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 1vkg_1_A DATA FIRST_RESID 15 DATA SEQUENCE VPVYIYSPEY VSMCDSLAKI PKRASMVHSL IEAYALHKQM RIVKPKVASM DATA SEQUENCE EEMATFHTDA YLQHLQKVSQ EGDDXXXXXX XXXXXXXXXA TEGIFDYAAA DATA SEQUENCE IGGATITAAQ CLIDGMCKVA INWSGGWHHA KKDEASGFCY LNDAVLGILR DATA SEQUENCE LRRKFERILY VDLDLHHGDG VEDAFSFTSK VMTVSLHKFS PGFFPGTGDV DATA SEQUENCE SDVGLGKGRY YSVNVPIQDG IQDEKYYQIc ESVLKEVYQA FNPKAVVLQL DATA SEQUENCE GADTIAGDPM CSFNMTPVGI GKcLKYILQW QLATLILGGG GYNLANTARC DATA SEQUENCE WTYLTGVILG KTLSSEIPDH EFFTAYGPDY VLEITPSCRP DRNEPHRIQQ DATA SEQUENCE ILNYIKGNLK HVV 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 15 V HA 0.000 4.126 4.120 0.009 0.000 0.244 15 V C 0.000 176.108 176.094 0.023 0.000 1.182 15 V CA 0.000 62.310 62.300 0.016 0.000 1.235 15 V CB 0.000 31.834 31.823 0.018 0.000 1.184 16 P HA 0.057 4.686 4.420 0.016 -0.199 0.270 16 P C -1.337 175.999 177.300 0.060 0.000 1.221 16 P CA -0.029 63.089 63.100 0.029 0.000 0.788 16 P CB 0.609 32.324 31.700 0.024 0.000 0.904 17 V N -0.662 119.291 119.914 0.065 0.000 2.628 17 V HA 0.672 5.091 4.120 0.117 -0.228 0.306 17 V C -1.379 174.812 176.094 0.161 0.000 1.045 17 V CA -1.025 61.333 62.300 0.097 0.000 0.905 17 V CB 3.576 35.428 31.823 0.049 0.000 0.997 17 V HN -0.282 7.930 8.190 0.037 0.000 0.436 18 Y N 8.148 128.482 120.300 0.055 0.000 2.338 18 Y HA 0.320 4.895 4.550 0.041 0.000 0.328 18 Y C -1.980 173.992 175.900 0.121 0.000 0.965 18 Y CA -2.549 55.607 58.100 0.095 0.000 1.208 18 Y CB 2.408 40.970 38.460 0.170 0.000 1.132 18 Y HN 1.041 9.474 8.280 0.255 0.000 0.469 19 I N 10.016 130.519 120.570 -0.112 0.000 2.329 19 I HA 0.293 4.637 4.170 -0.074 -0.218 0.295 19 I C -1.374 174.650 176.117 -0.155 0.000 1.109 19 I CA -1.652 59.583 61.300 -0.108 0.000 1.297 19 I CB -2.252 35.702 38.000 -0.076 0.000 1.433 19 I HN 0.194 8.354 8.210 -0.084 0.000 0.509 20 Y N 8.380 128.508 120.300 -0.288 0.000 2.544 20 Y HA 0.245 4.728 4.550 -0.113 0.000 0.342 20 Y C -2.694 173.152 175.900 -0.091 0.000 1.062 20 Y CA -0.970 56.962 58.100 -0.281 0.000 1.023 20 Y CB 4.392 42.442 38.460 -0.683 0.000 1.308 20 Y HN 0.587 8.815 8.280 -0.087 0.000 0.457 21 S N 2.856 117.855 115.700 -1.169 0.000 2.548 21 S HA 0.326 4.138 4.470 -1.097 0.000 0.278 21 S C -1.888 172.237 174.600 -0.791 0.000 1.150 21 S CA -3.411 54.213 58.200 -0.960 0.000 0.907 21 S CB 2.062 65.055 63.200 -0.346 0.000 1.108 21 S HN -0.185 7.667 8.310 -0.763 0.000 0.459 22 P HA -0.278 4.297 4.420 0.258 0.000 0.217 22 P C 1.144 178.475 177.300 0.052 0.000 1.162 22 P CA 2.445 65.548 63.100 0.005 0.000 0.901 22 P CB 0.072 31.811 31.700 0.065 0.000 0.793 23 E N -3.770 116.430 120.200 0.001 0.000 2.160 23 E HA -0.251 4.135 4.350 0.061 0.000 0.195 23 E C 2.157 178.821 176.600 0.106 0.000 0.991 23 E CA 3.230 59.657 56.400 0.045 0.000 0.810 23 E CB -0.990 28.718 29.700 0.013 0.000 0.742 23 E HN 0.638 8.960 8.360 -0.057 0.004 0.466 24 Y N 0.774 121.034 120.300 -0.066 0.000 2.184 24 Y HA -0.293 4.225 4.550 -0.053 0.000 0.290 24 Y C 1.252 177.165 175.900 0.022 0.000 1.129 24 Y CA 1.855 59.927 58.100 -0.046 0.000 1.144 24 Y CB -0.162 38.246 38.460 -0.087 0.000 0.995 24 Y HN -0.384 7.802 8.280 0.080 0.143 0.513 25 V N 0.578 120.518 119.914 0.044 0.000 2.231 25 V HA -0.634 3.373 4.120 -0.188 0.000 0.248 25 V C 2.552 178.671 176.094 0.041 0.000 1.054 25 V CA 4.776 67.074 62.300 -0.004 0.000 1.015 25 V CB -0.249 31.691 31.823 0.194 0.000 0.638 25 V HN -0.230 8.051 8.190 0.153 0.000 0.444 26 S N -0.448 115.314 115.700 0.104 0.000 2.402 26 S HA -0.375 4.333 4.470 0.118 -0.167 0.233 26 S C 2.004 176.661 174.600 0.094 0.000 1.030 26 S CA 3.081 61.346 58.200 0.107 0.000 1.003 26 S CB -0.012 63.255 63.200 0.112 0.000 0.813 26 S HN 0.054 8.444 8.310 0.133 0.000 0.477 27 M N 2.089 121.739 119.600 0.084 0.000 2.175 27 M HA -0.167 4.383 4.480 0.117 0.000 0.264 27 M C -0.219 176.117 176.300 0.060 0.000 1.063 27 M CA 1.654 57.008 55.300 0.091 0.000 1.119 27 M CB 0.233 32.901 32.600 0.114 0.000 1.377 27 M HN -0.577 7.627 8.290 0.086 0.138 0.415 28 C N -2.854 116.421 119.300 -0.041 0.000 2.269 28 C HA -0.059 4.335 4.460 -0.110 0.000 0.378 28 C C -1.949 173.115 174.990 0.123 0.000 1.319 28 C CA -0.126 58.863 59.018 -0.047 0.000 1.721 28 C CB -2.404 25.207 27.740 -0.216 0.000 1.998 28 C HN -0.042 8.036 8.230 -0.076 0.107 0.582 29 D N -1.594 118.905 120.400 0.166 0.000 2.881 29 D HA 0.405 5.339 4.640 0.134 -0.213 0.325 29 D C -0.482 175.900 176.300 0.138 0.000 1.621 29 D CA -0.075 54.007 54.000 0.136 0.000 0.785 29 D CB 1.513 42.376 40.800 0.105 0.000 1.233 29 D HN -0.683 7.670 8.370 0.178 0.123 0.447 30 S N -0.117 115.700 115.700 0.195 0.000 2.885 30 S HA 0.077 4.600 4.470 0.087 0.000 0.172 30 S C 0.317 174.926 174.600 0.015 0.000 0.703 30 S CA 0.389 58.660 58.200 0.118 0.000 0.820 30 S CB 1.305 64.605 63.200 0.168 0.000 0.766 30 S HN -0.764 7.748 8.310 0.336 0.000 0.605 31 L N 2.240 123.421 121.223 -0.069 0.000 3.574 31 L HA -0.388 3.859 4.340 -0.155 0.000 0.416 31 L C 1.354 178.140 176.870 -0.139 0.000 1.112 31 L CA 0.650 55.371 54.840 -0.197 0.000 0.745 31 L CB -0.738 41.036 42.059 -0.475 0.000 1.110 31 L HN 0.116 8.340 8.230 -0.010 0.000 0.747 32 A N 4.381 127.140 122.820 -0.103 0.000 2.027 32 A HA -0.371 3.916 4.320 -0.054 0.000 0.238 32 A C 0.060 177.595 177.584 -0.080 0.000 1.809 32 A CA 2.671 54.662 52.037 -0.076 0.000 0.738 32 A CB -0.456 18.501 19.000 -0.072 0.000 0.832 32 A HN 0.734 8.824 8.150 -0.099 0.000 0.554 33 K N -6.267 114.066 120.400 -0.111 0.000 2.861 33 K HA 0.353 4.613 4.320 -0.101 0.000 0.210 33 K C -1.154 175.367 176.600 -0.131 0.000 1.112 33 K CA -1.099 55.114 56.287 -0.124 0.000 1.076 33 K CB 0.353 32.759 32.500 -0.157 0.000 0.853 33 K HN -0.051 8.055 8.250 -0.137 0.062 0.463 34 I N 2.528 123.042 120.570 -0.093 0.000 2.460 34 I HA 0.322 4.456 4.170 -0.059 0.000 0.298 34 I C -2.332 173.781 176.117 -0.006 0.000 0.989 34 I CA -4.046 57.226 61.300 -0.046 0.000 1.173 34 I CB 2.142 40.127 38.000 -0.025 0.000 1.338 34 I HN -0.095 8.009 8.210 -0.079 0.058 0.456 35 P HA 0.256 4.684 4.420 0.014 0.000 0.325 35 P C -1.568 175.756 177.300 0.039 0.000 1.298 35 P CA -1.395 61.717 63.100 0.020 0.000 0.771 35 P CB 2.002 33.707 31.700 0.009 0.000 1.389 36 K N -1.356 119.054 120.400 0.017 0.000 2.805 36 K HA 0.295 4.809 4.320 0.044 -0.168 0.227 36 K C 0.384 176.937 176.600 -0.079 0.000 1.207 36 K CA -1.230 55.060 56.287 0.004 0.000 1.153 36 K CB -1.164 31.360 32.500 0.039 0.000 1.688 36 K HN 0.334 8.586 8.250 0.003 0.000 0.467 37 R N 2.178 122.670 120.500 -0.013 0.000 2.100 37 R HA -0.190 4.089 4.340 -0.101 0.000 0.220 37 R C 1.053 177.365 176.300 0.021 0.000 1.091 37 R CA 3.093 59.182 56.100 -0.018 0.000 0.986 37 R CB -0.022 30.319 30.300 0.069 0.000 0.888 37 R HN -0.298 7.930 8.270 0.040 0.066 0.444 38 A N -0.300 122.558 122.820 0.063 0.000 1.883 38 A HA -0.288 4.108 4.320 0.127 0.000 0.217 38 A C 1.829 179.454 177.584 0.069 0.000 1.186 38 A CA 3.210 55.290 52.037 0.073 0.000 0.624 38 A CB -0.975 18.031 19.000 0.010 0.000 0.822 38 A HN -0.258 8.027 8.150 0.073 -0.091 0.444 39 S N -1.205 114.514 115.700 0.032 0.000 2.353 39 S HA -0.385 4.200 4.470 0.191 0.000 0.222 39 S C 2.148 176.695 174.600 -0.089 0.000 1.035 39 S CA 3.928 62.166 58.200 0.062 0.000 1.025 39 S CB -0.203 63.054 63.200 0.094 0.000 0.902 39 S HN -0.550 8.031 8.310 0.021 -0.258 0.440 40 M N 1.510 120.866 119.600 -0.406 0.000 2.108 40 M HA -0.417 3.744 4.480 -0.532 0.000 0.261 40 M C 2.215 178.470 176.300 -0.074 0.000 1.066 40 M CA 4.087 59.147 55.300 -0.401 0.000 1.107 40 M CB -0.161 32.205 32.600 -0.389 0.000 1.356 40 M HN -0.781 7.256 8.290 -0.421 0.000 0.406 41 V N -0.454 119.446 119.914 -0.023 0.000 2.237 41 V HA -0.518 3.590 4.120 -0.020 0.000 0.245 41 V C 1.887 178.029 176.094 0.079 0.000 1.046 41 V CA 4.913 67.237 62.300 0.040 0.000 1.007 41 V CB -0.355 31.566 31.823 0.163 0.000 0.638 41 V HN -0.122 8.048 8.190 -0.033 0.000 0.445 42 H N 0.914 120.010 119.070 0.044 0.000 2.267 42 H HA -0.285 4.326 4.556 0.091 0.000 0.297 42 H C 2.385 177.687 175.328 -0.043 0.000 1.080 42 H CA 2.926 58.982 56.048 0.013 0.000 1.278 42 H CB -0.061 29.651 29.762 -0.083 0.000 1.365 42 H HN -0.024 8.387 8.280 0.219 0.000 0.489 43 S N -0.276 115.356 115.700 -0.114 0.000 2.399 43 S HA -0.366 4.012 4.470 -0.152 0.000 0.235 43 S C 2.340 176.826 174.600 -0.189 0.000 1.063 43 S CA 3.634 61.801 58.200 -0.055 0.000 1.070 43 S CB -0.566 62.876 63.200 0.404 0.000 0.904 43 S HN 0.285 8.547 8.310 0.091 0.102 0.456 44 L N 1.395 122.491 121.223 -0.213 0.000 2.102 44 L HA -0.111 3.966 4.340 -0.439 0.000 0.202 44 L C 1.309 178.094 176.870 -0.141 0.000 1.076 44 L CA 2.731 57.405 54.840 -0.276 0.000 0.761 44 L CB 0.081 41.997 42.059 -0.238 0.000 0.921 44 L HN -0.653 7.396 8.230 -0.125 0.106 0.444 45 I N -0.715 119.753 120.570 -0.170 0.000 2.248 45 I HA -0.716 3.380 4.170 -0.123 0.000 0.248 45 I C 1.685 177.661 176.117 -0.234 0.000 1.107 45 I CA 4.711 65.910 61.300 -0.168 0.000 1.373 45 I CB -0.463 37.440 38.000 -0.162 0.000 1.055 45 I HN -0.176 7.943 8.210 -0.153 0.000 0.418 46 E N 0.027 119.947 120.200 -0.466 0.000 2.028 46 E HA -0.352 3.230 4.350 -1.279 0.000 0.191 46 E C 2.863 179.283 176.600 -0.300 0.000 0.988 46 E CA 2.892 58.844 56.400 -0.746 0.000 0.799 46 E CB 0.085 29.266 29.700 -0.865 0.000 0.755 46 E HN 0.391 8.337 8.360 -0.490 0.120 0.447 47 A N -0.534 122.170 122.820 -0.193 0.000 1.986 47 A HA -0.256 4.018 4.320 -0.077 0.000 0.220 47 A C 1.129 178.671 177.584 -0.070 0.000 1.171 47 A CA 2.399 54.376 52.037 -0.101 0.000 0.640 47 A CB -0.261 18.645 19.000 -0.157 0.000 0.811 47 A HN -0.003 7.812 8.150 -0.247 0.186 0.451 48 Y N -4.631 115.606 120.300 -0.105 0.000 2.468 48 Y HA -0.211 4.319 4.550 -0.034 0.000 0.268 48 Y C -0.647 175.253 175.900 -0.001 0.000 1.177 48 Y CA 0.227 58.297 58.100 -0.050 0.000 1.265 48 Y CB 0.415 38.838 38.460 -0.062 0.000 1.103 48 Y HN -0.547 7.791 8.280 0.150 0.032 0.522 49 A N -3.147 119.774 122.820 0.168 0.000 2.826 49 A HA -0.405 4.317 4.320 0.513 -0.094 0.274 49 A C 0.310 178.057 177.584 0.272 0.000 1.443 49 A CA 1.081 53.288 52.037 0.283 0.000 0.833 49 A CB -2.382 16.711 19.000 0.155 0.000 1.023 49 A HN 0.170 8.143 8.150 0.096 0.235 0.600 50 L N -3.319 118.025 121.223 0.203 0.000 2.141 50 L HA -0.403 3.970 4.340 0.056 0.000 0.209 50 L C 1.864 178.785 176.870 0.086 0.000 1.094 50 L CA 2.914 57.805 54.840 0.084 0.000 0.763 50 L CB -0.901 41.151 42.059 -0.011 0.000 0.908 50 L HN -0.016 8.272 8.230 0.158 0.037 0.437 51 H N -1.809 117.194 119.070 -0.112 0.000 2.426 51 H HA -0.263 4.173 4.556 -0.199 0.000 0.298 51 H C 2.178 177.515 175.328 0.015 0.000 1.107 51 H CA 2.341 58.335 56.048 -0.091 0.000 1.298 51 H CB -1.517 28.246 29.762 0.001 0.000 1.377 51 H HN -0.426 8.071 8.280 0.390 0.017 0.519 52 K N -0.575 119.600 120.400 -0.374 0.000 2.281 52 K HA -0.167 3.946 4.320 -0.347 0.000 0.203 52 K C 1.461 178.002 176.600 -0.098 0.000 1.046 52 K CA 1.581 57.688 