42.059 -0.279 0.000 0.904 137 L HN -0.154 8.081 8.230 0.009 0.000 0.435 138 A N -1.651 121.192 122.820 0.039 0.000 1.930 138 A HA -0.403 3.680 4.320 -0.394 0.000 0.217 138 A C 1.387 178.885 177.584 -0.143 0.000 1.175 138 A CA 3.360 55.261 52.037 -0.227 0.000 0.627 138 A CB -0.797 17.996 19.000 -0.345 0.000 0.815 138 A HN -0.061 8.163 8.150 0.125 0.000 0.443 139 E N -0.815 119.347 120.200 -0.064 0.000 2.072 139 E HA -0.472 3.846 4.350 -0.054 0.000 0.191 139 E C 2.225 178.804 176.600 -0.034 0.000 0.985 139 E CA 3.118 59.492 56.400 -0.044 0.000 0.801 139 E CB -0.052 29.638 29.700 -0.017 0.000 0.750 139 E HN -0.474 7.866 8.360 -0.033 0.000 0.452 140 R N -1.100 119.385 120.500 -0.025 0.000 2.073 140 R HA -0.333 4.007 4.340 0.001 0.000 0.234 140 R C 2.431 178.718 176.300 -0.021 0.000 1.134 140 R CA 3.232 59.326 56.100 -0.010 0.000 0.952 140 R CB -0.149 30.154 30.300 0.005 0.000 0.850 140 R HN -0.208 8.048 8.270 -0.023 0.000 0.433 141 A N 0.066 122.860 122.820 -0.044 0.000 1.898 141 A HA -0.148 4.161 4.320 -0.018 0.000 0.216 141 A C 2.247 179.800 177.584 -0.052 0.000 1.181 141 A CA 2.837 54.850 52.037 -0.041 0.000 0.620 141 A CB -0.388 18.584 19.000 -0.048 0.000 0.819 141 A HN -0.068 8.046 8.150 -0.060 0.000 0.442 142 M N -2.168 117.383 119.600 -0.082 0.000 2.117 142 M HA -0.386 4.043 4.480 -0.084 0.000 0.262 142 M C 2.551 178.826 176.300 -0.041 0.000 1.065 142 M CA 3.606 58.860 55.300 -0.077 0.000 1.114 142 M CB -0.545 32.000 32.600 -0.093 0.000 1.361 142 M HN 0.042 8.271 8.290 -0.103 0.000 0.408 143 T N 2.437 116.980 114.554 -0.018 0.000 2.720 143 T HA -0.412 3.961 4.350 0.038 0.000 0.268 143 T C 1.953 176.671 174.700 0.030 0.000 1.037 143 T CA 5.279 67.391 62.100 0.020 0.000 1.144 143 T CB -0.384 68.497 68.868 0.023 0.000 0.864 143 T HN -0.078 8.148 8.240 -0.023 0.000 0.444 144 E N 1.353 121.562 120.200 0.014 0.000 2.072 144 E HA -0.355 4.012 4.350 0.029 0.000 0.191 144 E C 2.479 179.089 176.600 0.018 0.000 0.985 144 E CA 3.113 59.525 56.400 0.020 0.000 0.801 144 E CB -0.124 29.584 29.700 0.014 0.000 0.750 144 E HN -0.526 7.836 8.360 0.004 0.000 0.452 145 V N -0.110 119.803 119.914 -0.002 0.000 2.295 145 V HA -0.544 3.574 4.120 -0.003 0.000 0.246 145 V C 2.227 178.318 176.094 -0.005 0.000 1.049 145 V CA 4.121 66.414 62.300 -0.011 0.000 1.024 145 V CB -0.050 31.752 31.823 -0.035 0.000 0.648 145 V HN -0.251 7.932 8.190 -0.012 0.000 0.447 146 M N -0.954 118.640 119.600 -0.010 0.000 2.159 146 M HA -0.316 4.117 4.480 -0.080 0.000 0.263 146 M C 2.215 178.614 176.300 0.165 0.000 1.063 146 M CA 1.338 56.635 55.300 -0.005 0.000 1.110 146 M CB -1.087 31.466 32.600 -0.077 0.000 1.374 146 M HN -0.362 7.919 8.290 -0.015 0.000 0.411 147 L N -3.924 117.387 121.223 0.147 0.000 2.191 147 L HA -0.293 4.158 4.340 0.184 0.000 0.212 147 L C 1.459 178.382 176.870 0.089 0.000 1.103 147 L CA 2.554 57.474 54.840 0.135 0.000 0.769 147 L CB -0.703 41.404 42.059 0.079 0.000 0.908 147 L HN -0.246 8.048 8.230 0.107 0.000 0.438 148 E N -5.487 114.750 120.200 0.062 0.000 2.479 148 E HA 0.031 4.404 4.350 0.040 0.000 0.193 148 E C 0.188 176.812 176.600 0.040 0.000 1.049 148 E CA -0.783 55.642 56.400 0.041 0.000 0.870 148 E CB -0.268 29.448 29.700 0.025 0.000 0.944 148 E HN -0.630 7.632 8.360 0.054 0.131 0.492 149 T N -1.094 113.492 114.554 0.054 0.000 2.813 149 T HA 0.072 4.435 4.350 0.021 0.000 0.297 149 T C 0.671 175.406 174.700 0.058 0.000 1.036 149 T CA -0.844 61.281 62.100 0.042 0.000 1.044 149 T CB 1.938 70.822 68.868 0.026 0.000 0.993 149 T HN -0.801 7.335 8.240 0.071 0.148 0.535 150 D N 1.472 121.896 120.400 0.039 0.000 2.133 150 D HA -0.325 4.333 4.640 0.030 0.000 0.192 150 D C 1.866 178.201 176.300 0.059 0.000 1.001 150 D CA 4.298 58.320 54.000 0.037 0.000 0.844 150 D CB -0.763 40.050 40.800 0.022 0.000 0.944 150 D HN 0.472 8.857 8.370 0.025 0.000 0.447 151 S N -1.815 113.944 115.700 0.098 0.000 2.406 151 S HA -0.119 4.397 4.470 0.078 0.000 0.228 151 S C 1.994 176.700 174.600 0.177 0.000 1.020 151 S CA 2.947 61.231 58.200 0.140 0.000 0.965 151 S CB -0.959 62.367 63.200 0.209 0.000 0.798 151 S HN -0.005 8.362 8.310 0.095 0.000 0.488 152 G N 2.239 111.217 108.800 0.296 0.000 2.446 152 G HA2 -0.351 3.693 3.960 0.140 0.000 0.217 152 G HA3 -0.351 3.966 3.960 0.284 -0.186 0.217 152 G C 1.103 176.026 174.900 0.038 0.000 1.168 152 G CA 2.097 47.327 45.100 0.216 0.000 0.771 152 G HN -0.228 8.244 8.290 0.303 0.000 0.551 153 K N 0.848 121.276 120.400 0.046 0.000 2.148 153 K HA -0.342 3.981 4.320 0.005 0.000 0.204 153 K C 2.517 179.112 176.600 -0.009 0.000 1.050 153 K CA 3.525 59.820 56.287 0.013 0.000 0.942 153 K CB -0.218 32.294 32.500 0.019 0.000 0.724 153 K HN -0.208 8.081 8.250 0.066 0.000 0.446 154 N N 0.516 119.212 118.700 -0.006 0.000 2.120 154 N HA -0.263 4.468 4.740 -0.016 0.000 0.188 154 N C 2.307 177.781 175.510 -0.059 0.000 1.024 154 N CA 2.866 55.902 53.050 -0.022 0.000 0.852 154 N CB -0.356 38.124 38.487 -0.012 0.000 1.003 154 N HN -0.403 7.905 8.380 0.012 0.079 0.424 155 L N -0.438 120.721 121.223 -0.105 0.000 2.093 155 L HA -0.342 3.907 4.340 -0.150 0.000 0.208 155 L C 1.399 178.192 176.870 -0.127 0.000 1.085 155 L CA 3.054 57.794 54.840 -0.167 0.000 0.755 155 L CB -0.358 41.501 42.059 -0.333 0.000 0.904 155 L HN 0.045 8.210 8.230 -0.107 0.000 0.435 156 K N -0.069 120.273 120.400 -0.096 0.000 2.057 156 K HA -0.372 3.903 4.320 -0.075 0.000 0.207 156 K C 2.468 179.039 176.600 -0.049 0.000 1.049 156 K CA 3.302 59.550 56.287 -0.065 0.000 0.931 156 K CB -0.162 32.315 32.500 -0.038 0.000 0.714 156 K HN -0.252 7.869 8.250 -0.087 0.077 0.440 157 A N -1.646 121.151 122.820 -0.038 0.000 1.972 157 A HA -0.203 4.107 4.320 -0.016 0.000 0.219 157 A C 1.524 179.090 177.584 -0.030 0.000 1.169 157 A CA 2.731 54.754 52.037 -0.024 0.000 0.635 157 A CB -0.470 18.523 19.000 -0.012 0.000 0.810 157 A HN -0.303 7.825 8.150 -0.037 0.000 0.446 158 L N -3.994 117.197 121.223 -0.053 0.000 2.102 158 L HA -0.100 4.208 4.340 -0.053 0.000 0.202 158 L C 1.392 178.209 176.870 -0.088 0.000 1.076 158 L CA 2.346 57.144 54.840 -0.069 0.000 0.761 158 L CB 0.743 42.750 42.059 -0.087 0.000 0.921 158 L HN -0.859 7.217 8.230 -0.063 0.117 0.444 159 I N -11.633 108.879 120.570 -0.096 0.000 4.154 159 I HA 0.379 4.483 4.170 -0.111 0.000 0.334 159 I C -0.352 175.719 176.117 -0.076 0.000 1.371 159 I CA -0.973 60.265 61.300 -0.104 0.000 1.110 159 I CB 1.932 39.856 38.000 -0.126 0.000 1.085 159 I HN -0.458 7.695 8.210 -0.095 0.000 0.398 160 G N 1.048 109.812 108.800 -0.060 0.000 2.756 160 G HA2 -0.384 3.617 3.960 -0.033 0.000 0.678 160 G HA3 -0.384 3.554 3.960 -0.036 0.000 0.678 160 G C -1.579 173.295 174.900 -0.042 0.000 1.349 160 G CA -0.493 44.582 45.100 -0.042 0.000 0.847 160 G HN -0.511 7.743 8.290 -0.061 0.000 0.548 161 D N 0.510 120.893 120.400 -0.028 0.000 2.117 161 D HA -0.257 4.367 4.640 -0.026 0.000 0.197 161 D C 1.687 177.972 176.300 -0.025 0.000 0.987 161 D CA 3.243 57.229 54.000 -0.024 0.000 0.829 161 D CB -0.257 40.535 40.800 -0.013 0.000 0.961 161 D HN 0.250 8.606 8.370 -0.022 0.000 0.460 162 D N -1.147 119.239 120.400 -0.023 0.000 2.097 162 D HA -0.223 4.408 4.640 -0.016 0.000 0.195 162 D C 1.732 178.013 176.300 -0.030 0.000 0.989 162 D CA 3.173 57.160 54.000 -0.021 0.000 0.827 162 D CB -0.686 40.104 40.800 -0.017 0.000 0.966 162 D HN 0.283 8.640 8.370 -0.022 0.000 0.456 163 A N -0.433 122.362 122.820 -0.041 0.000 1.898 163 A HA -0.196 4.098 4.320 -0.043 0.000 0.216 163 A C 1.711 179.256 177.584 -0.066 0.000 1.181 163 A CA 2.806 54.812 52.037 -0.052 0.000 0.620 163 A CB -0.419 18.541 19.000 -0.066 0.000 0.819 163 A HN -0.143 7.982 8.150 -0.043 0.000 0.442 164 V N -1.676 118.191 119.914 -0.079 0.000 2.515 164 V HA -0.539 3.489 4.120 -0.153 0.000 0.250 164 V C 1.399 177.451 176.094 -0.070 0.000 1.058 164 V CA 3.735 65.967 62.300 -0.113 0.000 1.064 164 V CB -0.032 31.715 31.823 -0.127 0.000 0.675 164 V HN -0.328 7.819 8.190 -0.071 0.000 0.461 165 K N -0.009 120.370 120.400 -0.035 0.000 2.026 165 K HA -0.411 3.914 4.320 0.007 0.000 0.208 165 K C 2.308 178.900 176.600 -0.014 0.000 1.048 165 K CA 4.015 60.296 56.287 -0.010 0.000 0.929 165 K CB -0.266 32.230 32.500 -0.006 0.000 0.713 165 K HN -0.364 7.865 8.250 -0.035 0.000 0.439 166 S N 0.200 115.883 115.700 -0.029 0.000 2.370 166 S HA -0.292 4.150 4.470 -0.045 0.000 0.226 166 S C 2.036 176.603 174.600 -0.056 0.000 1.033 166 S CA 3.254 61.428 58.200 -0.042 0.000 1.011 166 S CB -0.420 62.758 63.200 -0.037 0.000 0.852 166 S HN -0.527 7.765 8.310 -0.030 0.000 0.457 167 L N 1.692 122.894 121.223 -0.036 0.000 2.056 167 L HA -0.315 4.029 4.340 0.007 0.000 0.207 167 L C 0.717 177.621 176.870 0.057 0.000 1.078 167 L CA 2.367 57.205 54.840 -0.002 0.000 0.749 167 L CB -0.615 41.422 42.059 -0.037 0.000 0.901 167 L HN -0.338 7.867 8.230 -0.042 0.000 0.433 168 A N -1.005 121.860 122.820 0.075 0.000 1.908 168 A HA -0.350 4.262 4.320 0.486 0.000 0.218 168 A C 2.161 179.829 177.584 0.140 0.000 1.181 168 