56.287 -0.300 0.000 0.938 52 K CB -1.064 31.302 32.500 -0.223 0.000 0.737 52 K HN -0.473 7.469 8.250 -0.315 0.119 0.458 53 Q N -3.390 116.382 119.800 -0.046 0.000 2.204 53 Q HA 0.078 4.408 4.340 -0.016 0.000 0.209 53 Q C -0.891 175.111 176.000 0.005 0.000 0.861 53 Q CA -0.037 55.757 55.803 -0.015 0.000 0.971 53 Q CB 0.605 29.337 28.738 -0.010 0.000 1.095 53 Q HN -0.220 7.844 8.270 -0.036 0.184 0.486 54 M N -3.047 116.566 119.600 0.022 0.000 2.727 54 M HA 0.240 4.750 4.480 0.051 0.000 0.300 54 M C -1.508 174.849 176.300 0.094 0.000 1.246 54 M CA -1.226 54.112 55.300 0.064 0.000 0.835 54 M CB 4.122 36.776 32.600 0.091 0.000 1.755 54 M HN -0.317 7.792 8.290 0.010 0.187 0.473 55 R N 1.582 122.149 120.500 0.110 0.000 2.255 55 R HA 0.293 4.689 4.340 0.093 0.000 0.326 55 R C -1.805 174.594 176.300 0.166 0.000 0.986 55 R CA -1.133 55.031 56.100 0.106 0.000 0.847 55 R CB 1.366 31.710 30.300 0.073 0.000 1.111 55 R HN 0.380 8.715 8.270 0.107 0.000 0.452 56 I N 5.985 126.666 120.570 0.184 0.000 2.385 56 I HA 0.570 5.114 4.170 0.299 -0.195 0.294 56 I C -0.281 175.906 176.117 0.116 0.000 0.988 56 I CA -0.738 60.702 61.300 0.234 0.000 1.265 56 I CB 1.440 39.634 38.000 0.324 0.000 1.388 56 I HN 0.341 8.642 8.210 0.153 0.000 0.480 57 V N 7.257 127.213 119.914 0.070 0.000 2.823 57 V HA 0.375 4.502 4.120 0.012 0.000 0.312 57 V C -2.007 174.062 176.094 -0.042 0.000 1.072 57 V CA -1.723 60.583 62.300 0.009 0.000 0.937 57 V CB 4.286 36.111 31.823 0.003 0.000 1.013 57 V HN 0.778 8.908 8.190 0.076 0.106 0.430 58 K N 4.725 125.084 120.400 -0.069 0.000 2.240 58 K HA 0.403 4.782 4.320 -0.156 -0.153 0.271 58 K C -1.917 174.598 176.600 -0.143 0.000 1.018 58 K CA -3.570 52.642 56.287 -0.124 0.000 0.874 58 K CB 1.108 33.542 32.500 -0.111 0.000 1.098 58 K HN 0.126 8.346 8.250 -0.049 0.000 0.458 59 P HA -0.018 4.281 4.420 -0.202 0.000 0.272 59 P C -1.396 175.778 177.300 -0.211 0.000 1.240 59 P CA -0.158 62.782 63.100 -0.267 0.000 0.791 59 P CB 1.205 32.593 31.700 -0.521 0.000 0.978 60 K N -2.208 118.084 120.400 -0.181 0.000 2.245 60 K HA 0.296 4.550 4.320 -0.110 0.000 0.234 60 K C -0.622 175.894 176.600 -0.140 0.000 1.021 60 K CA -1.491 54.722 56.287 -0.124 0.000 0.898 60 K CB 1.977 34.429 32.500 -0.080 0.000 1.163 60 K HN -0.392 7.747 8.250 -0.186 0.000 0.459 61 V N -0.599 119.257 119.914 -0.095 0.000 2.398 61 V HA 0.026 4.177 4.120 -0.119 -0.102 0.286 61 V C -0.395 175.663 176.094 -0.061 0.000 1.026 61 V CA -1.005 61.243 62.300 -0.087 0.000 0.868 61 V CB 1.134 32.924 31.823 -0.054 0.000 0.982 61 V HN 0.116 8.264 8.190 -0.071 0.000 0.443 62 A N 7.422 130.203 122.820 -0.064 0.000 2.429 62 A HA 0.104 4.547 4.320 -0.023 -0.136 0.242 62 A C -0.428 177.146 177.584 -0.016 0.000 1.088 62 A CA 0.127 52.144 52.037 -0.033 0.000 0.784 62 A CB 1.353 20.337 19.000 -0.026 0.000 1.038 62 A HN 0.357 8.359 8.150 -0.085 0.096 0.501 63 S N -1.621 114.086 115.700 0.012 0.000 2.638 63 S HA 0.308 4.804 4.470 0.043 0.000 0.298 63 S C 0.544 175.180 174.600 0.060 0.000 1.111 63 S CA -2.078 56.145 58.200 0.038 0.000 1.027 63 S CB 2.206 65.428 63.200 0.036 0.000 1.064 63 S HN 0.001 8.537 8.310 0.018 -0.215 0.525 64 M N 4.213 123.872 119.600 0.098 0.000 2.082 64 M HA -0.356 4.217 4.480 0.155 0.000 0.258 64 M C 1.012 177.373 176.300 0.102 0.000 1.069 64 M CA 3.223 58.603 55.300 0.133 0.000 1.102 64 M CB -0.904 31.785 32.600 0.148 0.000 1.336 64 M HN 0.457 8.809 8.290 0.104 0.000 0.404 65 E N -4.904 115.344 120.200 0.080 0.000 2.219 65 E HA -0.376 4.019 4.350 0.075 0.000 0.198 65 E C 0.700 177.348 176.600 0.080 0.000 0.998 65 E CA 2.475 58.918 56.400 0.072 0.000 0.818 65 E CB -1.055 28.677 29.700 0.054 0.000 0.741 65 E HN 0.550 8.959 8.360 0.073 -0.006 0.477 66 E N -2.471 117.776 120.200 0.077 0.000 2.102 66 E HA -0.096 4.305 4.350 0.085 0.000 0.190 66 E C 2.571 179.246 176.600 0.126 0.000 0.971 66 E CA 1.237 57.688 56.400 0.085 0.000 0.821 66 E CB 0.601 30.336 29.700 0.059 0.000 0.777 66 E HN -0.571 7.656 8.360 0.069 0.174 0.460 67 M N 0.707 120.381 119.600 0.124 0.000 2.175 67 M HA -0.291 4.331 4.480 0.237 0.000 0.264 67 M C 1.910 178.380 176.300 0.285 0.000 1.063 67 M CA 3.888 59.305 55.300 0.194 0.000 1.119 67 M CB 0.155 32.800 32.600 0.075 0.000 1.377 67 M HN 0.317 8.661 8.290 0.090 0.000 0.415 68 A N -3.251 119.686 122.820 0.194 0.000 2.248 68 A HA -0.069 4.583 4.320 0.196 -0.214 0.210 68 A C 0.646 178.316 177.584 0.145 0.000 1.174 68 A CA 1.568 53.706 52.037 0.169 0.000 0.750 68 A CB -0.920 18.154 19.000 0.123 0.000 0.780 68 A HN 0.052 8.280 8.150 0.151 0.013 0.478 69 T N -1.126 113.527 114.554 0.165 0.000 2.951 69 T HA -0.209 4.210 4.350 0.115 0.000 0.268 69 T C 0.204 175.019 174.700 0.192 0.000 1.073 69 T CA 3.190 65.379 62.100 0.149 0.000 1.134 69 T CB 0.399 69.352 68.868 0.142 0.000 0.884 69 T HN -0.459 7.669 8.240 0.183 0.221 0.479 70 F N 0.141 120.103 119.950 0.021 0.000 2.619 70 F HA 0.176 4.633 4.527 -0.117 0.000 0.281 70 F C -0.737 174.961 175.800 -0.170 0.000 1.065 70 F CA -0.185 57.744 58.000 -0.117 0.000 1.304 70 F CB 2.592 41.470 39.000 -0.203 0.000 1.059 70 F HN -0.709 7.730 8.300 0.280 0.030 0.648 71 H N -0.731 118.241 119.070 -0.164 0.000 2.488 71 H HA 0.292 4.572 4.556 -0.555 -0.057 0.347 71 H C 0.476 175.774 175.328 -0.051 0.000 1.174 71 H CA 0.186 56.098 56.048 -0.228 0.000 1.307 71 H CB 1.368 31.174 29.762 0.073 0.000 1.517 71 H HN -0.148 8.138 8.280 0.188 0.107 0.554 72 T N -0.224 114.382 114.554 0.086 0.000 2.814 72 T HA 0.034 4.413 4.350 0.048 0.000 0.297 72 T C 1.094 175.889 174.700 0.159 0.000 0.956 72 T CA -0.068 62.086 62.100 0.089 0.000 1.123 72 T CB 0.461 69.355 68.868 0.044 0.000 0.902 72 T HN 0.436 8.603 8.240 0.046 0.101 0.528 73 D N 7.478 127.944 120.400 0.110 0.000 2.192 73 D HA -0.566 4.140 4.640 0.110 0.000 0.189 73 D C 1.790 178.152 176.300 0.104 0.000 1.007 73 D CA 4.787 58.847 54.000 0.100 0.000 0.859 73 D CB -0.431 40.408 40.800 0.065 0.000 0.936 73 D HN 0.678 9.097 8.370 0.083 0.000 0.447 74 A N -0.514 122.367 122.820 0.100 0.000 1.884 74 A HA -0.198 4.342 4.320 0.074 -0.175 0.219 74 A C 2.368 180.048 177.584 0.159 0.000 1.197 74 A CA 2.978 55.077 52.037 0.103 0.000 0.637 74 A CB -0.749 18.302 19.000 0.086 0.000 0.827 74 A HN 0.308 8.509 8.150 0.086 0.000 0.450 75 Y N -0.069 120.278 120.300 0.077 0.000 2.089 75 Y HA -0.389 4.238 4.550 0.129 0.000 0.282 75 Y C 1.617 177.607 175.900 0.149 0.000 1.139 75 Y CA 2.886 61.054 58.100 0.114 0.000 1.123 75 Y CB -0.178 38.340 38.460 0.096 0.000 0.980 75 Y HN -0.451 7.895 8.280 0.272 0.097 0.493 76 L N -2.182 119.043 121.223 0.003 0.000 2.042 76 L HA -0.592 3.665 4.340 -0.138 0.000 0.210 76 L C 2.588 179.448 176.870 -0.017 0.000 1.076 76 L CA 3.276 58.115 54.840 -0.001 0.000 0.749 76 L CB -0.875 41.285 42.059 0.168 0.000 0.893 76 L HN -0.218 8.137 8.230 0.207 0.000 0.432 77 Q N -2.423 117.367 119.800 -0.016 0.000 2.050 77 Q HA -0.428 3.819 4.340 -0.154 0.000 0.202 77 Q C 2.558 178.489 176.000 -0.113 0.000 0.980 77 Q CA 3.556 59.311 55.803 -0.080 0.000 0.840 77 Q CB -0.148 28.582 28.738 -0.013 0.000 0.898 77 Q HN 0.386 8.669 8.270 0.040 0.010 0.424 78 H N 1.213 120.213 119.070 -0.116 0.000 2.299 78 H HA -0.260 4.243 4.556 -0.089 0.000 0.302 78 H C 1.924 177.161 175.328 -0.151 0.000 1.078 78 H CA 3.455 59.442 56.048 -0.102 0.000 1.323 78 H CB 0.195 29.938 29.762 -0.032 0.000 1.381 78 H HN -0.348 7.907 8.280 0.080 0.073 0.498 79 L N -0.856 120.198 121.223 -0.281 0.000 1.991 79 L HA -0.531 3.649 4.340 -0.267 0.000 0.221 79 L C 1.681 178.387 176.870 -0.275 0.000 1.079 79 L CA 3.885 58.554 54.840 -0.285 0.000 0.778 79 L CB -0.450 41.423 42.059 -0.309 0.000 0.893 79 L HN 0.462 8.582 8.230 -0.184 0.000 0.437 80 Q N -1.872 117.671 119.800 -0.428 0.000 2.014 80 Q HA -0.560 3.186 4.340 -0.990 0.000 0.207 80 Q C 2.091 177.793 176.000 -0.498 0.000 0.993 80 Q CA 3.321 58.581 55.803 -0.904 0.000 0.850 80 Q CB -0.083 27.811 28.738 -1.406 0.000 0.916 80 Q HN -0.053 8.008 8.270 -0.359 -0.006 0.417 81 K N -1.340 118.811 120.400 -0.415 0.000 2.032 81 K HA -0.393 3.778 4.320 -0.249 0.000 0.218 81 K C 2.676 179.111 176.600 -0.275 0.000 1.054 81 K CA 3.196 59.306 56.287 -0.295 0.000 0.941 81 K CB -0.118 32.237 32.500 -0.241 0.000 0.720 81 K HN -0.475 7.526 8.250 -0.416 0.000 0.449 82 V N -1.175 118.523 119.914 -0.361 0.000 2.295 82 V HA -0.406 3.593 4.120 -0.202 0.000 0.246 82 V C 2.131 178.110 176.094 -0.190 0.000 1.049 82 V CA 3.751 65.890 62.300 -0.270 0.000 1.024 82 V CB -0.128 31.480 31.823 -0.359 0.000 0.648 82 V HN -0.037 7.845 8.190 -0.514 0.000 0.447 83 S N -1.317 114.265 115.700 -0.197 0.000 2.443 83 S HA -0.437 3.953 4.470 -0.133 0.000 0.246 83 S C 1.723 176.261 174.600 -0.104 0.000 1.058 83 S CA 3.323 61.445 58.200 -0.129 0.000 1.028 83 S CB -0.383 62.779 63.200 -0.064 0.000 0.821 83 S HN 0.053 8.217 8.310 -0.243 0.000 0.484 84 Q N -2.065 117.665 119.800 -0.117 0.000 2.178 84 Q HA -0.055 4.245 4.340 -0.066 0.000 0.195 84 Q C 1.711 177.667 176.000 -0.074 0.000 0.960 84 Q CA 1.837 57.589 55.803 -0.085 0.000 0.843 84 Q CB -0.261 28.421 28.738 -0.092 0.000 0.927 84 Q HN -0.572 7.538 8.270 -0.151 0.070 0.487 85 E N 0.561 120.711 120.200 -0.083 0.000 2.033 85 E HA -0.294 4.024 4.350 -0.054 0.000 0.199 85 E C 0.912 177.478 176.600 -0.057 0.000 1.011 85 E CA 1.524 57.885 56.400 -0.065 0.000 0.815 85 E CB 0.515 30.175 29.700 -0.067 0.000 0.755 85 E HN -0.373 7.925 8.360 -0.103 0.000 0.451 86 G N -1.157 107.603 108.800 -0.067 0.000 2.358 86 G HA2 -0.307 3.746 3.960 -0.070 0.000 0.198 86 G HA3 -0.307 3.710 3.960 -0.047 -0.085 0.198 86 G C -1.574 173.300 174.900 -0.043 0.000 1.220 86 G CA -0.709 44.357 45.100 -0.057 0.000 1.187 86 G HN -0.251 7.989 8.290 -0.083 0.000 0.544 87 D N 2.783 123.167 120.400 -0.027 0.000 2.518 87 D HA 0.207 4.845 4.640 -0.003 0.000 0.230 87 D C -1.155 175.143 176.300 -0.005 0.000 1.138 87 D CA -0.328 53.667 54.000 -0.009 0.000 0.964 87 D CB -1.565 39.234 40.800 -0.002 0.000 1.011 87 D HN 0.005 8.358 8.370 -0.028 0.000 0.517 105 T N 0.013 114.510 114.554 -0.094 0.000 2.604 105 T HA 0.163 4.475 4.350 -0.063 0.000 0.267 105 T C -1.917 172.714 174.700 -0.116 0.000 0.923 105 T CA -1.107 60.938 62.100 -0.091 0.000 1.077 105 T CB 1.348 70.156 68.868 -0.099 0.000 1.392 105 T HN -0.076 8.067 8.240 -0.161 0.000 0.531 106 E N -2.295 117.845 120.200 -0.100 0.000 2.214 106 E HA 0.370 4.740 4.350 -0.098 -0.078 0.274 106 E C -0.074 176.469 176.600 -0.095 0.000 0.977 106 E CA -0.899 55.448 56.400 -0.089 0.000 0.827 106 E CB 1.021 30.686 29.700 -0.058 0.000 1.130 106 E HN 0.023 8.330 8.360 -0.088 0.000 0.394 107 G N 2.740 111.499 108.800 -0.069 0.000 2.493 107 G HA2 -0.349 3.626 3.960 0.025 0.000 0.206 107 G HA3 -0.349 3.589 3.960 -0.036 0.000 0.206 107 G C 0.289 175.170 174.900 -0.032 0.000 1.109 107 G CA 1.024 46.108 45.100 -0.027 0.000 0.689 107 G HN 0.624 8.775 8.290 -0.058 0.103 0.516 108 I N 0.058 120.508 120.570 -0.199 0.000 2.237 108 I HA -0.695 3.217 4.170 -0.430 0.000 0.245 108 I C 0.532 176.582 176.117 -0.112 0.000 1.013 108 I CA 3.124 64.220 61.300 -0.340 0.000 1.298 108 I CB -0.685 36.900 38.000 -0.693 0.000 0.995 108 I HN -0.392 7.597 8.210 -0.252 0.070 0.422 109 F N 0.868 120.719 119.950 -0.165 0.000 2.128 109 F HA -0.375 4.087 4.527 -0.109 0.000 0.295 109 F C 1.144 176.930 175.800 -0.023 0.000 1.100 109 F CA 4.523 62.460 58.000 -0.105 0.000 1.260 109 F CB 0.288 39.207 39.000 -0.135 0.000 1.009 109 F HN 0.209 8.525 8.300 0.066 0.024 0.476 110 D N -0.453 120.056 120.400 0.183 0.000 2.104 110 D HA -0.415 4.299 4.640 0.125 0.000 0.194 110 D C 2.185 178.526 176.300 0.068 0.000 0.994 110 D CA 3.648 57.720 54.000 0.121 0.000 0.830 110 D CB -0.735 40.139 40.800 0.124 0.000 0.959 110 D HN -0.035 8.398 8.370 0.215 0.066 0.452 111 Y N 0.894 121.170 120.300 -0.040 0.000 2.070 111 Y HA -0.511 4.055 4.550 0.027 0.000 0.280 111 Y C 1.171 177.057 175.900 -0.024 0.000 1.148 111 Y CA 3.799 61.885 58.100 -0.022 0.000 1.125 111 Y CB 0.085 38.508 38.460 -0.061 0.000 0.975 111 Y HN 0.106 8.391 8.280 0.203 0.117 0.492 112 A N -2.130 120.759 122.820 0.115 0.000 1.883 112 A HA -0.508 3.887 4.320 0.126 0.000 0.217 112 A C 1.350 178.872 177.584 -0.104 0.000 1.186 112 A CA 3.073 55.120 52.037 0.016 0.000 0.624 112 A CB -0.937 18.017 19.000 -0.077 0.000 0.822 112 A HN 0.294 8.412 8.150 0.147 0.120 0.444 113 A N -1.745 120.929 122.820 -0.243 0.000 1.917 113 A HA -0.341 3.822 4.320 -0.261 0.000 0.219 113 A C 1.798 179.308 177.584 -0.124 0.000 1.182 113 A CA 2.906 54.802 52.037 -0.235 0.000 0.633 113 A CB -0.645 18.208 19.000 -0.245 0.000 0.819 113 A HN 0.261 8.114 8.150 -0.313 0.109 0.448 114 A N -0.848 121.912 122.820 -0.099 0.000 1.832 114 A HA -0.288 3.940 4.320 -0.154 0.000 0.214 114 A C 2.056 179.562 177.584 -0.130 0.000 1.200 114 A CA 2.719 54.687 52.037 -0.115 0.000 0.610 114 A CB -0.403 18.571 19.000 -0.044 0.000 0.842 114 A HN -0.586 7.405 8.150 -0.090 0.106 0.444 115 I N -1.575 119.000 120.570 0.009 0.000 2.208 115 I HA -0.436 3.872 4.170 0.229 0.000 0.245 115 I C 2.362 178.518 176.117 0.065 0.000 1.097 115 I CA 3.484 64.870 61.300 0.142 0.000 1.363 115 I CB -0.659 37.489 38.000 0.247 0.000 1.051 115 I HN -0.283 7.915 8.210 -0.019 0.000 0.413 116 G N -1.493 107.337 108.800 0.051 0.000 2.491 116 G HA2 -0.393 3.628 3.960 0.102 0.000 0.218 116 G HA3 -0.393 3.591 3.960 0.041 0.000 0.218 116 G C 1.015 175.909 174.900 -0.009 0.000 1.180 116 G CA 2.512 47.643 45.100 0.051 0.000 0.774 116 G HN 0.411 8.720 8.290 0.039 0.004 0.562 117 G N 1.184 109.944 108.800 -0.067 0.000 2.476 117 G HA2 -0.413 3.508 3.960 -0.064 0.000 0.218 117 G HA3 -0.413 3.727 3.960 -0.136 -0.262 0.218 117 G C 0.860 175.676 174.900 -0.141 0.000 1.164 117 G CA 1.574 46.612 45.100 -0.103 0.000 0.768 117 G HN -0.172 7.899 8.290 -0.078 0.173 0.560 118 A N 2.844 125.531 122.820 -0.222 0.000 1.859 118 A HA -0.416 3.718 4.320 -0.310 0.000 0.217 118 A C 2.078 179.598 177.584 -0.107 0.000 1.198 118 A CA 3.159 55.044 52.037 -0.254 0.000 0.629 118 A CB -0.722 18.083 19.000 -0.325 0.000 0.830 118 A HN 0.342 8.156 8.150 -0.241 0.191 0.446 119 T N 1.737 116.263 114.554 -0.047 0.000 2.635 119 T HA -0.439 3.886 4.350 -0.042 0.000 0.267 119 T C 2.064 176.752 174.700 -0.021 0.000 1.040 119 T CA 5.899 67.984 62.100 -0.025 0.000 1.156 119 T CB -0.402 68.472 68.868 0.011 0.000 0.863 119 T HN -0.247 7.977 8.240 -0.027 0.000 0.430 120 I N 0.954 121.517 120.570 -0.012 0.000 2.264 120 I HA -0.536 3.643 4.170 0.016 0.000 0.248 120 I C 1.810 177.918 176.117 -0.015 0.000 1.111 120 I CA 4.251 65.550 61.300 -0.001 0.000 1.382 120 I CB -0.634 37.369 38.000 0.005 0.000 1.060 120 I HN 0.043 8.246 8.210 -0.011 0.000 0.418 121 T N 2.374 116.902 114.554 -0.044 0.000 2.788 121 T HA -0.411 3.920 4.350 -0.033 0.000 0.268 121 T C 1.493 176.175 174.700 -0.030 0.000 1.044 121 T CA 5.201 67.273 62.100 -0.046 0.000 1.139 121 T CB -0.768 68.049 68.868 -0.084 0.000 0.867 121 T HN 0.178 8.277 8.240 -0.064 0.103 0.454 122 A N 1.332 124.131 122.820 -0.036 0.000 1.902 122 A HA -0.344 3.960 4.320 -0.027 0.000 0.217 122 A C 1.513 179.096 177.584 -0.001 0.000 1.181 122 A CA 3.098 55.117 52.037 -0.029 0.000 0.623 122 A CB -0.875 18.092 19.000 -0.055 0.000 0.818 122 A HN -0.214 7.795 8.150 -0.048 0.112 0.443 123 A N -1.273 121.554 122.820 0.011 0.000 1.858 123 A HA -0.476 3.881 4.320 0.061 0.000 0.216 123 A C 1.533 179.156 177.584 0.065 0.000 1.190 123 A CA 3.072 55.139 52.037 0.050 0.000 0.617 123 A CB -0.808 18.224 19.000 0.054 0.000 0.827 123 A HN 0.110 8.183 8.150 -0.001 0.076 0.443 124 Q N -0.304 119.519 119.800 0.038 0.000 2.077 124 Q HA -0.332 4.029 4.340 0.036 0.000 0.206 124 Q C 2.229 178.252 176.000 0.037 0.000 0.989 124 Q CA 3.041 58.862 55.803 0.031 0.000 0.853 124 Q CB -0.657 28.087 28.738 0.010 0.000 0.907 124 Q HN 0.173 8.457 8.270 0.023 0.000 0.418 125 C N -1.764 117.554 119.300 0.030 0.000 2.429 125 C HA -0.324 4.153 4.460 0.029 0.000 0.277 125 C C 2.237 177.262 174.990 0.058 0.000 1.262 125 C CA 4.966 64.004 59.018 0.034 0.000 1.733 125 C CB -0.770 26.983 27.740 0.021 0.000 2.010 125 C HN -0.192 8.045 8.230 0.019 0.005 0.483 126 L N 0.816 122.085 121.223 0.077 0.000 1.994 126 L HA -0.325 4.261 4.340 0.093 -0.190 0.208 126 L C 3.152 180.146 176.870 0.207 0.000 1.071 126 L CA 2.888 57.802 54.840 0.123 0.000 0.745 126 L CB -0.066 42.063 42.059 0.118 0.000 0.892 126 L HN -0.573 7.618 8.230 0.062 0.076 0.431 127 I N -2.157 118.538 120.570 0.209 0.000 2.151 127 I HA -0.475 3.776 4.170 0.136 0.000 0.243 127 I C 1.261 177.410 176.117 0.053 0.000 1.080 127 I CA 2.526 63.899 61.300 0.121 0.000 1.339 127 I CB -1.034 36.992 38.000 0.044 0.000 1.039 127 I HN 0.285 8.601 8.210 0.178 0.000 0.409 128 D N -1.884 118.547 120.400 0.051 0.000 2.856 128 D HA -0.030 4.618 4.640 0.014 0.000 0.242 128 D C -0.180 176.147 176.300 0.044 0.000 1.226 128 D CA -0.025 53.993 54.000 0.030 0.000 0.855 128 D CB -1.721 39.092 40.800 0.021 0.000 1.065 128 D HN -0.131 8.085 8.370 0.059 0.189 0.462 129 G N -1.925 106.916 108.800 0.069 0.000 2.425 129 G HA2 -0.376 3.705 3.960 0.098 0.000 0.290 129 G HA3 -0.376 3.622 3.960 0.063 0.000 0.290 129 G C -0.201 174.729 174.900 0.050 0.000 0.863 129 G CA 1.278 46.421 45.100 0.072 0.000 1.047 129 G HN -0.259 7.967 8.290 0.087 0.116 0.495 130 M N -0.354 119.275 119.600 0.049 0.000 2.412 130 M HA 0.072 4.572 4.480 0.032 0.000 0.263 130 M C -1.133 175.188 176.300 0.036 0.000 1.122 130 M CA 2.380 57.702 55.300 0.037 0.000 1.179 130 M CB 1.607 34.227 32.600 0.033 0.000 1.335 130 M HN -0.170 8.136 8.290 0.058 0.019 0.465 131 C N -5.942 113.381 119.300 0.039 0.000 3.154 131 C HA 0.402 4.878 4.460 0.027 0.000 0.312 131 C C -0.929 174.079 174.990 0.030 0.000 1.349 131 C CA -2.164 56.872 59.018 0.030 0.000 1.518 131 C CB 3.481 31.236 27.740 0.025 0.000 1.934 131 C HN -0.660 7.598 8.230 0.046 0.000 0.462 132 K N -1.477 118.931 120.400 0.015 0.000 2.402 132 K HA 0.127 4.452 4.320 0.008 0.000 0.204 132 K C -1.821 174.769 176.600 -0.017 0.000 1.056 132 K CA 0.297 56.586 56.287 0.003 0.000 1.069 132 K CB 0.809 33.312 32.500 0.004 0.000 0.888 132 K HN 0.329 8.585 8.250 0.011 0.000 0.546 133 V N -2.122 117.782 119.914 -0.016 0.000 2.623 133 V HA 0.627 4.906 4.120 -0.050 -0.190 0.304 133 V C -1.962 174.111 176.094 -0.034 0.000 1.054 133 V CA -1.442 60.836 62.300 -0.037 0.000 0.882 133 V CB 3.434 35.235 31.823 -0.036 0.000 1.002 133 V HN -0.731 7.399 8.190 -0.004 0.057 0.424 134 A N 6.050 128.834 122.820 -0.060 0.000 2.386 134 A HA 0.640 5.049 4.320 -0.025 -0.104 0.311 134 A C -2.418 175.085 177.584 -0.134 0.000 1.068 134 A CA -1.765 50.237 52.037 -0.058 0.000 0.743 134 A CB 3.575 22.550 19.000 -0.042 0.000 1.258 134 A HN 0.696 8.798 8.150 -0.081 0.000 0.429 135 I N 0.607 121.094 120.570 -0.139 0.000 2.509 135 I HA 0.396 4.427 4.170 -0.483 -0.150 0.293 135 I C -1.738 174.198 176.117 -0.302 0.000 1.020 135 I CA -1.016 60.084 61.300 -0.333 0.000 1.088 135 I CB 3.578 41.396 38.000 -0.303 0.000 1.267 135 I HN 0.444 8.522 8.210 -0.053 0.101 0.430 136 N N 3.792 122.228 118.700 -0.441 0.000 2.725 136 N HA 0.404 5.083 4.740 -0.102 0.000 0.248 136 N C -0.283 175.042 175.510 -0.310 0.000 1.402 136 N CA -1.442 51.473 53.050 -0.225 0.000 0.766 136 N CB 0.360 38.781 38.487 -0.110 0.000 1.223 136 N HN 0.412 8.408 8.380 -0.641 0.000 0.515 137 W N 1.237 122.452 121.300 -0.142 0.000 2.611 137 W HA -0.183 4.057 4.660 -0.700 0.000 0.251 137 W C 0.501 176.830 176.519 -0.317 0.000 1.265 137 W CA 1.864 58.962 57.345 -0.411 0.000 1.295 137 W CB 0.044 29.346 29.460 -0.264 0.000 1.129 137 W HN 0.182 8.244 8.180 -0.197 0.000 0.630 138 S N -2.111 113.640 115.700 0.085 0.000 2.577 138 S HA 0.141 4.771 4.470 0.266 0.000 0.219 138 S C -0.443 174.282 174.600 0.208 0.000 0.962 138 S CA 0.743 59.046 58.200 0.170 0.000 0.921 138 S CB 0.211 63.422 63.200 0.018 0.000 0.789 138 S HN -0.594 7.872 8.310 0.080 -0.109 0.497 139 G N -1.919 106.861 108.800 -0.033 0.000 2.613 139 G HA2 0.379 4.359 3.960 0.035 0.000 0.303 139 G HA3 0.379 4.364 3.960 -0.081 -0.074 0.303 139 G C -1.033 173.502 174.900 -0.608 0.000 1.312 139 G CA -1.723 43.282 45.100 -0.159 0.000 1.036 139 G HN -0.475 7.577 8.290 -0.096 0.180 0.513 140 G N -2.726 105.718 108.800 -0.593 0.000 2.164 140 G HA2 -0.203 3.597 3.960 -0.268 0.000 0.154 140 G HA3 -0.203 3.344 3.960 -0.689 0.000 0.154 140 G C -0.237 174.234 174.900 -0.715 0.000 1.014 140 G CA -0.378 44.364 45.100 -0.596 0.000 0.683 140 G HN -0.381 8.176 8.290 -0.325 -0.462 0.500 141 W N 2.094 123.413 121.300 0.032 0.000 2.081 141 W HA 0.010 4.640 4.660 -0.050 0.000 0.433 141 W C -0.596 175.983 176.519 0.100 0.000 0.876 141 W CA -1.454 55.920 57.345 0.048 0.000 1.631 141 W CB -1.979 27.578 29.460 0.161 0.000 1.757 141 W HN -0.146 8.062 8.180 -0.403 -0.269 0.298 142 H N -1.244 117.907 119.070 0.135 0.000 2.533 142 H HA 0.179 4.759 4.556 0.041 0.000 0.271 142 H C -0.264 175.058 175.328 -0.010 0.000 1.000 142 H CA -0.935 55.126 56.048 0.021 0.000 1.149 142 H CB -0.065 29.698 29.762 0.003 0.000 1.375 142 H HN 0.137 8.222 8.280 -0.263 0.037 0.582 143 H N -0.475 118.898 119.070 0.505 0.000 2.586 143 H HA 0.279 5.148 4.556 0.217 -0.182 0.273 143 H C -1.022 174.425 175.328 0.198 0.000 0.997 143 H CA -0.093 56.147 56.048 0.320 0.000 1.177 143 H CB 0.110 30.089 29.762 0.362 0.000 1.471 143 H HN -0.850 7.640 8.280 0.459 0.065 0.538 144 A N -0.881 122.133 122.820 0.323 0.000 2.302 144 A HA -0.103 4.322 4.320 0.175 0.000 0.285 144 A C -1.532 176.203 177.584 0.250 0.000 1.105 144 A CA -0.065 52.132 52.037 0.267 0.000 0.816 144 A CB 2.222 21.453 19.000 0.384 0.000 1.067 144 A HN -0.770 7.536 8.150 0.353 0.056 0.489 145 K N 0.289 120.752 120.400 0.106 0.000 2.306 145 K HA 0.458 4.911 4.320 0.222 0.000 0.236 145 K C 2.337 178.682 176.600 -0.425 0.000 1.013 145 K CA -2.267 54.020 56.287 -0.001 0.000 0.857 145 K CB 2.166 34.614 32.500 -0.086 0.000 1.214 145 K HN 0.364 8.628 8.250 0.023 0.000 0.449 146 K N 0.566 120.457 120.400 -0.848 0.000 