A CA 3.259 55.446 52.037 0.249 0.000 0.627 168 A CB -0.975 18.165 19.000 0.233 0.000 0.818 168 A HN 0.066 8.228 8.150 0.021 0.000 0.445 169 V N -1.603 118.335 119.914 0.040 0.000 2.343 169 V HA -0.441 3.686 4.120 0.011 0.000 0.247 169 V C 2.200 178.267 176.094 -0.045 0.000 1.051 169 V CA 3.792 66.089 62.300 -0.006 0.000 1.036 169 V CB -0.254 31.549 31.823 -0.034 0.000 0.654 169 V HN -0.355 7.840 8.190 0.020 0.008 0.451 170 R N -1.651 118.775 120.500 -0.124 0.000 2.090 170 R HA -0.214 3.968 4.340 -0.263 0.000 0.228 170 R C 2.732 179.011 176.300 -0.034 0.000 1.110 170 R CA 1.635 57.571 56.100 -0.273 0.000 0.973 170 R CB -0.945 28.809 30.300 -0.909 0.000 0.869 170 R HN -0.784 7.409 8.270 -0.129 0.000 0.440 171 V N 0.995 120.996 119.914 0.145 0.000 2.343 171 V HA -0.461 3.928 4.120 0.448 0.000 0.247 171 V C 1.751 177.992 176.094 0.244 0.000 1.051 171 V CA 4.342 66.840 62.300 0.330 0.000 1.036 171 V CB -0.189 31.880 31.823 0.411 0.000 0.654 171 V HN -0.202 8.076 8.190 0.148 0.000 0.451 172 V N 0.781 120.767 119.914 0.119 0.000 2.343 172 V HA -0.480 3.675 4.120 0.058 0.000 0.247 172 V C 2.527 178.640 176.094 0.031 0.000 1.051 172 V CA 4.230 66.564 62.300 0.056 0.000 1.036 172 V CB -0.207 31.625 31.823 0.016 0.000 0.654 172 V HN -0.038 8.216 8.190 0.108 0.000 0.451 173 K N -1.461 118.942 120.400 0.006 0.000 2.097 173 K HA -0.268 4.039 4.320 -0.022 0.000 0.206 173 K C 1.761 178.337 176.600 -0.040 0.000 1.049 173 K CA 3.426 59.699 56.287 -0.023 0.000 0.933 173 K CB -0.317 32.155 32.500 -0.047 0.000 0.717 173 K HN -0.483 7.767 8.250 -0.000 0.000 0.442 174 D N -2.658 117.714 120.400 -0.046 0.000 2.183 174 D HA -0.033 4.490 4.640 -0.194 0.000 0.205 174 D C 1.207 177.290 176.300 -0.362 0.000 0.962 174 D CA 2.257 56.122 54.000 -0.226 0.000 0.849 174 D CB 0.676 41.283 40.800 -0.322 0.000 0.978 174 D HN -0.449 7.818 8.370 0.013 0.110 0.488 175 Y N -3.484 116.819 120.300 0.005 0.000 2.471 175 Y HA 0.200 4.744 4.550 -0.009 0.000 0.249 175 Y C 1.487 177.364 175.900 -0.038 0.000 1.116 175 Y CA 0.201 58.292 58.100 -0.015 0.000 1.240 175 Y CB 2.018 40.464 38.460 -0.023 0.000 1.251 175 Y HN -0.167 8.191 8.280 0.129 0.000 0.527 176 G N -0.425 108.425 108.800 0.085 0.000 2.511 176 G HA2 -0.135 3.833 3.960 0.013 0.000 0.217 176 G HA3 -0.135 3.908 3.960 -0.004 -0.085 0.217 176 G C -0.169 174.724 174.900 -0.012 0.000 1.133 176 G CA 0.690 45.800 45.100 0.017 0.000 0.792 176 G HN -0.238 8.090 8.290 0.063 0.000 0.539 177 G N -0.705 108.090 108.800 -0.008 0.000 2.159 177 G HA2 -0.363 3.591 3.960 -0.010 0.000 0.256 177 G HA3 -0.363 3.590 3.960 -0.012 0.000 0.256 177 G C 0.100 174.987 174.900 -0.021 0.000 0.977 177 G CA -0.307 44.785 45.100 -0.014 0.000 0.652 177 G HN -0.115 8.172 8.290 -0.005 0.000 0.531 178 G N -0.550 108.232 108.800 -0.030 0.000 2.601 178 G HA2 -0.497 3.448 3.960 -0.025 0.000 0.261 178 G HA3 -0.497 3.461 3.960 -0.003 0.000 0.261 178 G C -0.119 174.764 174.900 -0.027 0.000 1.289 178 G CA 0.116 45.203 45.100 -0.021 0.000 0.920 178 G HN -0.285 7.935 8.290 -0.035 0.049 0.571 179 V N 2.700 122.634 119.914 0.033 0.000 2.407 179 V HA -0.475 3.698 4.120 0.089 0.000 0.248 179 V C 1.783 177.927 176.094 0.084 0.000 1.055 179 V CA 3.337 65.700 62.300 0.104 0.000 1.049 179 V CB -0.249 31.688 31.823 0.191 0.000 0.662 179 V HN 0.251 8.471 8.190 0.049 0.000 0.455 180 A N -0.804 122.046 122.820 0.051 0.000 1.902 180 A HA -0.241 4.304 4.320 0.058 -0.190 0.217 180 A C 1.641 179.237 177.584 0.020 0.000 1.181 180 A CA 2.836 54.898 52.037 0.041 0.000 0.623 180 A CB -0.774 18.242 19.000 0.027 0.000 0.818 180 A HN 0.191 8.365 8.150 0.041 0.000 0.443 181 A N -2.545 120.270 122.820 -0.007 0.000 1.970 181 A HA -0.227 4.085 4.320 -0.014 0.000 0.216 181 A C 1.755 179.306 177.584 -0.055 0.000 1.170 181 A CA 2.322 54.344 52.037 -0.025 0.000 0.645 181 A CB -0.437 18.545 19.000 -0.031 0.000 0.816 181 A HN -0.633 7.510 8.150 -0.011 0.000 0.447 182 A N -1.632 121.124 122.820 -0.106 0.000 1.933 182 A HA -0.369 3.818 4.320 -0.222 0.000 0.218 182 A C 1.685 179.240 177.584 -0.047 0.000 1.175 182 A CA 2.545 54.451 52.037 -0.218 0.000 0.628 182 A CB -0.448 18.178 19.000 -0.622 0.000 0.814 182 A HN -0.494 7.515 8.150 -0.105 0.078 0.444 183 Q N -3.897 115.941 119.800 0.064 0.000 2.083 183 Q HA -0.263 4.170 4.340 0.156 0.000 0.198 183 Q C 2.009 178.035 176.000 0.044 0.000 0.969 183 Q CA 2.444 58.310 55.803 0.106 0.000 0.838 183 Q CB 0.449 29.251 28.738 0.106 0.000 0.900 183 Q HN -0.592 7.718 8.270 0.067 0.000 0.436 184 K N -3.888 116.525 120.400 0.021 0.000 2.099 184 K HA 0.008 4.335 4.320 0.012 0.000 0.203 184 K C 0.436 177.035 176.600 -0.002 0.000 1.047 184 K CA 0.989 57.281 56.287 0.009 0.000 0.963 184 K CB 1.243 33.747 32.500 0.007 0.000 0.759 184 K HN -0.376 7.798 8.250 0.016 0.086 0.451 185 N N -3.111 115.581 118.700 -0.012 0.000 2.732 185 N HA 0.376 5.107 4.740 -0.016 0.000 0.230 185 N C -2.064 173.426 175.510 -0.033 0.000 1.487 185 N CA -2.025 51.014 53.050 -0.019 0.000 0.765 185 N CB -0.336 38.142 38.487 -0.014 0.000 1.384 185 N HN -0.343 8.027 8.380 -0.017 0.000 0.530 186 P HA -0.128 4.248 4.420 -0.074 0.000 0.220 186 P C 1.125 178.390 177.300 -0.058 0.000 1.152 186 P CA 2.076 65.137 63.100 -0.065 0.000 0.812 186 P CB 0.572 32.222 31.700 -0.083 0.000 0.792 187 E N -1.758 118.415 120.200 -0.044 0.000 2.085 187 E HA -0.387 3.934 4.350 -0.049 0.000 0.194 187 E C 2.056 178.627 176.600 -0.048 0.000 0.994 187 E CA 3.857 60.231 56.400 -0.044 0.000 0.801 187 E CB -1.042 28.639 29.700 -0.032 0.000 0.743 187 E HN 0.195 8.533 8.360 -0.037 0.000 0.453 188 V N -0.481 119.409 119.914 -0.040 0.000 2.427 188 V HA -0.403 3.693 4.120 -0.040 0.000 0.248 188 V C 1.415 177.480 176.094 -0.049 0.000 1.051 188 V CA 3.148 65.424 62.300 -0.039 0.000 1.048 188 V CB -0.208 31.599 31.823 -0.026 0.000 0.666 188 V HN -0.728 7.440 8.190 -0.035 0.000 0.456 189 R N -1.061 119.409 120.500 -0.050 0.000 2.075 189 R HA -0.241 4.248 4.340 -0.039 -0.172 0.232 189 R C 2.945 179.189 176.300 -0.093 0.000 1.126 189 R CA 1.705 57.773 56.100 -0.054 0.000 0.963 189 R CB -0.901 29.371 30.300 -0.047 0.000 0.858 189 R HN -0.808 7.434 8.270 -0.047 0.000 0.435 190 I N 0.009 120.519 120.570 -0.100 0.000 2.226 190 I HA -0.426 3.647 4.170 -0.161 0.000 0.245 190 I C 1.943 177.972 176.117 -0.147 0.000 1.100 190 I CA 4.073 65.294 61.300 -0.131 0.000 1.374 190 I CB -0.409 37.529 38.000 -0.103 0.000 1.057 190 I HN 0.047 8.206 8.210 -0.085 0.000 0.413 191 N N -0.564 118.071 118.700 -0.109 0.000 2.188 191 N HA -0.224 4.454 4.740 -0.103 0.000 0.184 191 N C 2.650 178.085 175.510 -0.125 0.000 1.018 191 N CA 2.518 55.507 53.050 -0.102 0.000 0.858 191 N CB -0.442 38.004 38.487 -0.069 0.000 0.989 191 N HN -0.254 8.072 8.380 -0.089 0.000 0.426 192 Q N 0.351 120.075 119.800 -0.126 0.000 2.119 192 Q HA -0.277 3.984 4.340 -0.131 0.000 0.201 192 Q C 2.538 178.388 176.000 -0.251 0.000 0.972 192 Q CA 3.156 58.868 55.803 -0.150 0.000 0.847 192 Q CB 0.117 28.793 28.738 -0.105 0.000 0.903 192 Q HN -0.231 7.974 8.270 -0.109 0.000 0.433 193 M N -0.827 118.600 119.600 -0.288 0.000 2.319 193 M HA -0.353 3.836 4.480 -0.485 0.000 0.265 193 M C 2.136 178.130 176.300 -0.512 0.000 1.068 193 M CA 3.785 58.823 55.300 -0.436 0.000 1.118 193 M CB -0.039 32.305 32.600 -0.426 0.000 1.395 193 M HN -0.240 7.906 8.290 -0.240 0.000 0.435 194 Q N -0.434 119.143 119.800 -0.372 0.000 2.170 194 Q HA -0.287 3.853 4.340 -0.333 0.000 0.203 194 Q C 2.477 178.395 176.000 -0.137 0.000 0.976 194 Q CA 3.243 58.890 55.803 -0.260 0.000 0.858 194 Q CB -0.222 28.424 28.738 -0.153 0.000 0.907 194 Q HN -0.287 7.802 8.270 -0.302 0.000 0.433 195 A N -0.514 122.217 122.820 -0.149 0.000 1.930 195 A HA -0.207 4.068 4.320 -0.076 0.000 0.217 195 A C 1.754 179.274 177.584 -0.107 0.000 1.175 195 A CA 2.871 54.842 52.037 -0.109 0.000 0.627 195 A CB -0.631 18.303 19.000 -0.111 0.000 0.815 195 A HN -0.659 7.388 8.150 -0.172 0.000 0.443 196 V N -0.668 119.139 119.914 -0.178 0.000 2.295 196 V HA -0.579 3.462 4.120 -0.131 0.000 0.246 196 V C 1.702 177.853 176.094 0.094 0.000 1.049 196 V CA 4.272 66.493 62.300 -0.131 0.000 1.024 196 V CB -0.150 31.475 31.823 -0.330 0.000 0.648 196 V HN -0.770 7.183 8.190 -0.258 0.082 0.447 197 F N -1.005 118.875 119.950 -0.117 0.000 2.126 197 F HA -0.392 4.095 4.527 -0.065 0.000 0.299 197 F C 2.294 178.036 175.800 -0.098 0.000 1.096 197 F CA 1.308 59.259 58.000 -0.083 0.000 1.255 197 F CB -1.378 37.583 39.000 -0.065 0.000 0.997 197 F HN -0.120 8.259 8.300 0.131 0.000 0.479 198 D N -0.724 119.737 120.400 0.103 0.000 2.123 198 D HA -0.313 4.332 4.640 0.007 0.000 0.196 198 D C 2.788 179.033 176.300 -0.092 0.000 0.992 198 D CA 3.462 57.461 54.000 -0.002 0.000 0.833 198 D CB -0.431 40.356 40.800 -0.021 0.000 0.954 198 D HN -0.278 8.151 8.370 0.097 0.000 0.455 199 M N -1.898 117.627 119.600 -0.125 0.000 2.132 199 M HA -0.304 3.961 4.480 -0.358 0.000 0.263 199 M C 2.116 178.126 176.300 -0.483 0.000 1.065 199 M CA 2.246 57.362 