2.103 146 K HA -0.340 2.521 4.320 -2.517 -0.051 0.207 146 K C -0.450 175.781 176.600 -0.616 0.000 1.048 146 K CA 3.734 59.188 56.287 -1.387 0.000 0.930 146 K CB -0.178 31.735 32.500 -0.978 0.000 0.716 146 K HN 0.847 8.832 8.250 -0.442 0.000 0.444 147 D N -5.679 114.438 120.400 -0.472 0.000 2.650 147 D HA 0.208 4.643 4.640 -0.342 0.000 0.265 147 D C -1.441 174.546 176.300 -0.522 0.000 1.339 147 D CA -1.575 52.190 54.000 -0.392 0.000 0.816 147 D CB -0.805 39.891 40.800 -0.175 0.000 1.091 147 D HN -0.193 7.899 8.370 -0.420 0.026 0.483 148 E N -1.351 118.436 120.200 -0.688 0.000 2.380 148 E HA 0.055 4.203 4.350 -0.336 0.000 0.281 148 E C -2.795 173.635 176.600 -0.283 0.000 0.999 148 E CA -0.012 56.148 56.400 -0.400 0.000 0.800 148 E CB 3.349 32.945 29.700 -0.173 0.000 1.228 148 E HN -0.766 7.066 8.360 -0.705 0.105 0.436 149 A N 4.661 127.443 122.820 -0.064 0.000 2.305 149 A HA 0.785 5.206 4.320 0.026 -0.085 0.322 149 A C -1.301 176.233 177.584 -0.083 0.000 1.187 149 A CA -0.798 51.238 52.037 -0.001 0.000 0.825 149 A CB 1.309 20.348 19.000 0.064 0.000 1.164 149 A HN 0.490 8.652 8.150 0.020 0.000 0.498 150 S N 0.861 116.509 115.700 -0.087 0.000 2.588 150 S HA 0.191 4.574 4.470 -0.145 0.000 0.275 150 S C -0.024 174.508 174.600 -0.113 0.000 1.130 150 S CA -0.931 57.224 58.200 -0.074 0.000 0.855 150 S CB 1.730 64.960 63.200 0.049 0.000 1.116 150 S HN -0.033 8.250 8.310 -0.045 0.000 0.472 151 G N 4.442 113.078 108.800 -0.274 0.000 2.306 151 G HA2 -0.272 3.054 3.960 -1.056 0.000 0.274 151 G HA3 -0.272 3.496 3.960 -0.319 0.000 0.274 151 G C -0.815 173.934 174.900 -0.251 0.000 0.890 151 G CA 0.931 45.728 45.100 -0.504 0.000 1.298 151 G HN 0.380 8.549 8.290 -0.202 0.000 0.445 152 F N -5.571 114.227 119.950 -0.253 0.000 3.081 152 F HA -0.395 3.804 4.527 -0.547 0.000 0.270 152 F C -0.466 175.035 175.800 -0.499 0.000 0.934 152 F CA 0.798 58.565 58.000 -0.389 0.000 0.907 152 F CB -1.937 36.932 39.000 -0.219 0.000 0.920 152 F HN -0.447 6.946 8.300 -1.511 0.000 0.667 153 C N 0.635 119.727 119.300 -0.346 0.000 2.319 153 C HA 0.200 4.659 4.460 -0.000 0.000 0.323 153 C C -1.102 173.745 174.990 -0.238 0.000 1.277 153 C CA -0.708 58.270 59.018 -0.067 0.000 1.517 153 C CB 1.411 29.325 27.740 0.289 0.000 2.206 153 C HN 0.002 7.857 8.230 -0.331 0.177 0.486 154 Y N 1.841 122.261 120.300 0.200 0.000 2.481 154 Y HA 0.142 4.894 4.550 0.337 0.000 0.247 154 Y C -0.818 175.237 175.900 0.257 0.000 1.151 154 Y CA -0.513 57.740 58.100 0.255 0.000 1.238 154 Y CB 1.123 39.674 38.460 0.151 0.000 1.179 154 Y HN 0.590 9.075 8.280 0.341 0.000 0.524 155 L N -3.332 118.123 121.223 0.387 0.000 2.505 155 L HA 0.137 4.595 4.340 0.196 0.000 0.259 155 L C -1.653 175.516 176.870 0.498 0.000 0.952 155 L CA 0.099 55.142 54.840 0.338 0.000 0.840 155 L CB 3.553 45.730 42.059 0.196 0.000 1.358 155 L HN -0.687 7.720 8.230 0.388 0.056 0.409 156 N N 4.143 123.228 118.700 0.642 0.000 3.194 156 N HA 0.318 5.569 4.740 0.380 -0.283 0.271 156 N C 0.402 176.095 175.510 0.305 0.000 1.308 156 N CA -2.384 50.924 53.050 0.430 0.000 1.042 156 N CB -1.073 37.648 38.487 0.391 0.000 1.310 156 N HN 0.243 9.214 8.380 0.986 0.000 0.502 157 D N 3.168 123.742 120.400 0.290 0.000 2.271 157 D HA -0.347 4.412 4.640 0.198 0.000 0.207 157 D C 0.717 177.068 176.300 0.085 0.000 0.983 157 D CA 3.154 57.268 54.000 0.191 0.000 0.878 157 D CB -0.233 40.686 40.800 0.197 0.000 0.920 157 D HN -0.250 8.289 8.370 0.358 0.047 0.479 158 A N -0.629 122.214 122.820 0.038 0.000 1.872 158 A HA -0.186 4.105 4.320 -0.049 0.000 0.214 158 A C 2.002 179.522 177.584 -0.106 0.000 1.187 158 A CA 2.809 54.801 52.037 -0.075 0.000 0.614 158 A CB -0.511 18.379 19.000 -0.183 0.000 0.826 158 A HN -0.605 7.646 8.150 0.083 -0.051 0.442 159 V N 0.287 120.115 119.914 -0.143 0.000 2.255 159 V HA -0.515 3.631 4.120 0.044 0.000 0.247 159 V C 1.669 177.741 176.094 -0.037 0.000 1.051 159 V CA 4.528 66.717 62.300 -0.184 0.000 1.018 159 V CB -0.196 31.073 31.823 -0.923 0.000 0.641 159 V HN -0.217 8.226 8.190 -0.136 -0.335 0.445 160 L N -2.526 118.707 121.223 0.017 0.000 2.129 160 L HA -0.421 3.987 4.340 0.112 0.000 0.212 160 L C 2.740 179.651 176.870 0.069 0.000 1.087 160 L CA 3.119 58.016 54.840 0.094 0.000 0.757 160 L CB -1.131 41.017 42.059 0.148 0.000 0.896 160 L HN -0.362 7.887 8.230 0.032 0.000 0.434 161 G N -1.559 107.267 108.800 0.043 0.000 2.396 161 G HA2 -0.222 3.763 3.960 0.042 0.000 0.214 161 G HA3 -0.222 3.749 3.960 0.018 0.000 0.214 161 G C 0.872 175.797 174.900 0.042 0.000 1.166 161 G CA 1.545 46.666 45.100 0.035 0.000 0.793 161 G HN -0.616 7.561 8.290 0.029 0.130 0.533 162 I N 3.202 123.784 120.570 0.020 0.000 2.091 162 I HA -0.633 3.534 4.170 -0.005 0.000 0.239 162 I C 1.620 177.775 176.117 0.064 0.000 1.061 162 I CA 4.081 65.380 61.300 -0.001 0.000 1.317 162 I CB -0.096 37.840 38.000 -0.107 0.000 1.031 162 I HN -0.083 8.063 8.210 0.001 0.065 0.401 163 L N -2.341 118.953 121.223 0.118 0.000 1.997 163 L HA -0.533 3.898 4.340 0.152 0.000 0.216 163 L C 2.153 179.081 176.870 0.096 0.000 1.074 163 L CA 3.168 58.086 54.840 0.130 0.000 0.763 163 L CB -0.792 41.345 42.059 0.129 0.000 0.890 163 L HN 0.295 8.609 8.230 0.139 0.000 0.434 164 R N -2.700 117.851 120.500 0.084 0.000 2.170 164 R HA -0.298 4.079 4.340 0.062 0.000 0.242 164 R C 1.655 178.010 176.300 0.091 0.000 1.145 164 R CA 2.306 58.450 56.100 0.073 0.000 0.984 164 R CB -0.531 29.807 30.300 0.064 0.000 0.869 164 R HN -0.649 7.623 8.270 0.083 0.048 0.455 165 L N -2.802 118.500 121.223 0.131 0.000 2.179 165 L HA -0.183 4.340 4.340 0.305 0.000 0.208 165 L C 1.686 178.683 176.870 0.212 0.000 1.096 165 L CA 2.266 57.263 54.840 0.261 0.000 0.779 165 L CB -0.247 41.975 42.059 0.271 0.000 0.922 165 L HN -0.196 7.943 8.230 0.109 0.157 0.443 166 R N -0.702 119.876 120.500 0.129 0.000 2.119 166 R HA -0.315 4.369 4.340 0.113 -0.276 0.246 166 R C 2.424 178.729 176.300 0.008 0.000 1.146 166 R CA 2.775 58.925 56.100 0.084 0.000 0.962 166 R CB -0.726 29.621 30.300 0.078 0.000 0.863 166 R HN -0.167 8.051 8.270 0.115 0.121 0.442 167 R N -3.739 116.753 120.500 -0.013 0.000 2.204 167 R HA -0.239 4.076 4.340 -0.042 0.000 0.253 167 R C 1.518 177.718 176.300 -0.167 0.000 1.172 167 R CA 2.554 58.614 56.100 -0.067 0.000 0.994 167 R CB -0.021 30.244 30.300 -0.058 0.000 0.874 167 R HN -0.570 7.702 8.270 0.022 0.011 0.462 168 K N -3.323 116.883 120.400 -0.324 0.000 2.511 168 K HA 0.093 4.200 4.320 -0.355 0.000 0.206 168 K C -0.187 176.035 176.600 -0.630 0.000 1.333 168 K CA 0.245 56.184 56.287 -0.580 0.000 0.957 168 K CB 2.736 34.688 32.500 -0.914 0.000 1.172 168 K HN -0.461 7.571 8.250 -0.282 0.049 0.547 169 F N 0.575 120.528 119.950 0.006 0.000 2.404 169 F HA 0.109 4.634 4.527 -0.004 0.000 0.354 169 F C -0.230 175.569 175.800 -0.002 0.000 1.122 169 F CA -0.781 57.220 58.000 0.002 0.000 1.080 169 F CB 0.840 39.848 39.000 0.014 0.000 1.131 169 F HN 0.207 8.313 8.300 -0.322 0.000 0.471 170 E N 3.802 124.080 120.200 0.130 0.000 2.033 170 E HA -0.170 4.211 4.350 0.050 0.000 0.189 170 E C -0.141 176.500 176.600 0.068 0.000 0.979 170 E CA 2.255 58.690 56.400 0.059 0.000 0.802 170 E CB 0.632 30.337 29.700 0.008 0.000 0.763 170 E HN 0.467 8.909 8.360 0.136 0.000 0.449 171 R N -1.259 119.267 120.500 0.044 0.000 2.294 171 R HA 0.697 5.390 4.340 0.138 -0.271 0.319 171 R C -1.047 175.363 176.300 0.183 0.000 0.984 171 R CA -0.835 55.297 56.100 0.054 0.000 0.861 171 R CB 1.227 31.319 30.300 -0.346 0.000 1.104 171 R HN -0.323 7.968 8.270 0.035 0.000 0.451 172 I N 2.692 123.414 120.570 0.253 0.000 2.603 172 I HA 0.558 4.970 4.170 0.136 -0.161 0.300 172 I C -1.899 174.336 176.117 0.196 0.000 1.017 172 I CA -3.226 58.167 61.300 0.155 0.000 1.098 172 I CB 2.647 40.652 38.000 0.008 0.000 1.279 172 I HN 0.489 8.867 8.210 0.279 0.000 0.437 173 L N 5.717 127.035 121.223 0.158 0.000 2.341 173 L HA 0.697 5.199 4.340 -0.042 -0.188 0.278 173 L C -2.730 174.222 176.870 0.136 0.000 1.005 173 L CA -1.850 53.049 54.840 0.099 0.000 0.818 173 L CB 3.640 45.804 42.059 0.174 0.000 1.259 173 L HN 0.120 8.434 8.230 0.139 0.000 0.418 174 Y N 8.193 128.464 120.300 -0.048 0.000 2.331 174 Y HA 0.875 5.659 4.550 -0.002 -0.236 0.334 174 Y C -2.461 173.451 175.900 0.020 0.000 0.960 174 Y CA -3.286 54.800 58.100 -0.022 0.000 1.130 174 Y CB 2.877 41.299 38.460 -0.064 0.000 1.164 174 Y HN 0.994 9.321 8.280 0.080 0.000 0.458 175 V N 8.011 127.729 119.914 -0.327 0.000 2.555 175 V HA 0.586 4.757 4.120 -0.229 -0.188 0.302 175 V C -2.092 173.673 176.094 -0.550 0.000 1.038 175 V CA -1.408 60.719 62.300 -0.288 0.000 0.887 175 V CB 3.078 34.868 31.823 -0.055 0.000 0.991 175 V HN 0.731 8.791 8.190 -0.218 0.000 0.434 176 D N 5.550 125.705 120.400 -0.408 0.000 2.471 176 D HA 0.413 4.874 4.640 -0.298 0.000 0.245 176 D C -0.748 175.570 176.300 0.030 0.000 1.116 176 D CA -1.079 52.763 54.000 -0.262 0.000 0.853 176 D CB 2.287 42.947 40.800 -0.233 0.000 1.123 176 D HN 0.574 8.793 8.370 -0.252 0.000 0.540 177 L N 4.444 125.730 121.223 0.104 0.000 2.700 177 L HA 0.363 4.893 4.340 0.318 0.000 0.234 177 L C -1.152 175.857 176.870 0.232 0.000 1.156 177 L CA -0.544 54.440 54.840 0.240 0.000 0.946 177 L CB 0.230 42.443 42.059 0.256 0.000 1.216 177 L HN 0.407 8.676 8.230 0.065 0.000 0.493 178 D N -0.857 119.677 120.400 0.223 0.000 2.368 178 D HA -0.145 4.891 4.640 0.166 -0.297 0.240 178 D C 1.345 177.768 176.300 0.206 0.000 1.169 178 D CA 0.312 54.452 54.000 0.233 0.000 0.906 178 D CB 1.963 42.976 40.800 0.354 0.000 1.187 178 D HN -0.803 7.719 8.370 0.212 -0.025 0.435 179 L N 1.234 122.492 121.223 0.058 0.000 2.265 179 L HA -0.271 3.763 4.340 -0.510 0.000 0.215 179 L C -0.927 175.933 176.870 -0.016 0.000 1.117 179 L CA 1.390 56.075 54.840 -0.257 0.000 0.782 179 L CB 0.520 42.309 42.059 -0.450 0.000 0.914 179 L HN -0.081 8.516 8.230 0.071 -0.325 0.441 180 H N -5.063 114.230 119.070 0.373 0.000 2.544 180 H HA 0.173 5.070 4.556 0.568 0.000 0.342 180 H C -0.865 174.663 175.328 0.334 0.000 1.185 180 H CA -1.183 55.153 56.048 0.479 0.000 1.264 180 H CB 1.767 31.889 29.762 0.601 0.000 1.607 180 H HN -0.313 8.591 8.280 0.501 -0.323 0.550 181 H N 0.906 120.108 119.070 0.219 0.000 2.848 181 H HA -0.174 4.209 4.556 -0.288 0.000 0.317 181 H C 1.646 176.834 175.328 -0.234 0.000 1.046 181 H CA 0.581 56.507 56.048 -0.203 0.000 1.470 181 H CB 0.402 29.917 29.762 -0.411 0.000 1.483 181 H HN 0.401 8.972 8.280 0.486 0.000 0.548 182 G N 8.559 116.999 108.800 -0.600 0.000 3.541 182 G HA2 -0.018 3.104 3.960 -1.397 0.000 0.253 182 G HA3 -0.018 3.858 3.960 -0.300 -0.096 0.253 182 G C -0.629 173.901 174.900 -0.616 0.000 1.017 182 G CA -0.634 44.038 45.100 -0.713 0.000 1.832 182 G HN 0.355 8.476 8.290 -0.281 0.000 0.649 183 D N 3.862 123.762 120.400 -0.833 0.000 2.108 183 D HA -0.389 3.845 4.640 -0.677 0.000 0.190 183 D C 2.283 178.479 176.300 -0.173 0.000 0.995 183 D CA 2.748 56.438 54.000 -0.517 0.000 0.834 183 D CB -1.185 39.521 40.800 -0.157 0.000 0.967 183 D HN -0.135 7.662 8.370 -0.775 0.108 0.446 184 G N 0.164 108.928 108.800 -0.059 0.000 2.759 184 G HA2 -0.472 3.546 3.960 0.062 0.000 0.224 184 G HA3 -0.472 3.742 3.960 0.093 -0.199 0.224 184 G C 1.641 176.511 174.900 -0.050 0.000 1.173 184 G CA 2.568 47.685 45.100 0.027 0.000 0.770 184 G HN -0.215 8.062 8.290 -0.023 0.000 0.626 185 V N 2.306 122.170 119.914 -0.083 0.000 2.270 185 V HA -0.486 3.517 4.120 -0.194 0.000 0.245 185 V C 1.464 177.587 176.094 0.048 0.000 1.043 185 V CA 4.168 66.405 62.300 -0.104 0.000 1.014 185 V CB -0.243 31.390 31.823 -0.316 0.000 0.645 185 V HN -0.815 7.333 8.190 -0.064 0.004 0.447 186 E N 0.349 120.573 120.200 0.040 0.000 2.035 186 E HA -0.499 3.937 4.350 0.143 0.000 0.204 186 E C 2.287 178.902 176.600 0.025 0.000 1.025 186 E CA 3.085 59.530 56.400 0.075 0.000 0.835 186 E CB -0.170 29.555 29.700 0.041 0.000 0.764 186 E HN -0.736 7.616 8.360 -0.013 0.000 0.457 187 D N -0.148 120.232 120.400 -0.033 0.000 2.160 187 D HA -0.335 4.244 4.640 -0.101 0.000 0.189 187 D C 2.367 178.597 176.300 -0.117 0.000 1.003 187 D CA 3.293 57.251 54.000 -0.071 0.000 0.846 187 D CB -0.007 40.772 40.800 -0.034 0.000 0.949 187 D HN 0.020 8.269 8.370 -0.037 0.100 0.446 188 A N -1.154 121.552 122.820 -0.190 0.000 1.940 188 A HA -0.271 3.940 4.320 -0.182 0.000 0.221 188 A C 0.873 178.094 177.584 -0.604 0.000 1.190 188 A CA 2.447 54.194 52.037 -0.484 0.000 0.647 188 A CB -0.165 18.148 19.000 -1.147 0.000 0.821 188 A HN -0.157 7.734 8.150 -0.152 0.168 0.457 189 F N -5.668 114.226 119.950 -0.094 0.000 2.708 189 F HA 0.129 4.657 4.527 0.001 0.000 0.300 189 F C -0.248 175.493 175.800 -0.099 0.000 1.118 189 F CA -1.568 56.399 58.000 -0.056 0.000 1.307 189 F CB -0.055 38.911 39.000 -0.056 0.000 0.986 189 F HN -0.673 7.481 8.300 -0.056 0.113 0.522 190 S N 1.032 116.648 115.700 -0.139 0.000 2.906 190 S HA -0.027 4.378 4.470 -0.109 0.000 0.234 190 S C -0.580 173.719 174.600 -0.501 0.000 0.973 190 S CA -0.076 57.935 58.200 -0.315 0.000 1.036 190 S CB -1.016 61.918 63.200 -0.444 0.000 0.798 190 S HN -0.193 7.894 8.310 -0.202 0.102 0.498 191 F N -2.789 117.203 119.950 0.070 0.000 2.856 191 F HA 0.323 4.909 4.527 0.033 -0.039 0.338 191 F C -0.136 175.679 175.800 0.025 0.000 1.100 191 F CA -0.633 57.391 58.000 0.040 0.000 1.150 191 F CB 2.891 41.909 39.000 0.030 0.000 1.101 191 F HN -0.952 7.288 8.300 0.092 0.116 0.548 192 T N -0.537 114.120 114.554 0.173 0.000 2.907 192 T HA 0.283 4.658 4.350 0.040 0.000 0.290 192 T C -1.212 173.439 174.700 -0.081 0.000 1.066 192 T CA -2.880 59.261 62.100 0.070 0.000 1.012 192 T CB 2.310 71.260 68.868 0.137 0.000 1.184 192 T HN -0.661 7.676 8.240 0.162 0.000 0.522 193 S N 0.804 116.357 115.700 -0.245 0.000 2.650 193 S HA 0.255 4.245 4.470 -0.799 0.000 0.240 193 S C 0.288 174.886 174.600 -0.003 0.000 1.007 193 S CA -0.132 57.653 58.200 -0.691 0.000 0.984 193 S CB 0.979 63.358 63.200 -1.368 0.000 0.910 193 S HN 0.253 8.470 8.310 -0.154 0.000 0.509 194 K N 1.211 121.652 120.400 0.069 0.000 2.305 194 K HA -0.011 4.397 4.320 0.146 0.000 0.199 194 K C -1.690 175.052 176.600 0.237 0.000 1.047 194 K CA 0.716 57.091 56.287 0.148 0.000 0.976 194 K CB 0.804 33.353 32.500 0.082 0.000 0.765 194 K HN -0.003 8.178 8.250 0.023 0.083 0.474 195 V N -2.504 117.488 119.914 0.130 0.000 2.444 195 V HA 0.585 4.905 4.120 0.014 -0.191 0.294 195 V C -1.059 174.981 176.094 -0.089 0.000 1.022 195 V CA -1.000 61.252 62.300 -0.079 0.000 0.850 195 V CB 2.055 33.505 31.823 -0.620 0.000 0.992 195 V HN -0.803 7.418 8.190 0.107 0.034 0.426 196 M N 8.657 128.079 119.600 -0.297 0.000 2.364 196 M HA 0.778 5.371 4.480 -0.220 -0.246 0.334 196 M C -1.686 174.482 176.300 -0.221 0.000 1.107 196 M CA -1.722 53.297 55.300 -0.468 0.000 0.988 196 M CB 4.276 36.061 32.600 -1.358 0.000 1.673 196 M HN 0.885 9.026 8.290 -0.249 0.000 0.441 197 T N 2.792 117.295 114.554 -0.084 0.000 2.887 197 T HA 0.896 5.512 4.350 0.109 -0.200 0.288 197 T C -1.074 173.634 174.700 0.013 0.000 1.021 197 T CA -2.129 60.007 62.100 0.060 0.000 1.000 197 T CB 2.591 71.572 68.868 0.187 0.000 1.034 197 T HN 0.131 8.325 8.240 -0.075 0.000 0.467 198 V N 3.668 123.581 119.914 -0.001 0.000 2.524 198 V HA 0.400 4.710 4.120 0.018 -0.179 0.297 198 V C -2.181 173.913 176.094 0.000 0.000 1.035 198 V CA -0.552 61.746 62.300 -0.004 0.000 0.867 198 V CB 3.111 34.924 31.823 -0.017 0.000 1.004 198 V HN 0.925 9.092 8.190 -0.037 0.000 0.426 199 S N 6.290 122.055 115.700 0.107 0.000 2.552 199 S HA 0.521 5.199 4.470 0.107 -0.144 0.314 199 S C -1.844 172.923 174.600 0.279 0.000 1.099 199 S CA -1.913 56.421 58.200 0.224 0.000 1.070 199 S CB 1.534 64.966 63.200 0.386 0.000 0.998 199 S HN 0.220 8.607 8.310 0.130 0.000 0.474 200 L N 7.935 129.282 121.223 0.207 0.000 2.296 200 L HA 0.581 5.026 4.340 -0.107 -0.169 0.286 200 L C -0.904 176.134 176.870 0.280 0.000 1.023 200 L CA -0.706 54.188 54.840 0.090 0.000 0.812 200 L CB 1.237 43.348 42.059 0.086 0.000 1.223 200 L HN -0.010 8.343 8.230 0.206 0.000 0.421 201 H N -1.316 117.943 119.070 0.316 0.000 2.933 201 H HA 0.509 5.321 4.556 0.305 -0.073 0.310 201 H C -2.208 173.369 175.328 0.415 0.000 1.351 201 H CA -2.093 54.161 56.048 0.344 0.000 1.137 201 H CB 2.182 32.142 29.762 0.330 0.000 1.853 201 H HN 0.312 8.318 8.280 -0.457 0.000 0.539 202 K N 0.447 121.118 120.400 0.452 0.000 2.143 202 K HA 0.539 5.329 4.320 0.413 -0.222 0.272 202 K C -1.111 175.771 176.600 0.470 0.000 1.001 202 K CA -1.367 55.112 56.287 0.320 0.000 0.915 202 K CB 2.138 34.513 32.500 -0.208 0.000 1.047 202 K HN 0.156 8.650 8.250 0.405 0.000 0.458 203 F N 6.834 126.887 119.950 0.173 0.000 2.577 203 F HA 0.205 4.913 4.527 0.303 0.000 0.344 203 F C -2.463 173.399 175.800 0.104 0.000 1.145 203 F CA -0.174 57.945 58.000 0.198 0.000 0.996 203 F CB 2.404 41.488 39.000 0.140 0.000 1.248 203 F HN -0.010 8.463 8.300 0.288 0.000 0.447 204 S N 6.795 122.339 115.700 -0.260 0.000 2.543 204 S HA 0.405 4.733 4.470 -0.236 0.000 0.271 204 S C -2.615 171.851 174.600 -0.223 0.000 1.148 204 S CA -2.979 55.093 58.200 -0.212 0.000 0.914 204 S CB 2.164 65.313 63.200 -0.086 0.000 1.096 204 S HN 0.000 8.212 8.310 -0.163 0.000 0.471 205 P HA -0.144 4.149 4.420 -0.211 0.000 0.247 205 P C -0.220 177.058 177.300 -0.036 0.000 1.141 205 P CA 1.443 64.456 63.100 -0.145 0.000 0.858 205 P CB -0.727 30.916 31.700 -0.094 0.000 0.804 206 G N 2.154 110.947 108.800 -0.011 0.000 2.211 206 G HA2 -0.302 3.675 3.960 0.027 0.000 0.201 206 G HA3 -0.302 3.695 3.960 0.060 0.000 0.201 206 G C -1.308 173.672 174.900 0.132 0.000 0.997 206 G CA -0.505 44.626 45.100 0.052 0.000 0.652 206 G HN 0.094 8.349 8.290 -0.058 0.000 0.500 207 F N 2.559 122.503 119.950 -0.009 0.000 2.394 207 F HA 0.211 4.814 4.527 0.126 0.000 0.340 207 F C -1.670 174.206 175.800 0.126 0.000 1.105 207 F CA -0.846 57.202 58.000 0.081 0.000 1.124 207 F CB 1.803 40.832 39.000 0.049 0.000 1.145 207 F HN -0.167 8.071 8.300 0.164 0.159 0.505 208 F N 6.773 126.420 119.950 -0.505 0.000 2.535 208 F HA -0.024 4.409 4.527 -0.157 0.000 0.332 208 F C 0.053 175.832 175.800 -0.034 0.000 1.208 208 F CA -0.996 56.843 58.000 -0.267 0.000 1.330 208 F CB 0.180 38.987 39.000 -0.321 0.000 1.167 208 F HN 0.167 8.076 8.300 -0.651 0.000 0.597 209 P HA -0.123 2.807 4.420 -2.484 0.000 0.219 209 P C -0.527 176.506 177.300 -0.445 0.000 1.146 209 P CA 0.813 63.197 63.100 -1.194 0.000 0.808 209 P CB 0.625 31.743 31.700 -0.970 0.000 0.779 210 G N -2.294 106.415 108.800 -0.151 0.000 2.253 210 G HA2 -0.170 3.853 3.960 -0.068 0.000 0.209 210 G HA3 -0.170 3.725 3.960 -0.107 0.000 0.209 210 G C -1.021 173.906 174.900 0.045 0.000 0.997 210 G CA -0.196 44.862 45.100 -0.069 0.000 0.640 210 G HN -0.671 7.548 8.290 -0.048 0.042 0.496 211 T N -1.933 112.635 114.554 0.022 0.000 2.902 211 T HA -0.030 4.360 4.350 0.067 0.000 0.280 211 T C 0.169 174.699 174.700 -0.285 0.000 0.992 211 T CA -1.481 60.617 62.100 -0.002 0.000 1.015 211 T CB 1.370 70.261 68.868 0.038 0.000 1.044 211 T HN -0.671 7.478 8.240 -0.033 0.072 0.520 212 G N 0.310 108.809 108.800 -0.502 0.000 2.148 212 G HA2 -0.372 3.019 3.960 -0.948 0.000 0.157 212 G HA3 -0.372 2.903 3.960 -1.142 0.000 0.157 212 G C -1.074 173.565 174.900 -0.436 0.000 1.012 212 G CA -0.379 44.251 45.100 -0.783 0.000 0.677 212 G HN -0.114 8.202 8.290 -0.279 -0.193 0.506 213 D N -0.807 119.245 120.400 -0.579 0.000 2.368 213 D HA -0.013 3.621 4.640 -1.676 0.000 0.240 213 D C 1.579 177.563 176.300 -0.528 0.000 1.169 213 D CA -0.987 52.434 54.000 -0.964 0.000 0.906 213 D CB 1.706 42.102 40.800 -0.673 0.000 1.187 213 D HN -0.667 7.696 8.370 -0.314 -0.182 0.435 214 V N 2.469 122.059 119.914 -0.541 0.000 2.568 214 V HA -0.237 3.887 4.120 -0.306 -0.188 0.253 214 V C 0.168 176.026 176.094 -0.394 0.000 1.072 214 V CA 2.524 64.555 62.300 -0.448 0.000 1.084 214 V CB 0.534 32.008 31.823 -0.581 0.000 0.676 214 V HN 0.205 8.015 8.190 -0.632 0.000 0.469 215 S N -5.800 109.665 115.700 -0.392 0.000 2.603 215 S HA -0.163 4.362 4.470 0.091 0.000 0.229 215 S C -0.432 174.138 174.600 -0.049 0.000 0.972 215 S CA 0.900 59.031 58.200 -0.115 0.000 0.935 215 S CB -0.197 62.957 63.200 -0.076 0.000 0.769 215 S HN -0.447 7.579 8.310 -0.428 0.027 0.536 216 D N 3.238 123.571 120.400 -0.113 0.000 2.453 216 D HA 0.111 4.708 4.640 -0.071 0.000 0.223 216 D C -0.461 175.797 176.300 -0.070 0.000 1.183 216 D CA -0.068 53.879 54.000 -0.088 0.000 0.933 216 D CB -0.899 39.830 40.800 -0.118 0.000 1.038 216 D HN -0.417 7.642 8.370 -0.183 0.201 0.513 217 V N -4.344 115.513 119.914 -0.095 0.000 3.483 217 V HA 0.429 4.765 4.120 -0.072 -0.259 0.301 217 V C -0.508 175.486 176.094 -0.166 0.000 1.389 217 V CA -1.683 60.532 62.300 -0.142 0.000 1.101 217 V CB 1.376 33.031 31.823 -0.280 0.000 0.971 217 V HN -0.675 7.454 8.190 -0.103 0.000 0.434 218 G N -1.626 107.092 108.800 -0.136 0.000 2.462 218 G HA2 -0.207 3.666 3.960 -0.145 0.000 0.685 218 G HA3 -0.207 3.899 3.960 -0.093 -0.202 0.685 218 G C -1.665 173.145 174.900 -0.150 0.000 1.295 218 G CA -0.746 44.273 45.100 -0.135 0.000 0.941 218 G HN -0.810 7.410 8.290 -0.117 0.000 0.554 219 L N -1.448 119.675 121.223 -0.167 0.000 2.211 219 L HA 0.434 4.776 4.340 0.004 0.000 0.259 219 L C 0.990 177.951 176.870 0.152 0.000 1.031 219 L CA -1.425 53.398 54.840 -0.030 0.000 0.877 219 L CB 2.446 44.456 42.059 -0.082 0.000 1.457 219 L HN 0.447 8.533 8.230 -0.240 0.000 0.466 220 G N -0.944 108.029 108.800 0.288 0.000 2.787 220 G HA2 -0.477 3.595 3.960 0.186 0.000 0.374 220 G HA3 -0.477 3.680 3.960 0.328 0.000 0.374 220 G C 1.059 176.076 174.900 0.196 0.000 1.003 220 G CA 2.498 47.754 45.100 0.260 0.000 0.833 220 G HN 0.271 8.738 8.290 0.295 0.000 0.824 221 K N 5.665 126.181 120.400 0.193 0.000 2.367 221 K HA 0.034 4.428 4.320 0.122 0.000 0.194 221 K C 0.799 177.433 176.600 0.057 0.000 1.027 221 K CA -0.088 56.264 56.287 0.110 0.000 1.075 221 K CB 0.189 32.724 32.500 0.059 0.000 0.845 221 K HN 0.185 8.590 8.250 0.257 0.000 0.529 222 G N 1.006 109.872 108.800 0.111 0.000 4.464 222 G HA2 0.266 4.263 3.960 -0.032 0.000 0.297 222 G HA3 0.266 4.341 3.960 0.055 -0.082 0.297 222 G C -2.631 172.326 174.900 0.095 0.000 1.342 222 G CA -0.826 44.310 45.100 0.060 0.000 1.335 222 G HN -0.081 8.270 8.290 0.193 0.055 0.609 223 R N 0.935 121.549 120.500 0.190 0.000 2.534 223 R HA 0.240 4.575 4.340 -0.105 -0.058 0.301 223 R C -1.028 175.431 176.300 0.265 0.000 0.961 223 R CA -1.117 55.004 56.100 0.035 0.000 0.871 223 R CB 1.787 32.098 30.300 0.018 0.000 1.170 223 R HN -0.775 7.554 8.270 0.249 0.090 0.446 224 Y N -2.615 117.813 120.300 0.213 0.000 4.936 224 Y HA -0.366 4.197 4.550 0.022 0.000 0.266 224 Y C -1.738 174.121 175.900 -0.069 0.000 0.909 224 Y CA 1.921 60.065 58.100 0.074 0.000 1.828 224 Y CB -2.145 36.364 38.460 0.082 0.000 1.283 224 Y HN 0.945 8.887 8.280 -0.355 0.124 0.511 225 Y N -4.425 115.913 120.300 0.064 0.000 2.681 225 Y HA 0.103 4.627 4.550 -0.042 0.000 0.267 225 Y C -1.717 174.142 175.900 -0.069 0.000 1.166 225 Y CA -0.709 57.385 58.100 -0.010 0.000 1.209 225 Y CB 0.295 38.778 38.460 0.039 0.000 1.161 225 Y HN -0.627 7.773 8.280 0.347 0.088 0.534 226 S N 0.826 116.550 115.700 0.040 0.000 2.733 226 S HA 0.571 5.059 4.470 0.029 0.000 0.294 226 S C -1.518 173.086 174.600 0.007 0.000 1.149 226 S CA -0.804 57.410 58.200 0.024 0.000 1.034 226 S CB 2.374 65.588 63.200 0.022 0.000 1.015 226 S HN -0.633 7.608 8.310 0.027 0.086 0.486 227 V N 5.615 125.537 119.914 0.012 0.000 2.555 227 V HA 0.196 4.318 4.120 0.003 0.000 0.302 227 V C -1.644 174.481 176.094 0.051 0.000 1.038 227 V CA -1.362 60.944 62.300 0.009 0.000 0.887 227 V CB 2.837 34.648 31.823 -0.021 0.000 0.991 227 V HN 0.859 8.949 8.190 0.017 0.110 0.434 228 N N 5.519 124.234 118.700 0.025 0.000 2.371 228 N HA 0.460 5.510 4.740 0.205 -0.188 0.291 228 N C -1.525 173.931 175.510 -0.091 0.000 1.053 228 N CA -0.545 52.555 53.050 0.083 0.000 0.870 228 N CB 3.847 42.394 38.487 0.100 0.000 1.503 228 N HN 0.290 8.659 8.380 -0.017 0.000 0.485 229 V N 4.757 124.559 119.914 -0.186 0.000 2.275 229 V HA 0.295 4.271 4.120 -0.240 0.000 0.272 229 V C -2.421 173.406 176.094 -0.444 0.000 1.028 229 V CA -3.506 58.632 62.300 -0.270 0.000 0.810 229 V CB 0.750 32.450 31.823 -0.205 0.000 1.043 229 V HN 0.804 8.906 8.190 -0.147 0.000 0.453 230 P HA 0.011 4.239 4.420 -0.320 0.000 0.265 230 P C -1.331 175.894 177.300 -0.125 0.000 1.222 230 P CA -0.127 62.812 63.100 -0.268 0.000 0.767 230 P CB -0.311 31.225 31.700 -0.273 0.000 0.801 231 I N 2.402 122.955 120.570 -0.028 0.000 2.957 231 I HA 0.278 4.383 4.170 -0.108 0.000 0.310 231 I C -1.724 174.408 176.117 0.025 0.000 1.063 231 I CA -2.086 59.181 61.300 -0.055 0.000 1.033 231 I CB 3.193 41.126 38.000 -0.112 0.000 1.230 231 I HN 0.506 8.740 8.210 0.039 0.000 0.447 232 Q N 0.148 119.906 119.800 -0.070 0.000 2.385 232 Q HA 0.289 4.646 4.340 0.028 0.000 0.262 232 Q C -1.239 174.730 176.000 -0.052 0.000 1.050 232 Q CA -2.332 53.456 55.803 -0.026 0.000 0.903 232 Q CB 2.218 30.928 28.738 -0.046 0.000 1.325 232 Q HN 0.337 8.664 8.270 -0.151 -0.148 0.485 233 D N -2.521 117.872 120.400 -0.011 0.000 2.368 233 D HA -0.157 4.716 4.640 0.165 -0.134 0.240 233 D C 1.330 177.600 176.300 -0.051 0.000 1.169 233 D CA 2.089 56.103 54.000 0.024 0.000 0.906 233 D CB 0.624 41.428 40.800 0.006 0.000 1.187 233 D HN 0.030 8.384 8.370 -0.027 0.000 0.435 234 G N -1.273 107.510 108.800 -0.030 0.000 2.143 234 G HA2 -0.540 3.401 3.960 -0.030 0.000 0.249 234 G HA3 -0.540 3.546 3.960 -0.055 -0.160 0.249 234 G C -1.090 173.739 174.900 -0.118 0.000 0.981 234 G CA 0.179 45.243 45.100 -0.060 0.000 0.665 234 G HN 0.527 8.846 8.290 0.048 0.000 0.528 235 I N -0.323 120.105 120.570 -0.236 0.000 2.575 235 I HA -0.036 4.179 4.170 -0.158 -0.141 0.285 235 I C -1.818 174.208 176.117 -0.151 0.000 1.085 235 I CA -0.624 60.536 61.300 -0.232 0.000 1.403 235 I CB 1.618 39.386 38.000 -0.387 0.000 1.409 235 I HN -0.804 7.199 8.210 -0.346 0.000 0.557 236 Q N 5.585 125.336 119.800 -0.082 0.000 2.378 236 Q HA 0.404 4.911 4.340 -0.064 -0.205 0.276 236 Q C 0.859 176.858 176.000 -0.001 0.000 1.083 236 Q CA -1.705 54.068 55.803 -0.049 0.000 0.856 236 Q CB 3.661 32.375 28.738 -0.040 0.000 1.383 236 Q HN 0.094 8.321 8.270 -0.071 0.000 0.458 237 D N 0.366 120.764 120.400 -0.004 0.000 2.248 237 D HA -0.502 4.174 4.640 0.059 0.000 0.191 237 D C 1.937 178.295 176.300 0.096 0.000 1.013 237 D CA 4.137 58.160 54.000 0.037 0.000 0.883 237 D CB 0.001 40.791 40.800 -0.016 0.000 0.915 237 D HN 0.591 8.940 8.370 -0.034 0.000 0.448 238 E N -0.520 119.714 120.200 0.055 0.000 2.001 238 E HA -0.317 4.084 4.350 0.086 0.000 0.195 238 E C 1.807 178.449 176.600 0.070 0.000 1.002 238 E CA 2.758 59.197 56.400 0.064 0.000 0.819 238 E CB -1.007 28.707 29.700 0.024 0.000 0.769 238 E HN 0.162 8.508 8.360 0.023 0.028 0.454 239 K N -0.016 120.400 120.400 0.028 0.000 2.057 239 K HA -0.306 3.993 4.320 -0.036 0.000 0.206 239 K C 2.201 178.793 176.600 -0.015 0.000 1.050 239 K CA 2.565 58.842 56.287 -0.016 0.000 0.935 239 K CB -0.056 32.416 32.500 -0.047 0.000 0.715 239 K HN -0.582 7.678 8.250 0.016 0.000 0.439 240 Y N 0.042 120.295 120.300 -0.079 0.000 2.081 240 Y HA -0.524 3.949 4.550 -0.129 0.000 0.280 240 Y C 1.774 177.667 175.900 -0.013 0.000 1.163 240 Y CA 4.162 62.218 58.100 -0.074 0.000 1.135 240 Y CB -0.019 38.411 38.460 -0.051 0.000 0.970 240 Y HN -0.248 8.110 8.280 0.130 0.000 0.498 241 Y N -0.612 119.706 120.300 0.030 0.000 2.181 241 Y HA -0.374 4.131 4.550 -0.076 0.000 0.288 241 Y C 1.957 177.763 175.900 -0.156 0.000 1.146 241 Y CA 2.534 60.598 58.100 -0.060 0.000 1.164 241 Y CB -0.204 38.254 38.460 -0.004 0.000 0.982 241 Y HN -0.464 8.014 8.280 0.330 0.000 0.515 242 Q N -0.892 118.782 119.800 -0.211 0.000 2.112 242 Q HA -0.450 3.647 4.340 -0.405 0.000 0.206 242 Q C 2.730 178.511 176.000 -0.365 0.000 0.987 242 Q CA 3.456 59.076 55.803 -0.305 0.000 0.858 242 Q CB -0.079 28.572 28.738 -0.145 0.000 0.905 242 Q HN -0.480 7.780 8.270 -0.018 0.000 0.420 243 I N 0.256 120.630 120.570 -0.326 0.000 2.163 243 I HA -0.382 3.627 4.170 -0.268 0.000 0.240 243 I C 2.060 177.942 176.117 -0.392 0.000 1.081 243 I CA 3.902 65.004 61.300 -0.330 0.000 1.353 243 I CB -0.067 37.728 38.000 -0.342 0.000 1.054 243 I HN -0.283 7.754 8.210 -0.280 0.005 0.407 244 c N 0.826 119.137 118.600 -0.483 0.000 2.359 244 c HA -0.594 3.764 4.570 -0.354 0.000 0.277 244 c C 1.259 175.063 174.090 -0.477 0.000 1.192 244 c CA 4.366 60.440 56.329 -0.426 0.000 1.759 244 c CB -1.958 40.360 42.510 -0.319 0.000 2.038 244 c HN 0.277 8.143 8.230 -0.518 0.053 0.448 245 E N -0.028 119.696 120.200 -0.793 0.000 2.049 245 E HA -0.519 3.085 4.350 -1.245 0.000 0.198 245 E C 2.130 178.405 176.600 -0.542 0.000 1.007 245 E CA 3.480 59.295 56.400 -0.976 0.000 0.809 245 E CB 0.000 28.949 29.700 -1.252 0.000 0.749 245 E HN 0.257 8.027 8.360 -0.982 0.000 0.450 246 S N -0.326 115.142 115.700 -0.387 0.000 2.353 246 S HA -0.314 4.059 4.470 -0.160 0.000 0.222 246 S C 2.159 176.681 174.600 -0.131 0.000 1.035 246 S CA 3.808 61.885 58.200 -0.204 0.000 1.025 246 S CB -0.217 62.880 63.200 -0.172 0.000 0.902 246 S HN -0.426 7.626 8.310 -0.430 0.000 0.440 247 V N 3.832 123.654 119.914 -0.153 0.000 2.231 247 V HA -0.489 3.593 4.120 -0.064 0.000 0.248 247 V C 1.841 177.933 176.094 -0.003 0.000 1.054 247 V CA 4.843 67.092 62.300 -0.085 0.000 1.015 247 V CB -0.375 31.376 31.823 -0.120 0.000 0.638 247 V HN -0.479 7.583 8.190 -0.213 0.000 0.444 248 L N -2.390 118.839 121.223 0.010 0.000 2.043 248 L HA -0.520 3.981 4.340 0.269 0.000 0.212 248 L C 2.053 179.142 176.870 0.365 0.000 1.075 248 L CA 3.415 58.401 54.840 0.243 0.000 0.752 248 L CB -1.042 41.188 42.059 0.284 0.000 0.891 248 L HN 0.181 8.350 8.230 -0.102 0.000 0.432 249 K N -0.236 120.307 120.400 0.238 0.000 2.009 249 K HA -0.447 4.172 4.320 0.497 0.000 0.210 249 K C 2.389 179.112 176.600 0.205 0.000 1.049 249 K CA 3.376 59.840 56.287 0.294 0.000 0.929 249 K CB -0.269 32.320 32.500 0.148 0.000 0.714 249 K HN 0.136 8.225 8.250 0.045 0.188 0.440 250 E N -1.647 118.614 120.200 0.102 0.000 2.049 250 E HA -0.299 4.079 4.350 0.046 0.000 0.198 250 E C 2.754 179.390 176.600 0.060 0.000 1.007 250 E CA 2.507 58.939 56.400 0.054 0.000 0.809 250 E CB -0.483 29.221 29.700 0.007 0.000 0.749 250 E HN -0.259 8.140 8.360 0.064 0.000 0.450 251 V N 0.581 120.541 119.914 0.077 0.000 2.215 251 V HA -0.467 3.667 4.120 0.023 0.000 0.249 251 V C 2.528 178.681 176.094 0.099 0.000 1.054 251 V CA 4.342 66.684 62.300 0.071 0.000 1.012 251 V CB -0.241 31.630 31.823 0.080 0.000 0.639 251 V HN -0.126 8.113 8.190 0.080 0.000 0.448 252 Y N -0.420 119.852 120.300 -0.046 0.000 2.096 252 Y HA -0.593 3.732 4.550 -0.377 0.000 0.276 252 Y C 2.023 177.830 175.900 -0.154 0.000 1.209 252 Y CA 3.545 61.494 58.100 -0.252 0.000 1.137 252 Y CB -0.197 38.035 38.460 -0.379 0.000 0.956 252 Y HN -0.101 8.333 8.280 0.256 0.000 0.506 253 Q N -5.773 113.924 119.800 -0.172 0.000 2.354 253 Q HA -0.139 3.944 4.340 -0.428 0.000 0.203 253 Q C 0.307 176.222 176.000 -0.141 0.000 0.933 253 Q CA 1.122 56.786 55.803 -0.231 0.000 0.901 253 Q CB 0.542 29.230 28.738 -0.082 0.000 1.007 253 Q HN -0.568 7.712 8.270 0.038 0.012 0.495 254 A N -2.019 120.765 122.820 -0.059 0.000 2.507 254 A HA 0.117 4.407 4.320 -0.050 0.000 0.270 254 A C -1.273 176.337 177.584 0.044 0.000 1.318 254 A CA 0.254 52.273 52.037 -0.029 0.000 0.924 254 A CB 0.632 19.615 19.000 -0.027 0.000 1.061 254 A HN -0.278 7.747 8.150 -0.025 0.110 0.516 255 F N -1.595 118.259 119.950 -0.160 0.000 2.801 255 F HA -0.067 4.420 4.527 -0.068 0.000 0.381 255 F C -1.723 173.987 175.800 -0.150 0.000 0.861 255 F CA 0.358 58.287 58.000 -0.118 0.000 1.039 255 F CB 3.120 42.060 39.000 -0.100 0.000 1.041 255 F HN -0.736 7.424 8.300 -0.055 0.107 0.596 256 N N 2.660 121.160 118.700 -0.332 0.000 2.637 256 N HA -0.317 4.111 4.740 -0.696 -0.107 0.287 256 N C -2.646 172.608 175.510 -0.425 0.000 1.130 256 N CA 0.341 53.101 53.050 -0.484 0.000 0.764 256 N CB -0.507 37.737 38.487 -0.404 0.000 0.935 256 N HN -0.354 7.762 8.380 -0.274 0.099 0.558 257 P HA 0.042 4.340 4.420 -0.203 0.000 0.279 257 P C -1.425 175.838 177.300 -0.062 0.000 1.276 257 P CA -0.122 62.941 63.100 -0.062 0.000 0.801 257 P CB 1.312 33.136 31.700 0.206 0.000 1.127 258 K N -4.152 116.238 120.400 -0.017 0.000 2.474 258 K HA 0.277 4.586 4.320 -0.018 0.000 0.204 258 K C -0.917 175.545 176.600 -0.230 0.000 1.220 258 K CA -0.534 55.737 56.287 -0.026 0.000 0.966 258 K CB 3.081 35.660 32.500 0.131 0.000 1.049 258 K HN 0.246 8.511 8.250 0.025 0.000 0.554 259 A N -2.528 120.164 122.820 -0.214 0.000 2.556 259 A HA 0.579 4.754 4.320 -0.416 -0.104 0.294 259 A C -2.712 174.838 177.584 -0.058 0.000 1.091 259 A CA -1.151 50.675 52.037 -0.351 0.000 0.704 259 A CB 3.432 22.072 19.000 -0.600 0.000 1.300 259 A HN -0.803 7.315 8.150 -0.053 0.000 0.406 260 V N -1.059 118.846 119.914 -0.015 0.000 2.789 260 V HA 0.838 5.256 4.120 0.131 -0.219 0.311 260 V C -1.361 174.772 176.094 0.064 0.000 1.073 260 V CA -1.521 60.838 62.300 