55.300 -0.307 0.000 1.122 199 M CB -0.762 31.729 32.600 -0.181 0.000 1.365 199 M HN -0.615 7.623 8.290 -0.077 0.006 0.411 200 E N 0.699 120.782 120.200 -0.195 0.000 2.077 200 E HA -0.217 4.087 4.350 -0.077 0.000 0.193 200 E C 2.615 179.138 176.600 -0.128 0.000 0.989 200 E CA 2.816 59.146 56.400 -0.117 0.000 0.800 200 E CB -0.495 29.177 29.700 -0.047 0.000 0.746 200 E HN -0.655 7.576 8.360 -0.092 0.074 0.452 201 V N 0.065 119.908 119.914 -0.118 0.000 2.332 201 V HA -0.562 3.512 4.120 -0.077 0.000 0.248 201 V C 1.689 177.736 176.094 -0.078 0.000 1.055 201 V CA 4.434 66.683 62.300 -0.085 0.000 1.038 201 V CB -0.207 31.579 31.823 -0.061 0.000 0.651 201 V HN 0.093 8.221 8.190 -0.103 0.000 0.450 202 M N -0.302 119.212 119.600 -0.143 0.000 2.108 202 M HA -0.550 3.902 4.480 -0.046 0.000 0.261 202 M C 1.828 178.129 176.300 0.002 0.000 1.066 202 M CA 4.061 59.298 55.300 -0.104 0.000 1.107 202 M CB -0.059 32.431 32.600 -0.182 0.000 1.356 202 M HN -0.520 7.654 8.290 -0.193 0.000 0.406 203 H N -1.275 117.798 119.070 0.005 0.000 2.363 203 H HA -0.247 4.315 4.556 0.010 0.000 0.301 203 H C 2.682 178.027 175.328 0.029 0.000 1.074 203 H CA 2.519 58.572 56.048 0.009 0.000 1.354 203 H CB 0.216 29.974 29.762 -0.007 0.000 1.397 203 H HN -0.581 7.532 8.280 -0.279 0.000 0.516 204 L N -1.236 120.062 121.223 0.126 0.000 2.046 204 L HA -0.404 4.019 4.340 0.138 0.000 0.208 204 L C 1.711 178.646 176.870 0.109 0.000 1.077 204 L CA 3.343 58.240 54.840 0.095 0.000 0.747 204 L CB -0.545 41.515 42.059 0.001 0.000 0.896 204 L HN 0.010 8.288 8.230 0.079 0.000 0.432 205 K N -1.664 118.776 120.400 0.068 0.000 2.148 205 K HA -0.231 4.126 4.320 0.063 0.000 0.204 205 K C 2.481 179.129 176.600 0.080 0.000 1.050 205 K CA 3.131 59.455 56.287 0.062 0.000 0.942 205 K CB -0.179 32.340 32.500 0.031 0.000 0.724 205 K HN 0.014 8.292 8.250 0.046 0.000 0.446 206 A N -1.229 121.645 122.820 0.091 0.000 1.902 206 A HA -0.185 4.178 4.320 0.072 0.000 0.217 206 A C 1.776 179.411 177.584 0.084 0.000 1.181 206 A CA 2.953 55.040 52.037 0.084 0.000 0.623 206 A CB -0.888 18.166 19.000 0.090 0.000 0.818 206 A HN -0.385 7.825 8.150 0.100 0.000 0.443 207 A N -2.212 120.672 122.820 0.106 0.000 1.929 207 A HA -0.379 3.952 4.320 0.018 0.000 0.216 207 A C 1.354 178.955 177.584 0.028 0.000 1.176 207 A CA 2.717 54.789 52.037 0.059 0.000 0.628 207 A CB -0.557 18.512 19.000 0.114 0.000 0.816 207 A HN -0.631 7.600 8.150 0.135 0.000 0.444 208 Q N -0.428 119.469 119.800 0.162 0.000 2.079 208 Q HA -0.322 4.118 4.340 0.167 0.000 0.200 208 Q C 2.444 178.451 176.000 0.012 0.000 0.974 208 Q CA 2.964 58.847 55.803 0.133 0.000 0.840 208 Q CB -0.013 28.808 28.738 0.138 0.000 0.898 208 Q HN -0.266 8.038 8.270 0.195 0.083 0.430 209 R N -2.142 118.383 120.500 0.041 0.000 2.083 209 R HA -0.387 3.964 4.340 0.019 0.000 0.237 209 R C 2.423 178.737 176.300 0.023 0.000 1.137 209 R CA 3.804 59.925 56.100 0.033 0.000 0.951 209 R CB -0.105 30.228 30.300 0.055 0.000 0.851 209 R HN -0.407 7.900 8.270 0.061 0.000 0.434 210 H N 0.184 119.229 119.070 -0.042 0.000 2.270 210 H HA -0.217 4.328 4.556 -0.018 0.000 0.299 210 H C 2.281 177.558 175.328 -0.085 0.000 1.077 210 H CA 3.346 59.364 56.048 -0.048 0.000 1.294 210 H CB 0.102 29.832 29.762 -0.053 0.000 1.371 210 H HN -0.881 7.487 8.280 0.146 0.000 0.491 211 I N -1.447 119.006 120.570 -0.195 0.000 2.179 211 I HA -0.488 3.496 4.170 -0.310 0.000 0.242 211 I C 2.681 178.669 176.117 -0.214 0.000 1.088 211 I CA 3.971 65.089 61.300 -0.303 0.000 1.357 211 I CB 0.188 37.851 38.000 -0.561 0.000 1.051 211 I HN -0.207 7.940 8.210 -0.104 0.000 0.409 212 E N -1.284 118.779 120.200 -0.229 0.000 2.274 212 E HA -0.278 3.928 4.350 -0.240 0.000 0.194 212 E C 2.848 179.462 176.600 0.023 0.000 0.996 212 E CA 2.375 58.638 56.400 -0.229 0.000 0.840 212 E CB -0.502 28.907 29.700 -0.485 0.000 0.772 212 E HN 0.027 8.251 8.360 -0.226 0.000 0.491 213 G N -0.172 108.592 108.800 -0.061 0.000 2.450 213 G HA2 -0.250 3.715 3.960 0.009 0.000 0.220 213 G HA3 -0.250 3.707 3.960 -0.089 -0.050 0.220 213 G C 0.741 175.602 174.900 -0.065 0.000 1.130 213 G CA 1.795 46.867 45.100 -0.048 0.000 0.760 213 G HN -0.249 7.857 8.290 -0.112 0.116 0.557 214 L N 0.808 121.954 121.223 -0.129 0.000 2.127 214 L HA -0.315 3.828 4.340 -0.328 0.000 0.211 214 L C 2.236 179.118 176.870 0.021 0.000 1.089 214 L CA 2.238 56.963 54.840 -0.193 0.000 0.757 214 L CB -0.472 41.412 42.059 -0.292 0.000 0.899 214 L HN -0.635 7.476 8.230 -0.161 0.023 0.434 215 A N -3.290 119.690 122.820 0.266 0.000 2.119 215 A HA -0.124 4.473 4.320 0.462 0.000 0.217 215 A C 0.403 178.067 177.584 0.133 0.000 1.153 215 A CA 1.550 53.785 52.037 0.331 0.000 0.692 215 A CB 0.211 19.435 19.000 0.374 0.000 0.799 215 A HN -0.557 7.734 8.150 0.284 0.029 0.458 216 S N -3.548 112.198 115.700 0.077 0.000 2.588 216 S HA 0.197 4.685 4.470 0.030 0.000 0.245 216 S C 0.007 174.599 174.600 -0.012 0.000 1.021 216 S CA -0.652 57.567 58.200 0.032 0.000 1.006 216 S CB 0.308 63.533 63.200 0.041 0.000 0.830 216 S HN -0.534 7.794 8.310 0.073 0.026 0.468 217 T N 3.780 118.296 114.554 -0.064 0.000 2.856 217 T HA 0.102 4.402 4.350 -0.083 0.000 0.283 217 T C -1.946 172.670 174.700 -0.140 0.000 1.008 217 T CA -0.914 61.101 62.100 -0.141 0.000 0.997 217 T CB 1.701 70.365 68.868 -0.340 0.000 0.992 217 T HN -0.560 7.478 8.240 -0.059 0.167 0.454 218 D N 4.283 124.630 120.400 -0.089 0.000 2.359 218 D HA 0.020 4.636 4.640 -0.039 0.000 0.250 218 D C 0.514 176.770 176.300 -0.074 0.000 1.264 218 D CA -0.500 53.471 54.000 -0.048 0.000 0.911 218 D CB -0.257 40.546 40.800 0.005 0.000 1.056 218 D HN 0.284 8.622 8.370 -0.053 0.000 0.499 219 L N 4.623 125.782 121.223 -0.107 0.000 2.599 219 L HA -0.118 4.107 4.340 -0.191 0.000 0.230 219 L C 0.109 177.002 176.870 0.039 0.000 1.141 219 L CA 0.614 55.392 54.840 -0.104 0.000 0.877 219 L CB -0.492 41.483 42.059 -0.140 0.000 1.009 219 L HN 0.166 8.348 8.230 -0.081 0.000 0.447 220 N N -2.480 116.240 118.700 0.033 0.000 2.235 220 N HA 0.098 4.858 4.740 0.034 0.000 0.209 220 N C -0.934 174.602 175.510 0.042 0.000 1.122 220 N CA 0.326 53.396 53.050 0.034 0.000 0.845 220 N CB 0.827 39.325 38.487 0.017 0.000 1.004 220 N HN -0.386 8.238 8.380 0.019 -0.232 0.499 221 Q N -1.858 117.987 119.800 0.076 0.000 2.484 221 Q HA 0.322 4.686 4.340 0.039 0.000 0.285 221 Q C -0.123 175.932 176.000 0.092 0.000 1.097 221 Q CA -0.967 54.876 55.803 0.066 0.000 0.802 221 Q CB 2.696 31.468 28.738 0.057 0.000 1.444 221 Q HN -0.693 7.584 8.270 0.105 0.056 0.429 222 G N 0.051 108.871 108.800 0.033 0.000 2.564 222 G HA2 -0.340 3.602 3.960 -0.029 0.000 0.273 222 G HA3 -0.340 3.619 3.960 -0.002 0.000 0.273 222 G C 0.734 175.585 174.900 -0.083 0.000 1.242 222 G CA 0.293 45.384 45.100 -0.014 0.000 0.951 222 G HN 0.113 8.414 8.290 0.019 0.000 0.564 223 V N 2.340 122.113 119.914 -0.235 0.000 2.594 223 V HA -0.207 4.017 4.120 -0.210 -0.230 0.253 223 V C 1.696 177.606 176.094 -0.307 0.000 1.069 223 V CA 2.185 64.294 62.300 -0.319 0.000 1.082 223 V CB 0.029 31.583 31.823 -0.448 0.000 0.680 223 V HN 0.222 8.242 8.190 -0.283 0.000 0.469 224 Y N -2.211 118.051 120.300 -0.063 0.000 2.497 224 Y HA -0.141 4.352 4.550 -0.096 0.000 0.292 224 Y C 0.585 176.431 175.900 -0.091 0.000 1.137 224 Y CA 1.694 59.746 58.100 -0.080 0.000 1.285 224 Y CB -0.984 37.436 38.460 -0.066 0.000 0.991 224 Y HN -0.597 7.445 8.280 -0.353 0.026 0.556 225 A N -4.812 118.031 122.820 0.038 0.000 2.470 225 A HA 0.254 4.566 4.320 -0.013 0.000 0.251 225 A C -1.094 176.453 177.584 -0.061 0.000 1.245 225 A CA -1.139 50.892 52.037 -0.009 0.000 0.932 225 A CB 0.465 19.470 19.000 0.010 0.000 1.037 225 A HN -0.726 7.392 8.150 0.020 0.043 0.522 226 E N 0.453 120.603 120.200 -0.083 0.000 2.376 226 E HA -0.126 4.180 4.350 -0.074 0.000 0.266 226 E C -0.494 176.038 176.600 -0.113 0.000 1.009 226 E CA 0.092 56.438 56.400 -0.090 0.000 0.902 226 E CB 0.878 30.521 29.700 -0.094 0.000 0.972 226 E HN -0.762 7.544 8.360 -0.091 0.000 0.439 227 G N 2.468 111.209 108.800 -0.098 0.000 2.417 227 G HA2 0.397 4.402 3.960 -0.178 0.000 0.334 227 G HA3 0.397 4.287 3.960 -0.116 0.000 0.334 227 G C -2.052 172.807 174.900 -0.069 0.000 1.150 227 G CA -1.303 43.724 45.100 -0.122 0.000 0.923 227 G HN 0.152 8.396 8.290 -0.077 0.000 0.485 228 L N 2.332 123.514 121.223 -0.069 0.000 2.281 228 L HA 0.302 4.680 4.340 0.063 0.000 0.285 228 L C -1.727 175.237 176.870 0.156 0.000 1.074 228 L CA -2.966 51.911 54.840 0.061 0.000 0.817 228 L CB 0.968 43.086 42.059 0.099 0.000 1.168 228 L HN -0.223 7.916 8.230 -0.151 0.000 0.434 229 P HA -0.055 4.404 4.420 0.066 0.000 0.265 229 P C 0.284 177.665 177.300 0.135 0.000 1.187 229 P CA -0.282 62.878 63.100 0.100 0.000 0.766 229 P CB 1.002 32.737 31.700 0.059 0.000 0.820 230 E N 3.188 123.402 120.200 0.022 0.000 2.118 230 E HA -0.432 3.739 4.350 -0.299 0.000 0.195 230 E C 1.371 177.714 176.600 -0.428 0.000 0.992 230 E CA 3.597 59.862 56.400 -0.225 0.000 0.804 230 E CB -0.207 29.403 29.700 -0.150 0.000 0.741 230 E HN 0.596 8.966 8.360 0.016 0.000 0.458 231 D N -3.656 116.637 120.400 -0.180 0.000 2.312 231 D HA -0.141 4.384 4.640 -0.192 0.000 0.211 231 D C 1.444 177.692 176.300 -0.087 0.000 0.964 231 D CA 2.391 56.304 54.000 -0.145 0.000 0.877 231 D CB -0.670 40.090 40.800 -0.067 0.000 0.924 231 D HN 0.236 8.530 8.370 -0.099 0.016 0.515 232 A N -1.118 121.702 122.820 -0.000 0.000 1.972 232 A HA -0.169 4.209 4.320 0.098 0.000 0.219 232 A C 0.825 178.538 177.584 0.216 0.000 1.169 232 A CA 2.821 54.942 52.037 0.139 0.000 0.635 232 A CB -0.069 19.080 19.000 0.248 0.000 0.810 232 A HN -0.278 7.738 8.150 0.017 0.144 0.446 233 F N -10.193 109.830 119.950 0.122 0.000 2.880 233 F HA 0.088 4.687 4.527 0.119 0.000 0.346 233 F C -1.154 174.723 175.800 0.130 0.000 1.054 233 F CA -0.872 57.217 58.000 0.149 0.000 1.151 233 F CB 1.886 41.045 39.000 0.264 0.000 1.066 233 F HN -0.853 7.268 8.300 -0.268 0.019 0.566 234 N N 1.701 120.054 118.700 -0.578 0.000 2.898 234 N HA 0.135 4.799 4.740 -0.126 0.000 0.245 234 N C 0.261 175.653 175.510 -0.196 0.000 1.185 234 N CA -2.183 50.639 53.050 -0.380 0.000 0.879 234 N CB -0.756 37.338 38.487 -0.655 0.000 1.157 234 N HN -0.386 7.529 8.380 -0.774 0.000 0.503 235 K N 4.046 124.400 120.400 -0.076 0.000 2.167 235 K HA -0.057 4.226 4.320 -0.062 0.000 0.203 235 K C 1.059 177.637 176.600 -0.037 0.000 1.052 235 K CA 1.829 58.087 56.287 -0.047 0.000 0.956 235 K CB -0.647 31.847 32.500 -0.011 0.000 0.735 235 K HN 0.373 8.604 8.250 -0.032 0.000 0.451 236 A N -3.075 119.731 122.820 -0.023 0.000 2.167 236 A HA 0.105 4.419 4.320 -0.011 0.000 0.214 236 A C 0.433 178.005 177.584 -0.020 0.000 1.151 236 A CA -0.167 51.862 52.037 -0.013 0.000 0.735 236 A CB -0.115 18.887 19.000 0.004 0.000 0.802 236 A HN 0.026 8.166 8.150 -0.016 0.000 0.467 237 G N -0.938 107.836 108.800 -0.042 0.000 2.249 237 G HA2 -0.262 3.658 3.960 -0.067 0.000 0.273 237 G HA3 -0.262 3.677 3.960 -0.036 0.000 0.273 237 G C 0.259 175.150 174.900 -0.014 0.000 1.036 237 G CA 0.336 45.410 45.100 -0.042 0.000 0.824 237 G HN -0.391 7.921 8.290 -0.062 -0.059 0.504 238 V N -6.489 113.426 119.914 0.002 0.000 2.999 238 V HA -0.048 4.084 4.120 0.020 0.000 0.307 238 V C -0.664 175.452 176.094 0.037 0.000 1.084 238 V CA -0.025 62.290 62.300 0.025 0.000 1.155 238 V CB 0.819 32.667 31.823 0.042 0.000 0.975 238 V HN -0.922 7.427 8.190 0.001 -0.159 0.490 239 T N -4.087 110.491 114.554 0.040 0.000 2.969 239 T HA -0.031 4.353 4.350 0.057 0.000 0.250 239 T C 0.053 174.790 174.700 0.062 0.000 1.021 239 T CA -1.096 61.034 62.100 0.049 0.000 1.003 239 T CB 0.879 69.766 68.868 0.033 0.000 1.040 239 T HN 0.011 8.272 8.240 0.034 0.000 0.492 240 N N 1.538 120.268 118.700 0.051 0.000 2.412 240 N HA -0.113 4.654 4.740 0.045 0.000 0.258 240 N C 0.480 176.027 175.510 0.062 0.000 1.236 240 N CA 0.477 53.556 53.050 0.048 0.000 0.882 240 N CB 1.598 40.105 38.487 0.033 0.000 1.066 240 N HN -0.191 8.215 8.380 0.043 0.000 0.465 241 N N 3.969 122.708 118.700 0.064 0.000 2.188 241 N HA -0.224 4.600 4.740 0.141 0.000 0.184 241 N C 1.893 177.385 175.510 -0.030 0.000 1.018 241 N CA 2.608 55.706 53.050 0.079 0.000 0.858 241 N CB -0.058 38.492 38.487 0.104 0.000 0.989 241 N HN 0.499 8.913 8.380 0.057 0.000 0.426 242 V N 0.450 120.348 119.914 -0.027 0.000 2.358 242 V HA -0.551 3.505 4.120 -0.107 0.000 0.246 242 V C 1.489 177.547 176.094 -0.060 0.000 1.047 242 V CA 4.335 66.598 62.300 -0.061 0.000 1.035 242 V CB -0.224 31.589 31.823 -0.018 0.000 0.658 242 V HN -0.453 7.860 8.190 -0.000 -0.123 0.452 243 E N -0.422 119.773 120.200 -0.008 0.000 2.107 243 E HA -0.301 4.059 4.350 0.016 0.000 0.191 243 E C 2.670 179.304 176.600 0.057 0.000 0.982 243 E CA 3.275 59.689 56.400 0.022 0.000 0.809 243 E CB -0.425 29.297 29.700 0.037 0.000 0.756 243 E HN -0.321 8.320 8.360 0.007 -0.277 0.459 244 R N -1.065 119.483 120.500 0.079 0.000 2.075 244 R HA -0.330 4.214 4.340 0.340 0.000 0.232 244 R C 2.351 178.687 176.300 0.061 0.000 1.126 244 R CA 3.489 59.734 56.100 0.241 0.000 0.963 244 R CB -0.158 30.381 30.300 0.399 0.000 0.858 244 R HN 0.044 8.354 8.270 0.066 0.000 0.435 245 A N -1.380 121.126 122.820 -0.523 0.000 1.930 245 A HA -0.173 3.121 4.320 -1.711 0.000 0.217 245 A C 1.750 179.229 177.584 -0.173 0.000 1.175 245 A CA 2.841 54.270 52.037 -1.013 0.000 0.627 245 A CB -0.906 17.418 19.000 -1.127 0.000 0.815 245 A HN -0.087 7.782 8.150 -0.469 0.000 0.443 246 A N -1.492 121.285 122.820 -0.073 0.000 1.902 246 A HA -0.445 3.881 4.320 0.009 0.000 0.217 246 A C 1.280 178.920 177.584 0.094 0.000 1.181 246 A CA 3.081 55.128 52.037 0.018 0.000 0.623 246 A CB -0.510 18.499 19.000 0.014 0.000 0.818 246 A HN -0.330 7.763 8.150 -0.096 0.000 0.443 247 A N -1.196 121.729 122.820 0.175 0.000 1.940 247 A HA -0.329 4.114 4.320 0.204 0.000 0.219 247 A C 1.399 179.219 177.584 0.394 0.000 1.176 247 A CA 3.288 55.500 52.037 0.292 0.000 0.631 247 A CB -0.667 18.565 19.000 0.387 0.000 0.814 247 A HN -0.296 7.951 8.150 0.163 0.000 0.446 248 W N -0.473 120.906 121.300 0.132 0.000 2.379 248 W HA -0.345 4.206 4.660 -0.181 0.000 0.307 248 W C 1.569 178.076 176.519 -0.020 0.000 1.200 248 W CA 3.968 61.237 57.345 -0.126 0.000 1.297 248 W CB -0.014 29.276 29.460 -0.283 0.000 1.140 248 W HN -0.476 7.880 8.180 0.438 0.086 0.507 249 I N -1.345 119.178 120.570 -0.078 0.000 2.252 249 I HA -0.650 3.159 4.170 -0.601 0.000 0.245 249 I C 2.093 178.097 176.117 -0.188 0.000 1.102 249 I CA 4.299 65.423 61.300 -0.292 0.000 1.385 249 I CB -0.052 37.882 38.000 -0.110 0.000 1.064 249 I HN -0.473 7.808 8.210 0.118 0.000 0.414 250 I N -0.836 119.699 120.570 -0.058 0.000 2.226 250 I HA -0.517 3.625 4.170 -0.047 0.000 0.245 250 I C 2.160 178.261 176.117 -0.026 0.000 1.100 250 I CA 4.057 65.340 61.300 -0.028 0.000 1.374 250 I CB -0.126 37.886 38.000 0.021 0.000 1.057 250 I HN 0.141 8.347 8.210 -0.007 0.000 0.413 251 N N -0.226 118.480 118.700 0.010 0.000 2.142 251 N HA -0.315 4.452 4.740 0.045 0.000 0.186 251 N C 2.337 177.823 175.510 -0.041 0.000 1.023 251 N CA 3.201 56.272 53.050 0.036 0.000 0.852 251 N CB -0.104 38.482 38.487 0.166 0.000 0.998 251 N HN -0.431 7.976 8.380 0.044 0.000 0.424 252 A N -0.687 122.035 122.820 -0.163 0.000 2.019 252 A HA -0.064 4.172 4.320 -0.140 0.000 0.219 252 A C 1.618 179.120 177.584 -0.137 0.000 1.164 252 A CA 2.487 54.401 52.037 -0.205 0.000 0.644 252 A CB -0.311 18.425 19.000 -0.439 0.000 0.805 252 A HN -0.302 7.703 8.150 -0.242 0.000 0.449 253 S N -4.541 111.085 115.700 -0.124 0.000 2.554 253 S HA 0.079 4.498 4.470 -0.085 0.000 0.226 253 S C -0.951 173.615 174.600 -0.056 0.000 0.980 253 S CA -0.365 57.781 58.200 -0.090 0.000 0.939 253 S CB 0.547 63.687 63.200 -0.101 0.000 0.832 253 S HN -0.588 7.619 8.310 -0.131 0.025 0.486 254 N N 1.400 120.076 118.700 -0.040 0.000 2.710 254 N HA -0.408 4.327 4.740 -0.009 0.000 0.249 254 N C -1.196 174.301 175.510 -0.021 0.000 1.059 254 N CA 1.086 54.124 53.050 -0.020 0.000 0.720 254 N CB -1.236 37.242 38.487 -0.015 0.000 0.983 254 N HN -0.508 7.684 8.380 -0.042 0.163 0.544 255 S N -1.760 113.924 115.700 -0.028 0.000 2.585 255 S HA -0.104 4.348 4.470 -0.031 0.000 0.273 255 S C -0.951 173.641 174.600 -0.015 0.000 1.339 255 S CA 1.515 59.698 58.200 -0.028 0.000 1.028 255 S CB 1.018 64.196 63.200 -0.037 0.000 0.906 255 S HN -0.472 7.814 8.310 -0.033 0.004 0.528 256 K N 1.479 121.871 120.400 -0.015 0.000 2.509 256 K HA 0.157 4.475 4.320 -0.004 0.000 0.266 256 K C 0.473 177.068 176.600 -0.009 0.000 0.987 256 K CA -0.715 55.568 56.287 -0.008 0.000 0.868 256 K CB 2.769 35.265 32.500 -0.007 0.000 1.421 256 K HN 0.309 8.547 8.250 -0.019 0.000 0.444 257 G N 2.126 110.923 108.800 -0.005 0.000 2.564 257 G HA2 -0.486 3.472 3.960 -0.003 0.000 0.273 257 G HA3 -0.486 3.470 3.960 -0.007 0.000 0.273 257 G C 0.497 175.392 174.900 -0.007 0.000 1.242 257 G CA 0.842 45.939 45.100 -0.006 0.000 0.951 257 G HN 0.179 8.467 8.290 -0.002 0.000 0.564 258 N N 1.691 120.385 118.700 -0.009 0.000 2.205 258 N HA -0.299 4.437 4.740 -0.008 0.000 0.186 258 N C 1.793 177.294 175.510 -0.016 0.000 1.015 258 N CA 2.517 55.560 53.050 -0.010 0.000 0.862 258 N CB -0.472 38.008 38.487 -0.011 0.000 0.986 258 N HN 0.184 8.558 8.380 -0.009 0.000 0.429 259 D N 0.754 121.142 120.400 -0.021 0.000 2.097 259 D HA -0.345 4.273 4.640 -0.036 0.000 0.195 259 D C 1.399 177.681 176.300 -0.029 0.000 0.989 259 D CA 3.244 57.226 54.000 -0.031 0.000 0.827 259 D CB -0.281 40.498 40.800 -0.036 0.000 0.966 259 D HN -0.436 7.906 8.370 -0.020 0.016 0.456 260 A N -0.932 121.875 122.820 -0.021 0.000 1.933 260 A HA -0.378 3.930 4.320 -0.020 0.000 0.218 260 A C 2.089 179.668 177.584 -0.009 0.000 1.175 260 A CA 3.151 55.179 52.037 -0.015 0.000 0.628 260 A CB -0.302 18.695 19.000 -0.005 0.000 0.814 260 A HN -0.617 7.415 8.150 -0.018 0.107 0.444 261 E N -1.896 118.301 120.200 -0.006 0.000 2.110 261 E HA -0.465 3.887 4.350 0.003 0.000 0.193 261 E C 2.373 178.971 176.600 -0.003 0.000 0.988 261 E CA 3.089 59.488 56.400 -0.001 0.000 0.804 261 E CB -0.270 29.430 29.700 -0.000 0.000 0.745 261 E HN -0.444 7.912 8.360 -0.007 0.000 0.458 262 N N 0.034 118.727 118.700 -0.011 0.000 2.142 262 N HA -0.199 4.538 4.740 -0.005 0.000 0.186 262 N C 1.896 177.395 175.510 -0.017 0.000 1.023 262 N CA 2.847 55.889 53.050 -0.014 0.000 0.852 262 N CB -0.103 38.368 38.487 -0.026 0.000 0.998 262 N HN -0.307 7.958 8.380 -0.015 0.105 0.424 263 I N 0.089 120.642 120.570 -0.028 0.000 2.118 263 I HA -0.626 3.517 4.170 -0.044 0.000 0.241 263 I C 1.795 177.906 176.117 -0.010 0.000 1.070 263 I CA 4.863 66.144 61.300 -0.031 0.000 1.327 263 I CB -0.138 37.840 38.000 -0.036 0.000 1.034 263 I HN -0.289 7.902 8.210 -0.031 0.000 0.405 264 T N 2.076 116.629 114.554 -0.001 0.000 2.708 264 T HA -0.446 3.908 4.350 0.007 0.000 0.266 264 T C 2.033 176.744 174.700 0.018 0.000 1.037 264 T CA 5.084 67.189 62.100 0.008 0.000 1.146 264 T CB -0.222 68.652 68.868 0.011 0.000 0.865 264 T HN -0.411 7.827 8.240 -0.003 0.000 0.435 265 S N 2.324 118.036 115.700 0.020 0.000 2.382 265 S HA -0.218 4.271 4.470 0.032 0.000 0.228 265 S C 1.989 176.627 174.600 0.063 0.000 1.027 265 S CA 3.775 61.995 58.200 0.034 0.000 0.991 265 S CB -0.602 62.615 63.200 0.028 0.000 0.823 265 S HN -0.324 7.994 8.310 0.014 0.000 0.469 266 L N 1.926 123.186 121.223 0.062 0.000 2.056 266 L HA -0.289 4.168 4.340 0.194 0.000 0.207 266 L C 2.102 179.064 176.870 0.154 0.000 1.078 266 L CA 3.117 58.027 54.840 0.116 0.000 0.749 266 L CB -0.311 41.753 42.059 0.008 0.000 0.901 266 L HN 0.016 8.266 8.230 0.034 0.000 0.433 267 L N -0.785 120.482 121.223 0.073 0.000 2.017 267 L HA -0.431 3.958 4.340 0.082 0.000 0.208 267 L C 2.581 179.505 176.870 0.090 0.000 1.073 267 L CA 3.311 58.194 54.840 0.071 0.000 0.745 267 L CB -0.379 41.692 42.059 0.019 0.000 0.894 267 L HN -0.354 7.901 8.230 0.042 0.000 0.432 268 K N -1.977 118.462 120.400 0.065 0.000 2.026 268 K HA -0.436 3.906 4.320 0.037 0.000 0.208 268 K C 2.378 179.013 176.600 0.059 0.000 1.048 268 K CA 3.488 59.804 56.287 0.048 0.000 0.929 268 K CB -0.323 32.197 32.500 0.033 0.000 0.713 268 K HN -0.529 7.754 8.250 0.055 0.000 0.439 269 E N -0.560 119.692 120.200 0.087 0.000 2.051 269 E HA -0.286 4.065 4.350 0.002 0.000 0.192 269 E C 2.919 179.519 176.600 -0.000 0.000 0.991 269 E CA 2.731 59.158 56.400 0.046 0.000 0.799 269 E CB 0.056 29.803 29.700 0.079 0.000 0.748 269 E HN -0.487 7.937 8.360 0.107 0.000 0.449 270 Y N -1.204 119.103 120.300 0.011 0.000 2.516 270 Y HA -0.178 4.567 4.550 0.018 -0.184 0.291 270 Y C 1.515 177.425 175.900 0.016 0.000 1.131 270 Y CA 2.373 60.483 58.100 0.017 0.000 1.281 270 Y CB -0.150 38.326 38.460 0.026 0.000 1.013 270 Y HN -0.069 8.450 8.280 0.400 0.000 0.554 271 A N -2.354 120.541 122.820 0.125 0.000 2.015 271 A HA -0.165 4.203 4.320 0.081 0.000 0.219 271 A C -0.180 177.423 177.584 0.032 0.000 1.163 271 A CA 2.687 54.766 52.037 0.070 0.000 0.646 271 A CB -0.093 18.935 19.000 0.047 0.000 0.806 271 A HN -0.439 7.760 8.150 0.125 0.027 0.448 272 T N -7.466 107.091 114.554 0.004 0.000 3.111 272 T HA 0.146 4.492 4.350 -0.007 0.000 0.284 272 T C 0.602 175.273 174.700 -0.049 0.000 0.983 272 T CA 0.025 62.115 62.100 -0.016 0.000 0.900 272 T CB 0.626 69.487 68.868 -0.013 0.000 1.132 272 T HN -0.674 7.536 8.240 -0.002 0.029 0.531 273 N N 1.769 120.410 118.700 -0.097 0.000 2.336 273 N HA -0.013 4.660 4.740 -0.111 0.000 0.189 273 N C 1.189 176.632 175.510 -0.113 0.000 1.113 273 N CA -0.723 52.239 53.050 -0.147 0.000 0.858 273 N CB -0.883 37.429 38.487 -0.291 0.000 0.970 273 N HN -0.547 7.769 8.380 -0.106 0.000 0.471 274 G N -0.060 108.702 108.800 -0.065 0.000 2.196 274 G HA2 -0.429 3.523 3.960 -0.013 0.000 0.268 274 G HA3 -0.429 3.512 3.960 -0.032 0.000 0.268 274 G C -0.027 174.860 174.900 -0.021 0.000 0.975 274 G CA 0.561 45.642 45.100 -0.031 0.000 0.648 274 G HN 0.126 8.342 8.290 -0.049 0.045 0.538 275 K N 1.096 121.469 120.400 -0.046 0.000 2.451 275 K HA -0.178 4.143 4.320 0.002 0.000 0.280 275 K C -1.158 175.486 176.600 0.074 0.000 1.020 275 K CA -0.130 56.161 56.287 0.006 0.000 1.008 275 K CB 0.601 33.093 32.500 -0.012 0.000 0.917 275 K HN -0.696 7.692 8.250 -0.104 -0.200 0.478 276 D N 2.913 123.353 120.400 0.067 0.000 2.417 276 D HA -0.105 4.572 4.640 0.062 0.000 0.250 276 D C 0.131 176.494 176.300 0.104 0.000 1.166 276 D CA 0.240 54.282 54.000 0.071 0.000 0.881 276 D CB 0.573 41.403 40.800 0.051 0.000 1.164 276 D HN 0.141 8.544 8.370 0.055 0.000 0.467 277 L N 2.835 124.123 121.223 0.109 0.000 2.492 277 L HA -0.039 4.393 4.340 0.153 0.000 0.223 277 L C 0.958 177.896 176.870 0.113 0.000 1.132 277 L CA 0.623 55.541 54.840 0.130 0.000 0.850 277 L CB 0.227 42.366 42.059 0.134 0.000 0.966 277 L HN 0.216 8.503 8.230 0.094 0.000 0.454 278 L N -1.424 119.848 121.223 0.082 0.000 2.998 278 L HA 0.067 4.452 4.340 0.074 0.000 0.234 278 L C -2.041 174.865 176.870 0.061 0.000 1.350 278 L CA -0.659 54.219 54.840 0.064 0.000 1.202 278 L CB -1.837 40.240 42.059 0.030 0.000 1.583 278 L HN -0.554 7.983 8.230 0.071 -0.264 0.456 279 N N -0.957 117.791 118.700 0.081 0.000 2.519 279 N HA 0.169 5.061 4.740 0.059 -0.117 0.291 279 N C -1.138 174.427 175.510 0.092 0.000 1.107 279 N CA -0.545 52.549 53.050 0.074 0.000 0.904 279 N CB 2.700 41.229 38.487 0.070 0.000 1.500 279 N HN -0.888 7.472 8.380 0.098 0.079 0.510 280 M N 4.749 124.396 119.600 0.077 0.000 2.254 280 M HA -0.194 4.350 4.480 0.107 0.000 0.265 280 M C 0.950 177.313 176.300 0.105 0.000 1.066 280 M CA 1.900 57.251 55.300 0.086 0.000 1.123 280 M CB 0.364 32.991 32.600 0.045 0.000 1.388 280 M HN 0.596 9.295 8.290 0.061 -0.372 0.425 281 D N 0.129 120.581 120.400 0.087 0.000 2.117 281 D HA -0.350 4.346 4.640 0.095 0.000 0.197 281 D C 2.419 178.789 176.300 0.118 0.000 0.987 281 D CA 3.376 57.431 54.000 0.093 0.000 0.829 281 D CB -0.758 40.084 40.800 0.070 0.000 0.961 281 D HN -0.279 8.211 8.370 0.072 -0.077 0.460 282 N N -0.176 118.598 118.700 0.123 0.000 2.149 282 N HA -0.229 4.604 4.740 0.156 0.000 0.188 282 N C 2.191 177.807 175.510 0.176 0.000 1.019 282 N CA 2.729 55.873 53.050 0.156 0.000 0.857 282 N CB -0.140 38.444 38.487 0.162 0.000 0.997 282 N HN -0.437 8.307 8.380 0.110 -0.297 0.426 283 L N -0.853 120.478 121.223 0.179 0.000 2.109 283 L HA -0.303 4.133 4.340 0.160 0.000 0.207 283 L C 1.935 178.947 176.870 0.237 0.000 1.086 283 L CA 3.363 58.329 54.840 0.210 0.000 0.760 283 L CB -0.545 41.685 42.059 0.286 0.000 0.910 283 L HN -0.441 7.794 8.230 0.170 0.097 0.437 284 K N -0.809 119.744 120.400 0.255 0.000 2.097 284 K HA -0.349 4.200 4.320 0.383 0.000 0.205 284 K C 2.248 178.951 176.600 0.172 0.000 1.050 284 K CA 4.053 60.503 56.287 0.272 0.000 0.938 284 K CB -0.336 32.297 32.500 0.222 0.000 0.718 284 K HN -0.168 8.214 8.250 0.221 0.000 0.442 285 E N 0.224 120.508 120.200 0.141 0.000 2.072 285 E HA -0.287 4.124 4.350 0.102 0.000 0.191 285 E C 2.279 178.929 176.600 0.083 0.000 0.985 285 E CA 2.981 59.450 56.400 0.114 0.000 0.801 285 E CB 0.066 29.843 29.700 0.129 0.000 0.750 285 E HN -0.584 7.865 8.360 0.148 0.000 0.452 286 L N -0.521 120.739 121.223 0.062 0.000 2.046 286 L HA -0.380 3.910 4.340 -0.084 0.000 0.208 286 L C 1.315 178.104 176.870 -0.135 0.000 1.077 286 L CA 2.882 57.665 54.840 -0.094 0.000 0.747 286 L CB -0.423 41.471 42.059 -0.274 0.000 0.896 286 L HN -0.512 7.774 8.230 0.093 0.000 0.432 287 H N 0.225 119.159 119.070 -0.227 0.000 2.387 287 H HA -0.362 3.951 4.556 -0.405 0.000 0.299 287 H C 1.663 176.855 175.328 -0.226 0.000 1.090 287 H CA 3.970 59.791 56.048 -0.378 0.000 1.332 287 H CB 0.435 29.718 29.762 -0.798 0.000 1.386 287 H HN 0.039 8.321 8.280 0.004 0.000 0.516 288 A N -2.313 120.471 122.820 -0.061 0.000 1.972 288 A HA -0.196 4.088 4.320 -0.061 0.000 0.219 288 A C 1.027 178.550 177.584 -0.101 0.000 1.169 288 A CA 2.532 54.539 52.037 -0.051 0.000 0.635 288 A CB -0.461 18.563 19.000 0.040 0.000 0.810 288 A HN -0.303 7.865 8.150 0.031 0.000 0.446 289 R N -3.603 116.842 120.500 -0.091 0.000 2.153 289 R HA -0.135 4.173 4.340 -0.055 0.000 0.218 289 R C 1.478 177.701 176.300 -0.129 0.000 1.072 289 R CA 1.946 58.001 56.100 -0.076 0.000 0.990 289 R CB 0.230 30.518 30.300 -0.021 0.000 0.889 289 R HN -0.689 7.535 8.270 -0.076 0.000 0.452 290 L N -2.264 118.831 121.223 -0.214 0.000 2.162 290 L HA -0.053 4.184 4.340 -0.172 0.000 0.205 290 L C -1.063 175.647 176.870 -0.267 0.000 1.086 290 L CA 1.260 55.959 54.840 -0.235 0.000 0.778 290 L CB 1.925 43.815 42.059 -0.281 0.000 0.928 290 L HN -0.495 7.481 8.230 -0.254 0.101 0.446 291 V N -1.571 118.107 119.914 -0.394 0.000 2.407 291 V HA 0.308 4.267 4.120 -0.268 0.000 0.291 291 V C -2.534 173.414 176.094 -0.244 0.000 1.018 291 V CA -2.980 59.094 62.300 -0.377 0.000 0.842 291 V CB 1.574 32.995 31.823 -0.670 0.000 0.996 291 V HN -0.343 7.566 8.190 -0.467 0.000 0.426 292 P HA -0.039 4.338 4.420 -0.073 0.000 0.264 292 P C -0.570 176.699 177.300 -0.051 0.000 1.193 292 P CA -0.094 62.959 63.100 -0.079 0.000 0.763 292 P CB 0.447 32.113 31.700 -0.056 0.000 0.810 293 N N 2.525 121.211 118.700 -0.024 0.000 2.407 293 N HA -0.129 4.628 4.740 0.029 0.000 0.250 293 N C -0.771 174.750 175.510 0.018 0.000 1.236 293 N CA 1.048 54.105 53.050 0.012 0.000 0.879 293 N CB 0.340 38.841 38.487 0.022 0.000 1.088 293 N HN 0.172 8.538 8.380 -0.024 0.000 0.450 294 V N 3.591 123.527 119.914 0.038 0.000 2.540 294 V HA 0.106 4.240 4.120 0.023 0.000 0.302 294 V C -0.399 175.719 176.094 0.041 0.000 1.035 294 V CA -1.115 61.205 62.300 0.033 0.000 0.873 294 V CB 2.112 33.956 31.823 0.035 0.000 0.992 294 V HN -0.054 8.170 8.190 0.056 0.000 0.428 295 E N 6.708 126.927 120.200 0.031 0.000 1.985 295 E HA -0.016 4.357 4.350 0.039 0.000 0.268 295 E C -0.937 175.684 176.600 0.035 0.000 1.219 295 E CA 0.057 56.477 56.400 0.034 0.000 0.942 295 E CB -0.326 29.390 29.700 0.026 0.000 1.045 295 E HN 0.309 8.684 8.360 0.025 0.000 0.413 296 R N 3.710 124.237 120.500 0.045 0.000 2.437 296 R HA 0.195 4.555 4.340 0.033 0.000 0.310 296 R C -0.585 175.748 176.300 0.055 0.000 0.955 296 R CA -0.683 55.442 56.100 0.043 0.000 0.851 296 R CB 1.172 31.498 30.300 0.044 0.000 1.161 296 R HN -0.133 8.169 8.270 0.052 0.000 0.446 297 D N 4.131 124.561 120.400 0.051 0.000 2.400 297 D HA -0.139 4.557 4.640 0.094 0.000 0.238 297 D C -0.271 176.091 176.300 0.103 0.000 1.157 297 D CA 0.188 54.236 54.000 0.080 0.000 0.889 297 D CB 0.773 41.612 40.800 0.065 0.000 1.199 297 D HN 0.157 8.550 8.370 0.038 0.000 0.436 298 Y N 1.096 121.402 120.300 0.010 0.000 2.987 298 Y HA -0.393 4.163 4.550 0.010 0.000 0.339 298 Y C -0.650 175.255 175.900 0.009 0.000 1.272 298 Y CA 1.351 59.456 58.100 0.010 0.000 1.562 298 Y CB 0.518 38.985 38.460 0.011 0.000 1.253 298 Y HN -0.032 8.414 8.280 0.277 0.000 0.604 299 R N 8.425 128.592 120.500 -0.555 0.000 2.295 299 R HA 0.297 4.325 4.340 -0.520 0.000 0.324 299 R C -0.813 174.913 176.300 -0.957 0.000 0.968 299 R CA -1.039 54.697 56.100 -0.607 0.000 0.837 299 R CB 2.658 32.792 30.300 -0.276 0.000 1.133 299 R HN -0.062 7.988 8.270 -0.365 0.000 0.450 300 G N 4.703 113.000 108.800 -0.839 0.000 2.557 300 G HA2 0.364 4.003 3.960 -0.534 0.000 0.292 300 G HA3 0.364 4.204 3.960 -0.200 0.000 0.292 300 G C -2.010 172.823 174.900 -0.111 0.000 1.237 300 G CA -2.343 42.486 45.100 -0.452 0.000 0.978 300 G HN 0.272 8.197 8.290 -0.608 0.000 0.498 301 P HA -0.173 4.427 4.420 0.075 -0.136 0.266 301 P C -1.413 175.943 177.300 0.093 0.000 1.195 301 P CA -0.032 63.121 63.100 0.088 0.000 0.768 301 P CB 0.531 32.303 31.700 0.120 0.000 0.838 302 N N 1.624 120.390 118.700 0.111 0.000 2.408 302 N HA -0.019 4.757 4.740 0.061 0.000 0.257 302 N C -0.156 175.447 175.510 0.155 0.000 1.064 302 N CA -0.598 52.506 53.050 0.090 0.000 0.952 302 N CB 0.673 39.165 38.487 0.008 0.000 1.093 302 N HN 0.126 8.595 8.380 0.150 0.000 0.490 303 I N -1.001 119.631 120.570 0.103 0.000 3.936 303 I HA 0.346 4.570 4.170 0.090 0.000 0.330 303 I C -0.011 176.143 176.117 0.063 0.000 1.509 303 I CA -0.433 60.914 61.300 0.079 0.000 1.126 303 I CB -0.395 37.631 38.000 0.043 0.000 1.115 303 I HN 0.317 8.583 8.210 0.093 0.000 0.424 304 S N 0.403 116.137 115.700 0.057 0.000 2.559 304 S HA 0.145 4.636 4.470 0.035 0.000 0.226 304 S C 0.688 175.302 174.600 0.023 0.000 1.000 304 S CA 0.527 58.748 58.200 0.035 0.000 0.948 304 S CB 0.748 63.962 63.200 0.024 0.000 0.870 304 S HN 0.283 8.890 8.310 0.059 -0.261 0.497 305 G N 0.123 108.942 108.800 0.032 0.000 2.316 305 G HA2 -0.210 3.768 3.960 0.030 0.000 0.203 305 G HA3 -0.210 3.753 3.960 0.006 0.000 0.203 305 G C -0.083 174.803 174.900 -0.024 0.000 0.999 305 G CA -0.371 44.737 45.100 0.015 0.000 0.649 305 G HN -0.291 8.085 8.290 0.055 -0.053 0.489 306 G N 0.345 109.113 108.800 -0.053 0.000 2.599 306 G HA2 0.035 3.919 3.960 -0.128 0.000 0.264 306 G HA3 0.035 3.918 3.960 -0.128 0.000 0.264 306 G C -1.118 173.589 174.900 -0.322 0.000 1.200 306 G CA -0.410 44.608 45.100 -0.137 0.000 0.896 306 G HN -0.599 7.883 8.290 -0.031 -0.211 0.536 307 T N -4.091 110.198 114.554 -0.441 0.000 3.043 307 T HA -0.016 3.251 4.350 -1.805 0.000 0.272 307 T C -0.499 173.854 174.700 -0.577 0.000 0.990 307 T CA -1.090 60.491 62.100 -0.864 0.000 0.897 307 T CB 1.047 69.635 68.868 -0.466 0.000 1.111 307 T HN -0.203 7.848 8.240 -0.315 0.000 0.529 308 L N 4.158 125.155 121.223 -0.377 0.000 2.513 308 L HA 0.019 4.113 4.340 -0.410 0.000 0.272 308 L C -1.750 174.993 176.870 -0.212 0.000 1.187 308 L CA -1.867 52.767 54.840 -0.344 0.000 0.895 308 L CB 0.064 41.920 42.059 -0.338 0.000 1.147 308 L HN -0.494 7.536 8.230 -0.334 0.000 0.483 309 P HA 0.056 4.501 4.420 0.042 0.000 0.272 309 P C -0.546 176.711 177.300 -0.072 0.000 1.240 309 P CA -0.884 62.196 63.100 -0.033 0.000 0.791 309 P CB 0.822 32.527 31.700 0.008 0.000 0.978 310 S N -0.462 115.216 115.700 -0.036 0.000 2.576 310 S HA -0.198 4.392 4.470 -0.137 -0.203 0.272 310 S C 2.100 176.660 174.600 -0.067 0.000 1.352 310 S CA 0.258 58.412 58.200 -0.077 0.000 1.021 310 S CB 0.667 63.863 63.200 -0.007 0.000 0.887 310 S HN -0.276 8.487 8.310 -0.000 -0.453 0.542 311 S N 3.248 118.894 115.700 -0.090 0.000 2.370 311 S HA -0.298 4.145 4.470 -0.045 0.000 0.226 311 S C 2.185 176.783 174.600 -0.003 0.000 1.033 311 S CA 3.123 61.302 58.200 -0.036 0.000 1.011 311 S CB -0.279 62.913 63.200 -0.012 0.000 0.852 311 S HN 0.090 8.300 8.310 -0.166 0.000 0.457 312 I N 2.138 122.746 120.570 0.064 0.000 2.202 312 I HA -0.438 3.743 4.170 0.019 0.000 0.242 312 I C 2.133 178.234 176.117 -0.027 0.000 1.091 312 I CA 3.119 64.445 61.300 0.043 0.000 1.368 312 I CB -0.382 37.681 38.000 0.106 0.000 1.058 312 I HN -0.221 8.066 8.210 0.128 0.000 0.410 313 G N -1.574 107.211 108.800 -0.026 0.000 2.418 313 G HA2 -0.331 3.574 3.960 -0.092 0.000 0.217 313 G HA3 -0.331 3.772 3.960 -0.060 -0.179 0.217 313 G C 1.135 175.974 174.900 -0.102 0.000 1.158 313 G CA 2.187 47.245 45.100 -0.071 0.000 0.771 313 G HN 0.059 8.350 8.290 0.003 0.000 0.545 314 G N 1.072 109.829 108.800 -0.072 0.000 2.421 314 G HA2 -0.366 3.624 3.960 -0.046 0.000 0.216 314 G HA3 -0.366 3.750 3.960 -0.022 -0.170 0.216 314 G C 0.514 175.323 174.900 -0.152 0.000 1.171 314 G CA 1.530 46.590 45.100 -0.066 0.000 0.775 314 G HN -0.131 8.127 8.290 -0.052 0.000 0.543 315 E N 2.940 123.035 120.200 -0.176 0.000 2.106 315 E HA -0.281 3.942 4.350 -0.361 -0.090 0.192 315 E C 2.341 178.816 176.600 -0.209 0.000 0.984 315 E CA 2.339 58.584 56.400 -0.259 0.000 0.806 315 E CB -0.112 29.446 29.700 -0.235 0.000 0.750 315 E HN -0.543 7.734 8.360 -0.138 0.000 0.458 316 G N -1.173 107.527 108.800 -0.168 0.000 2.408 316 G HA2 -0.246 3.636 3.960 -0.129 0.000 0.217 316 G HA3 -0.246 3.631 3.960 -0.138 0.000 0.217 316 G C 1.713 176.484 174.900 -0.215 0.000 1.150 316 G CA 2.028 47.035 45.100 -0.155 0.000 0.776 316 G HN -0.080 8.030 8.290 -0.148 0.091 0.542 317 M N 1.943 121.346 119.600 -0.328 0.000 2.200 317 M HA -0.125 4.051 4.480 -0.506 0.000 0.265 317 M C 2.255 178.214 176.300 -0.568 0.000 1.066 317 M CA 1.035 55.963 55.300 -0.620 0.000 1.127 317 M CB -0.962 30.977 32.600 -1.102 0.000 1.379 317 M HN -0.262 7.846 8.290 -0.304 0.000 0.420 318 L N 0.854 121.881 121.223 -0.327 0.000 2.046 318 L HA -0.347 4.053 4.340 0.101 0.000 0.208 318 L C 1.037 177.909 176.870 0.004 0.000 1.077 318 L CA 3.557 58.363 54.840 -0.056 0.000 0.747 318 L CB -0.625 41.375 42.059 -0.098 0.000 0.896 318 L HN -0.101 7.948 8.230 -0.303 0.000 0.432 319 K N -1.742 118.615 120.400 -0.072 0.000 2.057 319 K HA -0.458 3.866 4.320 0.006 0.000 0.207 319 K C 2.093 178.700 176.600 0.012 0.000 1.049 319 K CA 3.354 59.627 56.287 -0.023 0.000 0.931 319 K CB -0.256 32.214 32.500 -0.050 0.000 0.714 319 K HN -0.337 7.836 8.250 -0.128 0.000 0.440 320 Q N -1.977 117.811 119.800 -0.021 0.000 2.167 320 Q HA -0.250 4.103 4.340 0.021 0.000 0.202 320 Q C 2.022 178.091 176.000 0.114 0.000 0.970 320 Q CA 2.256 58.069 55.803 0.016 0.000 0.855 320 Q CB -0.638 28.079 28.738 -0.035 0.000 0.911 320 Q HN -0.420 7.804 8.270 -0.077 0.000 0.438 321 H N 1.475 120.559 119.070 0.024 0.000 2.319 321 H HA -0.297 4.381 4.556 0.205 0.000 0.299 321 H C 2.068 177.524 175.328 0.213 0.000 1.092 321 H CA 3.893 60.039 56.048 0.163 0.000 1.302 321 H CB 0.183 30.081 29.762 0.226 0.000 1.373 321 H HN -0.322 8.037 8.280 0.151 0.012 0.497 322 I N -5.719 114.916 120.570 0.108 0.000 2.585 322 I HA -0.071 4.062 4.170 -0.062 0.000 0.254 322 I C 1.765 177.895 176.117 0.021 0.000 1.129 322 I CA 2.816 64.132 61.300 0.026 0.000 1.455 322 I CB 0.028 38.085 38.000 0.096 0.000 1.111 322 I HN -0.517 7.793 8.210 0.167 0.000 0.433 323 E N -0.925 119.300 120.200 0.041 0.000 2.385 323 E HA 0.030 4.392 4.350 0.020 0.000 0.194 323 E C 0.533 177.145 176.600 0.020 0.000 1.013 323 E CA 1.392 57.808 56.400 0.026 0.000 0.866 323 E CB 0.892 30.608 29.700 0.027 0.000 0.832 323 E HN -0.291 8.102 8.360 0.055 0.000 0.500 324 G N -1.579 107.246 108.800 0.043 0.000 2.621 324 G HA2 0.117 4.090 3.960 0.023 0.000 0.209 324 G HA3 0.117 4.151 3.960 0.069 -0.032 0.209 324 G C -0.086 174.850 174.900 0.060 0.000 1.379 324 G CA 0.369 45.499 45.100 0.050 0.000 0.766 324 G HN -0.331 7.997 8.290 0.063 0.000 0.599 325 F N 4.553 124.484 119.950 -0.032 0.000 2.065 325 F HA -0.337 4.182 4.527 -0.013 0.000 0.298 325 F C 1.585 177.319 175.800 -0.111 0.000 1.112 325 F CA 3.693 61.669 58.000 -0.039 0.000 1.212 325 F CB 0.533 39.555 39.000 0.036 0.000 0.975 325 F HN -0.478 7.990 8.300 0.279 0.000 0.476 326 L N -6.157 114.985 121.223 -0.134 0.000 2.418 326 L HA -0.236 3.875 4.340 -0.380 0.000 0.218 326 L C 1.350 178.104 176.870 -0.194 0.000 1.125 326 L CA 1.515 56.206 54.840 -0.250 0.000 0.835 326 L CB -0.420 41.519 42.059 -0.200 0.000 0.953 326 L HN -0.051 8.154 8.230 -0.041 0.000 0.454 327 K N -0.626 119.698 120.400 -0.127 0.000 2.308 327 K HA -0.126 4.141 4.320 -0.088 0.000 0.197 327 K C 1.787 178.328 176.600 -0.098 0.000 1.049 327 K CA 1.967 58.201 56.287 -0.089 0.000 0.991 327 K CB 0.170 32.644 32.500 -0.044 0.000 0.836 327 K HN -0.633 7.520 8.250 -0.101 0.037 0.500 328 E N -1.867 118.263 120.200 -0.116 0.000 2.107 328 E HA -0.157 4.146 4.350 -0.079 0.000 0.191 328 E C 0.377 176.892 176.600 -0.141 0.000 0.982 328 E CA 2.058 58.393 56.400 -0.108 0.000 0.809 328 E CB 0.695 30.339 29.700 -0.093 0.000 0.756 328 E HN -0.423 7.862 8.360 -0.125 0.000 0.459 329 N N -1.904 116.666 118.700 -0.217 0.000 2.750 329 N HA 0.352 4.993 4.740 -0.166 0.000 0.253 329 N C -2.546 172.815 175.510 -0.247 0.000 1.408 329 N CA -1.964 50.950 53.050 -0.226 0.000 0.780 329 N CB 1.147 39.467 38.487 -0.279 0.000 1.191 329 N HN -0.667 7.551 8.380 -0.269 0.000 0.511 330 P HA 0.007 4.532 4.420 -0.177 -0.211 0.267 330 P C -0.594 176.602 177.300 -0.174 0.000 1.201 330 P CA -0.422 62.581 63.100 -0.162 0.000 0.775 330 P CB 0.673 32.312 31.700 -0.103 0.000 0.854 331 V N -1.842 117.960 119.914 -0.187 0.000 3.211 331 V HA 0.344 4.373 4.120 -0.152 0.000 0.319 331 V C -0.861 175.187 176.094 -0.077 0.000 1.096 331 V CA -2.390 59.809 62.300 -0.169 0.000 1.029 331 V CB 1.548 33.182 31.823 -0.314 0.000 1.137 331 V HN -0.056 8.021 8.190 -0.189 0.000 0.453 332 A N -0.046 122.755 122.820 -0.031 0.000 2.462 332 A HA 0.089 4.399 4.320 -0.017 0.000 0.243 332 A C 1.304 178.894 177.584 0.010 0.000 1.076 332 A CA -0.137 51.897 52.037 -0.006 0.000 0.773 332 A CB 0.728 19.733 19.000 0.009 0.000 1.010 332 A HN 0.332 8.471 8.150 -0.019 0.000 0.493 333 D N 2.766 123.168 120.400 0.003 0.000 2.133 333 D HA -0.309 4.336 4.640 0.009 0.000 0.195 333 D C 1.851 178.157 176.300 0.011 0.000 0.997 333 D CA 3.258 57.261 54.000 0.007 0.000 0.840 333 D CB -0.078 40.721 40.800 -0.001 0.000 0.947 333 D HN 0.536 8.903 8.370 -0.004 0.000 0.452 334 K N -3.892 116.513 120.400 0.009 0.000 2.362 334 K HA -0.187 4.123 4.320 -0.016 0.000 0.200 334 K C 0.200 176.818 176.600 0.029 0.000 1.046 334 K CA 1.734 58.022 56.287 0.003 0.000 0.952 334 K CB -0.041 32.459 32.500 0.000 0.000 0.753 334 K HN -0.178 8.067 8.250 0.009 0.011 0.466 335 D N -3.398 117.046 120.400 0.074 0.000 2.379 335 D HA 0.198 4.912 4.640 0.124 0.000 0.208 335 D C 0.478 176.938 176.300 0.266 0.000 1.065 335 D CA 0.259 54.352 54.000 0.154 0.000 0.848 335 D CB 1.396 42.316 40.800 0.200 0.000 0.949 335 D HN -0.403 7.843 8.370 0.067 0.164 0.509 336 L N 1.234 122.561 121.223 0.173 0.000 2.046 336 L HA -0.167 4.311 4.340 0.229 0.000 0.208 336 L C 1.331 178.339 176.870 0.230 0.000 1.077 336 L CA 2.788 57.740 54.840 0.187 0.000 0.747 336 L CB -0.255 41.856 42.059 0.086 0.000 0.896 336 L HN -0.869 7.312 8.230 0.104 0.112 0.432 337 G N -3.020 105.868 108.800 0.147 0.000 2.422 337 G HA2 -0.416 3.675 3.960 0.219 0.000 0.218 337 G HA3 -0.416 3.535 3.960 -0.014 0.000 0.218 337 G C 0.984 176.171 174.900 0.478 0.000 1.146 337 G CA 2.270 47.489 45.100 0.198 0.000 0.769 337 G HN 0.502 8.830 8.290 0.063 0.000 0.547 338 K N 2.172 122.819 120.400 0.411 0.000 2.057 338 K HA -0.356 4.180 4.320 0.360 0.000 0.207 338 K C 2.550 179.303 176.600 0.254 0.000 1.049 338 K CA 3.470 59.942 56.287 0.309 0.000 0.931 338 K CB -0.228 32.335 32.500 0.106 0.000 0.714 338 K HN -0.651 7.788 8.250 0.316 0.000 0.440 339 H N -0.583 118.651 119.070 0.274 0.000 2.389 339 H HA -0.218 4.516 4.556 0.296 0.000 0.299 339 H C 2.502 178.063 175.328 0.388 0.000 1.081 339 H CA 4.276 60.509 56.048 0.309 0.000 1.345 339 H CB 0.055 29.972 29.762 0.259 0.000 1.393 339 H HN -0.708 7.795 8.280 0.371 0.000 0.520 340 L N -0.912 120.588 121.223 0.462 0.000 2.072 340 L HA -0.306 4.283 4.340 0.416 0.000 0.205 340 L C 1.605 178.703 176.870 0.379 0.000 1.079 340 L CA 2.683 57.764 54.840 0.402 0.000 0.752 340 L CB -0.131 42.126 42.059 0.331 0.000 0.906 340 L HN -0.433 8.058 8.230 0.434 0.000 0.436 341 F N 0.294 120.410 119.950 0.276 0.000 2.095 341 F HA -0.488 4.176 4.527 0.229 0.000 0.298 341 F C 0.840 176.738 175.800 0.163 0.000 1.104 341 F CA 3.787 61.926 58.000 0.231 0.000 1.232 341 F CB 0.183 39.330 39.000 0.245 0.000 0.987 341 F HN -0.120 8.542 8.300 0.603 0.000 0.475 342 A N -2.134 120.882 122.820 0.328 0.000 1.933 342 A HA -0.396 4.021 4.320 0.161 0.000 0.218 342 A C 2.081 179.617 177.584 -0.080 0.000 1.175 342 A CA 2.921 55.043 52.037 0.140 0.000 0.628 342 A CB -0.850 18.225 19.000 0.125 0.000 0.814 342 A HN -0.055 8.354 8.150 0.431 0.000 0.444 343 G N -1.261 107.530 108.800 -0.014 0.000 2.414 343 G HA2 -0.314 3.389 3.960 -0.428 0.000 0.215 343 G HA3 -0.314 3.699 3.960 0.089 0.000 0.215 343 G C 1.402 176.305 174.900 0.006 0.000 1.188 343 G CA 1.831 46.870 45.100 -0.101 0.000 0.783 343 G HN -0.576 7.804 8.290 0.150 0.000 0.537 344 V N 2.991 122.934 119.914 0.047 0.000 2.295 344 V HA -0.550 3.616 4.120 0.078 0.000 0.246 344 V C 1.927 177.958 176.094 -0.106 0.000 1.049 344 V CA 4.433 66.756 62.300 0.039 0.000 1.024 344 V CB 0.082 31.968 31.823 0.104 0.000 0.648 344 V HN -0.568 7.672 8.190 0.083 0.000 0.447 345 I N -1.877 118.532 120.570 -0.268 0.000 2.333 345 I HA -0.356 3.560 4.170 -0.423 0.000 0.246 345 I C 2.447 178.296 176.117 -0.446 0.000 1.106 345 I CA 3.205 64.245 61.300 -0.433 0.000 1.411 345 I CB -0.301 37.321 38.000 -0.630 0.000 1.082 345 I HN -0.618 7.410 8.210 -0.304 0.000 0.420 346 G N 0.150 108.771 108.800 -0.299 0.000 2.443 346 G HA2 -0.219 3.678 3.960 -0.214 0.000 0.219 346 G HA3 -0.219 3.653 3.960 -0.276 -0.078 0.219 346 G C 0.660 175.429 174.900 -0.219 0.000 1.131 346 G CA 1.589 46.530 45.100 -0.265 0.000 0.775 346 G HN -0.032 7.998 8.290 -0.259 0.104 0.547 347 Y N -3.115 117.118 120.300 -0.112 0.000 2.462 347 Y HA -0.030 4.518 4.550 -0.005 0.000 0.261 347 Y C -1.081 174.839 175.900 0.034 0.000 1.146 347 Y CA -0.121 57.952 58.100 -0.046 0.000 1.283 347 Y CB 0.512 38.911 38.460 -0.102 0.000 1.090 347 Y HN -0.733 7.479 8.280 -0.114 0.000 0.526 348 H N -2.112 116.965 119.070 0.011 0.000 2.750 348 H HA -0.364 4.167 4.556 -0.041 0.000 0.327 348 H C 0.939 176.223 175.328 -0.074 0.000 1.199 348 H CA 0.872 56.900 56.048 -0.034 0.000 1.149 348 H CB -2.390 27.348 29.762 -0.040 0.000 1.543 348 H HN -0.691 7.324 8.280 -0.173 0.161 0.427 349 G N -1.969 106.789 108.800 -0.070 0.000 2.432 349 G HA2 -0.263 3.689 3.960 -0.299 0.000 0.219 349 G HA3 -0.263 3.405 3.960 -0.486 0.000 0.219 349 G C -0.952 173.558 174.900 -0.650 0.000 1.135 349 G CA 1.055 45.933 45.100 -0.370 0.000 0.767 349 G HN -0.104 8.154 8.290 -0.053 0.000 0.550 350 F N -3.225 116.671 119.950 -0.090 0.000 2.598 350 F HA 0.243 4.664 4.527 -0.176 0.000 0.327 350 F C -0.958 174.814 175.800 -0.047 0.000 1.057 350 F CA -1.396 56.505 58.000 -0.165 0.000 0.957 350 F CB 3.065 41.806 39.000 -0.432 0.000 1.278 350 F HN -0.631 7.976 8.300 0.058 -0.272 0.484 351 T N -4.861 109.793 114.554 0.167 0.000 3.067 351 T HA -0.111 4.296 4.350 0.095 0.000 0.261 351 T C -0.810 173.969 174.700 0.133 0.000 1.110 351 T CA 0.677 62.848 62.100 0.119 0.000 1.113 351 T CB -0.086 68.834 68.868 0.087 0.000 0.917 351 T HN -0.005 8.339 8.240 0.174 0.000 0.499 352 D N -0.621 119.894 120.400 0.193 0.000 2.753 352 D HA -0.004 4.698 4.640 0.104 0.000 0.224 352 D C -0.788 175.630 176.300 0.196 0.000 1.213 352 D CA -0.353 53.737 54.000 0.151 0.000 0.833 352 D CB 2.686 43.554 40.800 0.113 0.000 1.607 352 D HN -0.866 7.626 8.370 0.257 0.032 0.463 353 G N 1.889 110.738 108.800 0.081 0.000 2.160 353 G HA2 -0.375 3.572 3.960 -0.022 0.000 0.251 353 G HA3 -0.375 3.580 3.960 -0.009 0.000 0.251 353 G C 0.576 175.500 174.900 0.040 0.000 1.008 353 G CA 0.536 45.650 45.100 0.024 0.000 0.724 353 G HN 0.425 8.744 8.290 0.047 0.000 0.514 354 N N -0.035 118.700 118.700 0.058 0.000 2.149 354 N HA -0.348 4.465 4.740 0.121 0.000 0.188 354 N C 1.750 177.210 175.510 -0.083 0.000 1.019 354 N CA 2.852 55.917 53.050 0.025 0.000 0.857 354 N CB -0.464 37.988 38.487 -0.058 0.000 0.997 354 N HN 0.318 8.736 8.380 0.064 0.000 0.426 355 G N 0.320 109.052 108.800 -0.113 0.000 2.433 355 G HA2 -0.232 3.610 3.960 -0.196 0.000 0.216 355 G HA3 -0.232 3.654 3.960 -0.123 0.000 0.216 355 G C 1.406 176.250 174.900 -0.094 0.000 1.186 355 G CA 1.956 46.974 45.100 -0.136 0.000 0.779 355 G HN 0.380 8.604 8.290 -0.095 0.008 0.543 356 R N 0.710 121.155 120.500 -0.092 0.000 2.096 356 R HA -0.338 3.929 4.340 -0.121 0.000 0.235 356 R C 2.510 178.775 176.300 -0.059 0.000 1.127 356 R CA 2.755 58.796 56.100 -0.098 0.000 0.968 356 R CB -0.274 29.958 30.300 -0.114 0.000 0.861 356 R HN 0.003 8.219 8.270 -0.090 0.000 0.440 357 M N 0.348 119.918 119.600 -0.050 0.000 2.086 357 M HA -0.289 4.158 4.480 -0.055 0.000 0.261 357 M C 1.860 178.197 176.300 0.062 0.000 1.067 357 M CA 2.373 57.661 55.300 -0.020 0.000 1.116 357 M CB -0.604 31.989 32.600 -0.011 0.000 1.348 357 M HN -0.128 8.131 8.290 -0.052 0.000 0.407 358 G N -1.712 107.108 108.800 0.034 0.000 2.446 358 G HA2 -0.406 3.622 3.960 0.112 0.000 0.217 358 G HA3 -0.406 3.438 3.960 -0.194 0.000 0.217 358 G C 1.130 176.280 174.900 0.416 0.000 1.168 358 G CA 2.058 47.198 45.100 0.067 0.000 0.771 358 G HN 0.179 8.453 8.290 -0.027 0.000 0.551 359 R N 1.524 122.238 120.500 0.356 0.000 2.092 359 R HA -0.311 4.479 4.340 0.750 0.000 0.231 359 R C 2.130 178.685 176.300 0.425 0.000 1.119 359 R CA 3.094 59.450 56.100 0.427 0.000 0.970 359 R CB -0.140 30.075 30.300 -0.141 0.000 0.864 359 R HN -0.377 8.002 8.270 0.182 0.000 0.440 360 M N 1.306 121.029 119.600 0.205 0.000 2.086 360 M HA -0.288 4.279 4.480 0.145 0.000 0.261 360 M C 1.497 177.913 176.300 0.193 0.000 1.067 360 M CA 2.838 58.222 55.300 0.140 0.000 1.116 360 M CB -0.501 32.099 32.600 0.000 0.000 1.348 360 M HN -0.119 8.246 8.290 0.125 0.000 0.407 361 L N -2.350 119.006 121.223 0.221 0.000 2.056 361 L HA -0.472 3.963 4.340 0.158 0.000 0.207 361 L C 1.962 179.012 176.870 0.300 0.000 1.078 361 L CA 2.954 57.931 54.840 0.227 0.000 0.749 361 L CB -0.823 41.380 42.059 0.239 0.000 0.901 361 L HN -0.187 8.175 8.230 0.219 0.000 0.433 362 Y N 0.025 120.521 120.300 0.326 0.000 2.128 362 Y HA -0.551 4.159 4.550 0.267 0.000 0.284 362 Y C 0.771 176.837 175.900 0.277 0.000 1.154 362 Y CA 3.695 61.985 58.100 0.317 0.000 1.149 362 Y CB -0.100 38.596 38.460 0.394 0.000 0.976 362 Y HN -0.179 8.474 8.280 0.621 0.000 0.505 363 A N -1.027 122.026 122.820 0.388 0.000 1.898 363 A HA -0.354 4.107 4.320 0.236 0.000 0.216 363 A C 1.886 179.514 177.584 0.074 0.000 1.181 363 A CA 3.048 55.227 52.037 0.237 0.000 0.620 363 A CB -0.884 18.282 19.000 0.278 0.000 0.819 363 A HN -0.071 8.415 8.150 0.558 0.000 0.442 364 I N -1.201 119.429 120.570 0.100 0.000 2.226 364 I HA -0.593 3.624 4.170 0.079 0.000 0.245 364 I C 1.691 177.839 176.117 0.052 0.000 1.100 364 I CA 4.270 65.621 61.300 0.085 0.000 1.374 364 I CB -0.089 37.984 38.000 0.121 0.000 1.057 364 I HN -0.221 8.073 8.210 0.139 0.000 0.413 365 A N -1.135 121.704 122.820 0.031 0.000 1.902 365 A HA -0.352 3.985 4.320 0.029 0.000 0.217 365 A C 2.208 179.756 177.584 -0.060 0.000 1.181 365 A CA 3.369 55.406 52.037 -0.001 0.000 0.623 365 A CB -0.989 18.017 19.000 0.009 0.000 0.818 365 A HN -0.232 7.948 8.150 0.049 0.000 0.443 366 E N -1.069 119.041 120.200 -0.150 0.000 2.031 366 E HA -0.319 3.939 4.350 -0.153 0.000 0.193 366 E C 2.910 179.500 176.600 -0.017 0.000 0.994 366 E CA 2.944 59.264 56.400 -0.133 0.000 0.800 366 E CB -0.187 29.412 29.700 -0.168 0.000 0.752 366 E HN -0.552 7.682 8.360 -0.211 0.000 0.447 367 L N -2.081 119.151 121.223 0.015 0.000 2.131 367 L HA -0.262 4.217 4.340 0.039 -0.116 0.210 367 L C 3.183 180.066 176.870 0.021 0.000 1.092 367 L CA 2.817 57.673 54.840 0.026 0.000 0.759 367 L CB -0.463 41.606 42.059 0.017 0.000 0.903 367 L HN 0.159 8.396 8.230 0.012 0.000 0.435 368 R N -3.261 117.250 120.500 0.019 0.000 2.189 368 R HA -0.194 4.158 4.340 0.021 0.000 0.218 368 R C 0.856 177.161 176.300 0.010 0.000 1.074 368 R CA 2.337 58.449 56.100 0.019 0.000 0.991 368 R CB 0.021 30.338 30.300 0.028 0.000 0.883 368 R HN -0.228 8.042 8.270 0.019 0.011 0.457 369 N N -1.434 117.266 118.700 0.001 0.000 2.295 369 N HA 0.019 4.758 4.740 -0.001 0.000 0.221 369 N C -0.602 174.909 175.510 0.001 0.000 1.129 369 N CA -0.260 52.788 53.050 -0.003 0.000 0.836 369 N CB 0.503 38.980 38.487 -0.016 0.000 1.040 369 N HN -0.609 7.615 8.380 -0.004 0.154 0.494 370 D N -0.560 119.846 120.400 0.011 0.000 2.723 370 D HA -0.375 4.278 4.640 0.023 0.000 0.236 370 D C -1.643 174.672 176.300 0.025 0.000 1.138 370 D CA 1.540 55.551 54.000 0.018 0.000 0.676 370 D CB -1.205 39.603 40.800 0.013 0.000 1.069 370 D HN -0.386 7.813 8.370 0.012 0.179 0.430 371 S N -4.156 111.566 115.700 0.036 0.000 2.656 371 S HA 0.164 4.667 4.470 0.055 0.000 0.273 371 S C -2.043 172.641 174.600 0.141 0.000 1.168 371 S CA -1.203 57.028 58.200 0.051 0.000 0.817 371 S CB 2.600 65.799 63.200 -0.001 0.000 1.146 371 S HN -0.377 7.955 8.310 0.036 0.000 0.475 372 F N -0.324 119.589 119.950 -0.061 0.000 2.881 372 F HA 0.108 4.668 4.527 -0.144 -0.120 0.348 372 F C -2.678 173.068 175.800 -0.091 0.000 1.240 372 F CA 0.073 58.018 58.000 -0.093 0.000 1.130 372 F CB 2.371 41.339 39.000 -0.052 0.000 1.417 372 F HN 0.146 8.509 8.300 0.104 0.000 0.585 373 N N 8.737 126.937 118.700 -0.834 0.000 2.518 373 N HA 0.508 4.867 4.740 -0.636 0.000 0.254 373 N C -2.583 172.275 175.510 -1.088 0.000 0.979 373 N CA -2.693 49.914 53.050 -0.738 0.000 0.930 373 N CB 1.713 40.003 38.487 -0.329 0.000 1.152 373 N HN -0.310 7.883 8.380 -0.670 -0.215 0.505 374 P HA 0.017 3.142 4.420 -2.158 0.000 0.271 374 P C -0.847 175.907 177.300 -0.910 0.000 1.220 374 P CA -0.268 61.918 63.100 -1.524 0.000 0.768 374 P CB 0.793 31.734 31.700 -1.265 0.000 0.848 375 L N 3.133 123.784 121.223 -0.953 0.000 2.410 375 L HA -0.001 4.060 4.340 -0.466 0.000 0.273 375 L C 0.502 177.252 176.870 -0.200 0.000 1.152 375 L CA -0.154 54.377 54.840 -0.516 0.000 0.855 375 L CB 0.193 41.880 42.059 -0.619 0.000 1.129 375 L HN 0.183 7.596 8.230 -1.360 0.000 0.463 376 A N 4.009 126.735 122.820 -0.155 0.000 2.366 376 A HA -0.010 4.307 4.320 -0.005 0.000 0.249 376 A C 0.331 177.891 177.584 -0.041 0.000 1.084 376 A CA -0.007 51.996 52.037 -0.056 0.000 0.794 376 A CB 1.210 20.173 19.000 -0.062 0.000 1.034 376 A HN 0.291 8.330 8.150 -0.185 0.000 0.491 377 M N 1.297 120.901 119.600 0.007 0.000 2.108 377 M HA -0.436 4.068 4.480 0.041 0.000 0.261 377 M C 1.576 177.858 176.300 -0.030 0.000 1.066 377 M CA 5.013 60.322 55.300 0.016 0.000 1.107 377 M CB -0.110 32.510 32.600 0.033 0.000 1.356 377 M HN 0.297 8.601 8.290 0.025 0.000 0.406 378 N N -1.563 117.105 118.700 -0.053 0.000 2.205 378 N HA -0.306 4.387 4.740 -0.079 0.000 0.186 378 N C 1.570 177.000 175.510 -0.134 0.000 1.015 378 N CA 3.199 56.197 53.050 -0.088 0.000 0.862 378 N CB -0.933 37.500 38.487 -0.090 0.000 0.986 378 N HN 0.205 8.558 8.380 -0.044 0.000 0.429 379 A N 0.429 123.165 122.820 -0.141 0.000 1.873 379 A HA -0.188 4.138 4.320 -0.179 -0.114 0.215 379 A C 1.981 179.460 177.584 -0.175 0.000 1.186 379 A CA 2.792 54.728 52.037 -0.169 0.000 0.616 379 A CB -0.481 18.407 19.000 -0.187 0.000 0.823 379 A HN -0.672 7.300 8.150 -0.125 0.103 0.442 380 E N -1.443 118.652 120.200 -0.174 0.000 2.058 380 E HA -0.489 3.744 4.350 -0.195 0.000 0.194 380 E C 2.531 178.965 176.600 -0.277 0.000 0.997 380 E CA 3.580 59.922 56.400 -0.096 0.000 0.801 380 E CB -0.204 29.582 29.700 0.144 0.000 0.746 380 E HN -0.422 7.781 8.360 -0.146 0.070 0.450 381 N N -1.066 117.460 118.700 -0.290 0.000 2.166 381 N HA -0.223 3.995 4.740 -0.869 0.000 0.186 381 N C 2.529 177.836 175.510 -0.338 0.000 1.019 381 N CA 2.884 55.669 53.050 -0.442 0.000 0.856 381 N CB -0.327 38.076 38.487 -0.140 0.000 0.993 381 N HN -0.136 8.152 8.380 -0.155 0.000 0.426 382 S N 0.502 116.095 115.700 -0.178 0.000 2.402 382 S HA -0.207 4.247 4.470 -0.026 0.000 0.229 382 S C 1.426 176.139 174.600 0.189 0.000 1.021 382 S CA 2.661 60.833 58.200 -0.047 0.000 0.974 382 S CB 0.160 63.210 63.200 -0.250 0.000 0.800 382 S HN -0.499 7.704 8.310 -0.179 0.000 0.484 383 L N -0.377 120.912 121.223 0.111 0.000 2.007 383 L HA -0.272 4.216 4.340 0.247 0.000 0.205 383 L C 1.354 178.401 176.870 0.295 0.000 1.073 383 L CA 2.802 57.778 54.840 0.226 0.000 0.744 383 L CB 0.315 42.515 42.059 0.235 0.000 0.898 383 L HN -0.551 7.661 8.230 -0.005 0.014 0.435 384 H N -6.124 113.109 119.070 0.271 0.000 2.502 384 H HA -0.051 4.533 4.556 0.045 0.000 0.283 384 H C 1.547 176.842 175.328 -0.055 0.000 1.015 384 H CA -0.445 55.642 56.048 0.064 0.000 1.298 384 H CB 0.456 30.159 29.762 -0.099 0.000 1.411 384 H HN -0.529 7.608 8.280 -0.239 0.000 0.556 385 G N -0.602 108.155 108.800 -0.070 0.000 2.162 385 G HA2 -0.448 3.186 3.960 -0.545 0.000 0.260 385 G HA3 -0.448 2.908 3.960 -1.007 0.000 0.260 385 G C -0.348 174.478 174.900 -0.122 0.000 0.976 385 G CA 1.168 45.983 45.100 -0.474 0.000 0.655 385 G HN -0.423 7.760 8.290 -0.179 0.000 0.533 386 I N 0.000 120.721 120.570 0.252 0.000 2.984 386 I HA 0.000 4.185 4.170 0.025 0.000 0.288 386 I CA 0.000 61.368 61.300 0.113 0.000 1.566 386 I CB 0.000 37.964 38.000 -0.060 0.000 1.214 386 I HN 0.000 8.623 8.210 0.793 0.062 0.494