0.098 0.000 0.921 260 V CB 3.977 35.919 31.823 0.198 0.000 1.009 260 V HN 0.764 8.907 8.190 -0.079 0.000 0.426 261 V N 5.382 125.368 119.914 0.119 0.000 2.443 261 V HA 0.515 4.854 4.120 0.063 -0.182 0.293 261 V C -2.185 174.010 176.094 0.168 0.000 1.021 261 V CA -0.791 61.595 62.300 0.144 0.000 0.848 261 V CB 2.798 34.741 31.823 0.200 0.000 0.998 261 V HN 0.655 8.941 8.190 0.160 0.000 0.424 262 L N 7.440 128.698 121.223 0.059 0.000 2.341 262 L HA 0.877 5.381 4.340 -0.065 -0.203 0.278 262 L C -2.683 174.177 176.870 -0.017 0.000 1.005 262 L CA -1.993 52.840 54.840 -0.012 0.000 0.818 262 L CB 4.122 46.169 42.059 -0.020 0.000 1.259 262 L HN 0.927 9.168 8.230 0.017 0.000 0.418 263 Q N 5.517 125.298 119.800 -0.030 0.000 2.322 263 Q HA 0.318 4.751 4.340 -0.048 -0.122 0.265 263 Q C -2.466 173.556 176.000 0.036 0.000 0.985 263 Q CA -1.214 54.591 55.803 0.003 0.000 0.849 263 Q CB 3.030 31.828 28.738 0.100 0.000 1.274 263 Q HN 0.463 8.662 8.270 -0.119 0.000 0.449 264 L N 5.921 127.187 121.223 0.072 0.000 3.100 264 L HA 0.352 4.812 4.340 0.199 0.000 0.259 264 L C -0.968 176.127 176.870 0.375 0.000 1.316 264 L CA -1.562 53.414 54.840 0.227 0.000 0.992 264 L CB 0.293 42.545 42.059 0.321 0.000 1.390 264 L HN 0.260 8.372 8.230 -0.009 0.113 0.550 265 G N -0.253 108.698 108.800 0.251 0.000 2.178 265 G HA2 -0.236 4.087 3.960 0.455 0.000 0.244 265 G HA3 -0.236 4.044 3.960 0.152 -0.228 0.244 265 G C -1.241 173.784 174.900 0.208 0.000 1.213 265 G CA 0.306 45.569 45.100 0.271 0.000 0.912 265 G HN -0.339 8.042 8.290 0.152 0.000 0.474 266 A N 6.351 129.227 122.820 0.094 0.000 3.260 266 A HA 0.342 4.631 4.320 -0.052 0.000 0.268 266 A C -0.995 176.454 177.584 -0.224 0.000 1.491 266 A CA -1.678 50.275 52.037 -0.141 0.000 1.181 266 A CB 0.008 18.741 19.000 -0.444 0.000 1.137 266 A HN 0.248 8.413 8.150 0.134 0.066 0.642 267 D N -1.635 118.669 120.400 -0.160 0.000 2.395 267 D HA 0.164 4.843 4.640 -0.206 -0.163 0.213 267 D C 0.442 176.637 176.300 -0.175 0.000 1.110 267 D CA 0.831 54.731 54.000 -0.166 0.000 0.835 267 D CB -0.204 40.569 40.800 -0.045 0.000 0.965 267 D HN -0.470 7.774 8.370 -0.079 0.079 0.505 268 T N -3.983 110.466 114.554 -0.175 0.000 3.014 268 T HA -0.040 4.147 4.350 -0.273 0.000 0.250 268 T C -0.526 174.139 174.700 -0.059 0.000 1.060 268 T CA 0.758 62.764 62.100 -0.156 0.000 1.040 268 T CB 0.756 69.557 68.868 -0.111 0.000 0.971 268 T HN -0.035 8.048 8.240 -0.141 0.072 0.497 269 I N 1.966 122.469 120.570 -0.111 0.000 2.588 269 I HA -0.071 4.115 4.170 -0.110 -0.082 0.283 269 I C 0.324 176.382 176.117 -0.097 0.000 1.119 269 I CA -1.279 59.949 61.300 -0.121 0.000 1.419 269 I CB -0.376 37.519 38.000 -0.175 0.000 1.394 269 I HN -0.715 7.367 8.210 -0.138 0.045 0.562 270 A N 6.345 129.115 122.820 -0.084 0.000 2.462 270 A HA -0.054 4.240 4.320 -0.043 0.000 0.243 270 A C -0.179 177.354 177.584 -0.086 0.000 1.076 270 A CA 1.110 53.107 52.037 -0.067 0.000 0.773 270 A CB 0.664 19.626 19.000 -0.064 0.000 1.010 270 A HN 0.332 8.427 8.150 -0.092 0.000 0.493 271 G N 3.182 111.940 108.800 -0.070 0.000 2.659 271 G HA2 -0.250 3.666 3.960 -0.073 0.000 0.202 271 G HA3 -0.250 3.646 3.960 -0.107 0.000 0.202 271 G C -0.854 174.008 174.900 -0.064 0.000 1.186 271 G CA -0.519 44.532 45.100 -0.081 0.000 0.783 271 G HN 0.462 8.722 8.290 -0.050 0.000 0.521 272 D N 4.447 124.805 120.400 -0.069 0.000 2.703 272 D HA -0.064 4.551 4.640 -0.042 0.000 0.225 272 D C 0.317 176.631 176.300 0.025 0.000 1.119 272 D CA -0.255 53.725 54.000 -0.034 0.000 0.845 272 D CB 0.621 41.389 40.800 -0.053 0.000 1.182 272 D HN -0.555 7.676 8.370 -0.092 0.084 0.493 273 P HA -0.254 4.190 4.420 0.042 0.000 0.219 273 P C 0.564 177.926 177.300 0.104 0.000 1.158 273 P CA 2.028 65.176 63.100 0.079 0.000 0.895 273 P CB 0.057 31.817 31.700 0.099 0.000 0.792 274 M N -5.647 114.052 119.600 0.165 0.000 2.146 274 M HA -0.272 4.349 4.480 0.235 0.000 0.256 274 M C 0.896 177.261 176.300 0.109 0.000 1.075 274 M CA 0.089 55.501 55.300 0.187 0.000 1.082 274 M CB -0.395 32.324 32.600 0.198 0.000 1.355 274 M HN -0.243 8.465 8.290 0.211 -0.291 0.402 275 C N -0.554 118.781 119.300 0.059 0.000 3.200 275 C HA -0.415 4.055 4.460 0.017 0.000 0.263 275 C C -1.141 173.868 174.990 0.030 0.000 1.345 275 C CA 0.833 59.870 59.018 0.032 0.000 2.274 275 C CB -2.010 25.748 27.740 0.030 0.000 1.459 275 C HN 0.132 8.252 8.230 0.053 0.142 0.501 276 S N -0.992 114.722 115.700 0.024 0.000 3.039 276 S HA 0.228 4.818 4.470 0.021 -0.108 0.251 276 S C -1.058 173.686 174.600 0.239 0.000 1.064 276 S CA 1.688 59.911 58.200 0.038 0.000 0.822 276 S CB 2.144 65.267 63.200 -0.129 0.000 0.802 276 S HN 0.123 8.441 8.310 0.012 0.000 0.519 277 F N -0.806 119.092 119.950 -0.087 0.000 2.461 277 F HA 0.064 4.540 4.527 -0.084 0.000 0.332 277 F C -1.338 174.406 175.800 -0.095 0.000 1.073 277 F CA -0.350 57.592 58.000 -0.096 0.000 1.017 277 F CB 2.761 41.682 39.000 -0.132 0.000 1.301 277 F HN -0.596 7.762 8.300 0.097 0.000 0.492 278 N N -0.220 118.529 118.700 0.081 0.000 2.757 278 N HA 0.274 5.013 4.740 -0.003 0.000 0.296 278 N C -1.581 173.905 175.510 -0.040 0.000 1.874 278 N CA -0.843 52.206 53.050 -0.002 0.000 0.885 278 N CB 0.458 38.932 38.487 -0.022 0.000 1.242 278 N HN 0.252 8.652 8.380 0.034 0.000 0.488 279 M N 0.164 119.736 119.600 -0.046 0.000 2.613 279 M HA 0.387 4.951 4.480 -0.096 -0.141 0.301 279 M C -1.032 175.200 176.300 -0.114 0.000 1.205 279 M CA -2.016 53.225 55.300 -0.098 0.000 0.950 279 M CB 3.149 35.660 32.600 -0.150 0.000 1.585 279 M HN 0.308 8.590 8.290 -0.013 0.000 0.490 280 T N -3.816 110.657 114.554 -0.136 0.000 2.903 280 T HA 0.583 4.827 4.350 -0.176 0.000 0.299 280 T C -1.567 173.002 174.700 -0.219 0.000 1.093 280 T CA -2.631 59.362 62.100 -0.179 0.000 1.002 280 T CB 1.278 70.041 68.868 -0.176 0.000 1.127 280 T HN 0.142 8.549 8.240 -0.128 -0.244 0.488 281 P HA -0.200 4.148 4.420 -0.120 0.000 0.218 281 P C 0.608 177.676 177.300 -0.387 0.000 1.146 281 P CA 2.213 65.115 63.100 -0.329 0.000 0.820 281 P CB 0.067 31.474 31.700 -0.487 0.000 0.778 282 V N -3.675 115.921 119.914 -0.531 0.000 2.295 282 V HA -0.381 3.630 4.120 -0.182 0.000 0.246 282 V C 2.353 178.406 176.094 -0.067 0.000 1.049 282 V CA 4.298 66.433 62.300 -0.274 0.000 1.024 282 V CB -0.496 31.176 31.823 -0.253 0.000 0.648 282 V HN -0.446 7.382 8.190 -0.530 0.044 0.447 283 G N -0.694 108.057 108.800 -0.081 0.000 2.480 283 G HA2 -0.321 3.610 3.960 -0.048 0.000 0.216 283 G HA3 -0.321 3.762 3.960 0.001 -0.122 0.216 283 G C 1.508 176.435 174.900 0.045 0.000 1.200 283 G CA 2.302 47.391 45.100 -0.018 0.000 0.782 283 G HN -0.417 7.899 8.290 -0.126 -0.101 0.554 284 I N 1.610 122.214 120.570 0.056 0.000 2.248 284 I HA -0.399 3.888 4.170 0.195 0.000 0.248 284 I C 2.204 178.410 176.117 0.148 0.000 1.107 284 I CA 0.885 62.263 61.300 0.131 0.000 1.373 284 I CB -1.468 36.596 38.000 0.107 0.000 1.055 284 I HN -0.772 7.434 8.210 -0.007 0.000 0.418 285 G N -1.507 107.398 108.800 0.174 0.000 2.422 285 G HA2 -0.342 3.730 3.960 0.187 0.000 0.218 285 G HA3 -0.342 3.870 3.960 0.388 -0.020 0.218 285 G C 0.996 175.921 174.900 0.042 0.000 1.146 285 G CA 2.144 47.368 45.100 0.206 0.000 0.769 285 G HN 0.424 8.593 8.290 0.155 0.214 0.547 286 K N 1.508 121.863 120.400 -0.075 0.000 2.167 286 K HA -0.062 4.144 4.320 -0.189 0.000 0.203 286 K C 2.218 178.725 176.600 -0.155 0.000 1.052 286 K CA 2.749 58.860 56.287 -0.294 0.000 0.956 286 K CB 0.009 32.035 32.500 -0.790 0.000 0.735 286 K HN -0.486 7.604 8.250 -0.064 0.122 0.451 287 c N -0.538 118.086 118.600 0.040 0.000 2.440 287 c HA -0.216 4.646 4.570 0.487 0.000 0.278 287 c C 1.934 176.100 174.090 0.127 0.000 1.295 287 c CA 4.429 60.916 56.329 0.264 0.000 1.738 287 c CB -1.849 40.834 42.510 0.288 0.000 1.987 287 c HN -0.249 7.892 8.230 0.026 0.104 0.492 288 L N 0.451 121.719 121.223 0.075 0.000 2.005 288 L HA -0.364 3.975 4.340 -0.002 0.000 0.207 288 L C 1.169 178.007 176.870 -0.054 0.000 1.072 288 L CA 3.423 58.272 54.840 0.016 0.000 0.744 288 L CB -0.296 41.795 42.059 0.054 0.000 0.895 288 L HN 0.283 8.368 8.230 0.089 0.198 0.433 289 K N -1.425 118.950 120.400 -0.042 0.000 2.044 289 K HA -0.524 3.734 4.320 -0.104 0.000 0.210 289 K C 2.114 178.627 176.600 -0.146 0.000 1.049 289 K CA 3.707 59.944 56.287 -0.085 0.000 0.927 289 K CB -0.411 32.051 32.500 -0.062 0.000 0.713 289 K HN 0.005 8.136 8.250 -0.018 0.108 0.443 290 Y N -1.389 118.807 120.300 -0.174 0.000 2.181 290 Y HA -0.398 4.034 4.550 -0.198 0.000 0.284 290 Y C 1.810 177.277 175.900 -0.722 0.000 1.179 290 Y CA 3.449 61.391 58.100 -0.264 0.000 1.179 290 Y CB 0.008 38.427 38.460 -0.068 0.000 0.973 290 Y HN -0.355 7.991 8.280 0.109 -0.001 0.519 291 I N -3.092 117.084 120.570 -0.658 0.000 2.260 291 I HA -0.505 2.230 4.170 -2.392 0.000 0.237 291 I C 1.691 177.381 176.117 -0.711 0.000 1.075 291 I CA 3.181 63.805 61.300 -1.127 0.000 1.376 291 I CB 0.133 37.794 38.000 -0.565 0.000 1.107 291 I HN -0.709 7.191 8.210 -0.306 0.127 0.420 292 L N -0.669 120.337 121.223 -0.361 0.000 2.085 292 L HA -0.402 3.854 4.340 -0.140 0.000 0.218 292 L C 2.611 179.359 176.870 -0.203 0.000 1.080 292 L CA 3.436 58.152 54.840 -0.206 0.000 0.776 292 L CB -1.332 40.641 42.059 -0.143 0.000 0.891 292 L HN 0.128 8.182 8.230 -0.294 0.000 0.437 293 Q N -1.172 118.448 119.800 -0.299 0.000 2.181 293 Q HA -0.327 3.930 4.340 -0.138 0.000 0.205 293 Q C 1.924 177.851 176.000 -0.122 0.000 0.980 293 Q CA 2.524 58.193 55.803 -0.224 0.000 0.862 293 Q CB -0.896 27.662 28.738 -0.299 0.000 0.905 293 Q HN -0.202 7.826 8.270 -0.380 0.014 0.429 294 W N 0.098 121.225 121.300 -0.289 0.000 2.313 294 W HA -0.239 4.202 4.660 -0.365 0.000 0.293 294 W C 0.136 176.574 176.519 -0.134 0.000 1.216 294 W CA 1.231 58.393 57.345 -0.306 0.000 1.223 294 W CB -0.228 28.997 29.460 -0.392 0.000 1.138 294 W HN 0.147 7.908 8.180 -0.483 0.129 0.535 295 Q N -8.833 111.024 119.800 0.095 0.000 2.501 295 Q HA -0.440 3.913 4.340 0.021 0.000 0.275 295 Q C -1.503 174.534 176.000 0.061 0.000 1.074 295 Q CA 0.673 56.508 55.803 0.053 0.000 0.974 295 Q CB -3.136 25.631 28.738 0.049 0.000 1.307 295 Q HN -0.171 7.984 8.270 0.047 0.144 0.513 296 L N -3.169 118.103 121.223 0.083 0.000 2.358 296 L HA 0.159 4.499 4.340 -0.001 0.000 0.268 296 L C -0.117 176.729 176.870 -0.041 0.000 1.032 296 L CA -1.821 53.034 54.840 0.026 0.000 0.805 296 L CB 1.875 43.981 42.059 0.079 0.000 1.253 296 L HN -0.687 7.596 8.230 0.123 0.020 0.452 297 A N 0.370 123.094 122.820 -0.160 0.000 2.476 297 A HA -0.019 4.399 4.320 -0.092 -0.153 0.275 297 A C -0.955 176.544 177.584 -0.142 0.000 1.133 297 A CA 0.080 52.005 52.037 -0.187 0.000 0.797 297 A CB -0.249 18.499 19.000 -0.419 0.000 1.081 297 A HN 0.680 8.683 8.150 -0.244 0.000 0.510 298 T N 7.488 121.998 114.554 -0.073 0.000 2.823 298 T HA 0.778 5.335 4.350 -0.041 -0.231 0.279 298 T C -1.264 173.398 174.700 -0.065 0.000 0.998 298 T CA -0.430 61.639 62.100 -0.052 0.000 0.994 298 T CB 2.553 71.397 68.868 -0.040 0.000 0.960 298 T HN 0.845 8.930 8.240 -0.059 0.120 0.448 299 L N 6.030 127.217 121.223 -0.060 0.000 2.313 299 L HA 0.549 4.964 4.340 -0.097 -0.134 0.283 299 L C -2.514 174.281 176.870 -0.125 0.000 1.013 299 L CA -1.379 53.412 54.840 -0.082 0.000 0.816 299 L CB 3.018 45.050 42.059 -0.044 0.000 1.236 299 L HN 0.701 8.909 8.230 -0.037 0.000 0.419 300 I N 4.631 125.063 120.570 -0.231 0.000 2.362 300 I HA 0.545 4.721 4.170 -0.252 -0.158 0.289 300 I C -1.336 174.469 176.117 -0.518 0.000 0.994 300 I CA -0.902 60.175 61.300 -0.371 0.000 1.158 300 I CB 1.358 39.086 38.000 -0.454 0.000 1.315 300 I HN 0.535 8.598 8.210 -0.245 0.000 0.451 301 L N 3.451 124.427 121.223 -0.412 0.000 2.256 301 L HA 0.956 5.253 4.340 -0.460 -0.233 0.261 301 L C 0.269 176.884 176.870 -0.424 0.000 1.022 301 L CA -2.603 51.999 54.840 -0.397 0.000 0.828 301 L CB 3.245 45.173 42.059 -0.219 0.000 1.374 301 L HN 0.658 8.717 8.230 -0.285 0.000 0.436 302 G N -2.305 106.220 108.800 -0.459 0.000 2.930 302 G HA2 0.476 4.064 3.960 -0.619 0.000 0.209 302 G HA3 0.476 4.003 3.960 -1.019 -0.178 0.209 302 G C -1.708 173.022 174.900 -0.283 0.000 2.018 302 G CA -1.225 43.516 45.100 -0.599 0.000 0.751 302 G HN 0.288 8.203 8.290 -0.436 0.113 0.770 303 G N 0.113 108.711 108.800 -0.338 0.000 2.295 303 G HA2 -0.218 2.852 3.960 -1.483 0.000 0.195 303 G HA3 -0.218 3.643 3.960 -0.418 -0.152 0.195 303 G C -0.593 174.266 174.900 -0.069 0.000 1.269 303 G CA -0.601 44.146 45.100 -0.587 0.000 1.170 303 G HN -0.748 7.395 8.290 -0.245 0.000 0.511 304 G N -0.787 108.030 108.800 0.028 0.000 2.785 304 G HA2 -0.215 3.809 3.960 0.106 0.000 0.256 304 G HA3 -0.215 3.863 3.960 -0.192 -0.233 0.256 304 G C -1.041 173.654 174.900 -0.343 0.000 1.248 304 G CA 0.431 45.461 45.100 -0.117 0.000 0.914 304 G HN -0.085 8.462 8.290 -0.008 -0.262 0.580 305 G N -1.631 106.598 108.800 -0.952 0.000 2.409 305 G HA2 -0.095 3.666 3.960 -0.561 0.000 0.231 305 G HA3 -0.095 3.522 3.960 -0.571 0.000 0.231 305 G C -0.480 174.130 174.900 -0.483 0.000 3.185 305 G CA -0.349 44.374 45.100 -0.628 0.000 0.941 305 G HN -0.215 6.742 8.290 -2.222 0.000 0.556 306 Y N 0.968 121.237 120.300 -0.051 0.000 2.676 306 Y HA -0.171 4.351 4.550 -0.047 0.000 0.331 306 Y C -0.808 175.036 175.900 -0.093 0.000 1.128 306 Y CA -0.568 57.500 58.100 -0.053 0.000 1.360 306 Y CB -0.388 38.062 38.460 -0.015 0.000 1.176 306 Y HN -0.159 7.833 8.280 -0.769 -0.173 0.518 307 N N 0.307 118.959 118.700 -0.080 0.000 2.711 307 N HA 0.193 4.875 4.740 -0.097 0.000 0.263 307 N C -0.068 175.318 175.510 -0.207 0.000 1.667 307 N CA -0.937 52.034 53.050 -0.132 0.000 0.785 307 N CB 0.175 38.568 38.487 -0.156 0.000 1.231 307 N HN -0.641 7.539 8.380 -0.168 0.099 0.503 308 L N 1.632 122.753 121.223 -0.170 0.000 2.107 308 L HA -0.554 3.669 4.340 -0.194 0.000 0.242 308 L C 1.613 178.313 176.870 -0.283 0.000 1.115 308 L CA 3.616 58.334 54.840 -0.203 0.000 0.842 308 L CB -0.771 41.194 42.059 -0.156 0.000 0.941 308 L HN 0.137 8.303 8.230 -0.106 0.000 0.448 309 A N -2.543 120.058 122.820 -0.365 0.000 1.896 309 A HA -0.454 3.483 4.320 -0.639 0.000 0.220 309 A C 2.435 179.752 177.584 -0.445 0.000 1.206 309 A CA 2.965 54.613 52.037 -0.647 0.000 0.647 309 A CB -1.190 17.199 19.000 -1.017 0.000 0.828 309 A HN 0.370 8.323 8.150 -0.327 0.000 0.455 310 N N -1.624 116.853 118.700 -0.371 0.000 2.106 310 N HA -0.346 4.248 4.740 -0.242 0.000 0.188 310 N C 2.127 177.424 175.510 -0.356 0.000 1.029 310 N CA 2.852 55.724 53.050 -0.297 0.000 0.848 310 N CB -0.017 38.310 38.487 -0.266 0.000 1.007 310 N HN -0.236 7.919 8.380 -0.364 0.007 0.423 311 T N 3.421 117.706 114.554 -0.448 0.000 2.685 311 T HA -0.474 3.371 4.350 -0.841 0.000 0.268 311 T C 1.270 175.523 174.700 -0.745 0.000 1.034 311 T CA 5.394 67.045 62.100 -0.748 0.000 1.149 311 T CB -0.517 67.882 68.868 -0.781 0.000 0.860 311 T HN 0.098 7.994 8.240 -0.391 0.110 0.449 312 A N 0.085 122.653 122.820 -0.421 0.000 1.930 312 A HA -0.313 3.852 4.320 -0.260 0.000 0.217 312 A C 1.788 179.269 177.584 -0.171 0.000 1.175 312 A CA 3.467 55.365 52.037 -0.230 0.000 0.627 312 A CB -0.421 18.557 19.000 -0.037 0.000 0.815 312 A HN 0.257 8.182 8.150 -0.358 0.010 0.443 313 R N -1.530 118.894 120.500 -0.126 0.000 2.081 313 R HA -0.277 4.054 4.340 -0.014 0.000 0.235 313 R C 2.324 178.539 176.300 -0.141 0.000 1.131 313 R CA 3.013 59.072 56.100 -0.069 0.000 0.960 313 R CB -0.376 29.894 30.300 -0.051 0.000 0.856 313 R HN -0.772 7.266 8.270 -0.162 0.135 0.436 314 C N -0.261 118.884 119.300 -0.260 0.000 2.473 314 C HA -0.300 4.093 4.460 -0.111 0.000 0.279 314 C C 1.820 176.723 174.990 -0.146 0.000 1.250 314 C CA 4.826 63.705 59.018 -0.232 0.000 1.713 314 C CB -0.617 26.881 27.740 -0.404 0.000 2.066 314 C HN 0.414 8.240 8.230 -0.339 0.201 0.474 315 W N -2.163 118.853 121.300 -0.473 0.000 2.402 315 W HA -0.148 3.929 4.660 -0.972 0.000 0.286 315 W C 2.299 178.453 176.519 -0.608 0.000 1.221 315 W CA 2.468 59.230 57.345 -0.971 0.000 1.257 315 W CB -1.251 27.185 29.460 -1.706 0.000 1.120 315 W HN 0.545 8.321 8.180 -0.673 0.000 0.551 316 T N 1.712 116.136 114.554 -0.216 0.000 2.821 316 T HA -0.394 3.851 4.350 -0.176 0.000 0.267 316 T C 1.155 175.752 174.700 -0.172 0.000 1.046 316 T CA 5.008 66.989 62.100 -0.198 0.000 1.139 316 T CB -0.233 68.492 68.868 -0.237 0.000 0.871 316 T HN -0.113 7.988 8.240 -0.218 0.008 0.454 317 Y N 2.264 122.433 120.300 -0.218 0.000 2.089 317 Y HA -0.412 4.008 4.550 -0.217 0.000 0.282 317 Y C 1.192 177.044 175.900 -0.080 0.000 1.139 317 Y CA 3.759 61.758 58.100 -0.169 0.000 1.123 317 Y CB 0.039 38.415 38.460 -0.140 0.000 0.980 317 Y HN -0.466 7.718 8.280 -0.008 0.091 0.493 318 L N -2.505 118.706 121.223 -0.021 0.000 2.043 318 L HA -0.519 3.715 4.340 -0.177 0.000 0.212 318 L C 2.457 179.326 176.870 -0.003 0.000 1.075 318 L CA 3.274 58.108 54.840 -0.011 0.000 0.752 318 L CB -0.737 41.478 42.059 0.259 0.000 0.891 318 L HN 0.571 8.804 8.230 0.180 0.105 0.432 319 T N -0.745 113.857 114.554 0.079 0.000 2.897 319 T HA -0.341 4.135 4.350 0.210 0.000 0.271 319 T C 1.922 176.589 174.700 -0.054 0.000 1.084 319 T CA 5.091 67.257 62.100 0.111 0.000 1.123 319 T CB -0.722 68.222 68.868 0.127 0.000 0.865 319 T HN 0.407 8.557 8.240 0.044 0.116 0.496 320 G N 0.900 109.592 108.800 -0.180 0.000 2.411 320 G HA2 -0.121 3.753 3.960 -0.143 0.000 0.213 320 G HA3 -0.121 3.668 3.960 -0.285 0.000 0.213 320 G C 0.796 175.561 174.900 -0.226 0.000 1.166 320 G CA 1.379 46.350 45.100 -0.216 0.000 0.802 320 G HN -0.172 7.793 8.290 -0.235 0.184 0.533 321 V N 3.722 123.435 119.914 -0.334 0.000 2.252 321 V HA -0.507 3.454 4.120 -0.265 0.000 0.249 321 V C 2.669 178.682 176.094 -0.135 0.000 1.056 321 V CA 4.509 66.648 62.300 -0.268 0.000 1.022 321 V CB -0.067 31.578 31.823 -0.297 0.000 0.641 321 V HN -0.410 7.426 8.190 -0.457 0.080 0.445 322 I N -2.081 118.434 120.570 -0.091 0.000 2.335 322 I HA -0.389 3.749 4.170 -0.052 0.000 0.251 322 I C 0.684 176.773 176.117 -0.047 0.000 1.129 322 I CA 3.066 64.337 61.300 -0.048 0.000 1.402 322 I CB -0.240 37.755 38.000 -0.008 0.000 1.069 322 I HN -0.270 7.886 8.210 -0.090 0.000 0.424 323 L N -4.777 116.412 121.223 -0.056 0.000 2.446 323 L HA -0.072 4.250 4.340 -0.030 0.000 0.219 323 L C 0.039 176.881 176.870 -0.047 0.000 1.116 323 L CA -0.205 54.609 54.840 -0.043 0.000 0.844 323 L CB 0.665 42.700 42.059 -0.040 0.000 0.970 323 L HN -0.954 7.086 8.230 -0.073 0.145 0.457 324 G N -2.347 106.413 108.800 -0.066 0.000 2.225 324 G HA2 -0.439 3.480 3.960 -0.069 0.000 0.264 324 G HA3 -0.439 3.495 3.960 -0.044 0.000 0.264 324 G C -0.634 174.236 174.900 -0.051 0.000 1.060 324 G CA 0.486 45.551 45.100 -0.058 0.000 0.833 324 G HN -0.117 7.953 8.290 -0.086 0.168 0.498 325 K N 0.057 120.417 120.400 -0.065 0.000 2.259 325 K HA 0.354 4.659 4.320 -0.026 0.000 0.252 325 K C -0.899 175.666 176.600 -0.057 0.000 0.936 325 K CA -2.301 53.960 56.287 -0.044 0.000 0.810 325 K CB 1.713 34.193 32.500 -0.033 0.000 1.143 325 K HN -0.304 7.880 8.250 -0.091 0.011 0.427 326 T N 2.855 117.397 114.554 -0.021 0.000 2.799 326 T HA 0.036 4.372 4.350 -0.023 0.000 0.286 326 T C -0.387 174.328 174.700 0.024 0.000 0.973 326 T CA 0.071 62.169 62.100 -0.003 0.000 1.035 326 T CB 0.757 69.634 68.868 0.015 0.000 0.932 326 T HN 0.006 8.243 8.240 -0.005 0.000 0.469 327 L N 4.451 125.691 121.223 0.030 0.000 2.344 327 L HA 0.267 4.692 4.340 0.141 0.000 0.272 327 L C 0.242 177.223 176.870 0.185 0.000 1.035 327 L CA -1.262 53.629 54.840 0.085 0.000 0.807 327 L CB 1.176 43.156 42.059 -0.131 0.000 1.237 327 L HN 0.161 8.406 8.230 0.025 0.000 0.442 328 S N 2.018 117.927 115.700 0.349 0.000 2.589 328 S HA -0.006 4.558 4.470 0.155 0.000 0.265 328 S C 0.690 175.465 174.600 0.292 0.000 1.342 328 S CA -0.085 58.267 58.200 0.253 0.000 1.005 328 S CB 0.836 64.129 63.200 0.156 0.000 0.909 328 S HN 0.178 8.798 8.310 0.517 0.000 0.555 329 S N 2.244 118.050 115.700 0.176 0.000 2.554 329 S HA 0.219 4.799 4.470 0.183 0.000 0.226 329 S C -1.327 173.362 174.600 0.148 0.000 0.980 329 S CA 0.088 58.382 58.200 0.156 0.000 0.939 329 S CB 0.166 63.425 63.200 0.097 0.000 0.832 329 S HN 0.481 8.868 8.310 0.128 0.000 0.486 330 E N 2.546 122.819 120.200 0.121 0.000 2.134 330 E HA 0.206 4.640 4.350 0.140 0.000 0.278 330 E C -1.029 175.615 176.600 0.073 0.000 0.959 330 E CA -1.426 55.034 56.400 0.100 0.000 0.783 330 E CB 1.132 30.859 29.700 0.045 0.000 1.095 330 E HN -0.353 8.006 8.360 0.110 0.068 0.399 331 I N 6.869 127.536 120.570 0.163 0.000 2.505 331 I HA -0.069 4.134 4.170 0.054 0.000 0.287 331 I C -1.429 174.792 176.117 0.173 0.000 1.104 331 I CA -3.545 57.829 61.300 0.124 0.000 1.387 331 I CB -1.836 36.209 38.000 0.074 0.000 1.404 331 I HN -0.434 7.909 8.210 0.222 0.000 0.528 332 P HA -0.122 4.226 4.420 -0.120 0.000 0.272 332 P C -1.181 176.180 177.300 0.102 0.000 1.243 332 P CA 0.033 63.091 63.100 -0.070 0.000 0.803 332 P CB 0.836 32.398 31.700 -0.230 0.000 0.974 333 D N -0.227 120.116 120.400 -0.095 0.000 2.468 333 D HA -0.047 4.331 4.640 -0.436 0.000 0.218 333 D C -1.009 175.262 176.300 -0.048 0.000 1.155 333 D CA -0.213 53.642 54.000 -0.243 0.000 0.924 333 D CB -0.575 40.021 40.800 -0.341 0.000 1.029 333 D HN 0.167 8.462 8.370 -0.124 0.000 0.515 334 H N 1.589 120.661 119.070 0.003 0.000 2.710 334 H HA 0.303 4.837 4.556 -0.036 0.000 0.361 334 H C 0.993 176.336 175.328 0.026 0.000 1.175 334 H CA -2.403 53.652 56.048 0.011 0.000 1.206 334 H CB 2.613 32.399 29.762 0.039 0.000 1.750 334 H HN -0.556 7.712 8.280 -0.019 0.000 0.553 335 E N 1.745 121.896 120.200 -0.083 0.000 2.253 335 E HA -0.333 3.852 4.350 -0.274 0.000 0.202 335 E C -0.011 176.276 176.600 -0.521 0.000 1.014 335 E CA 2.763 58.952 56.400 -0.351 0.000 0.823 335 E CB -0.092 29.295 29.700 -0.521 0.000 0.736 335 E HN 0.708 9.090 8.360 0.037 0.000 0.478 336 F N -4.722 115.183 119.950 -0.076 0.000 2.647 336 F HA 0.160 4.731 4.527 0.073 0.000 0.300 336 F C 0.506 176.255 175.800 -0.086 0.000 1.106 336 F CA -1.170 56.845 58.000 0.025 0.000 1.313 336 F CB 0.099 39.292 39.000 0.323 0.000 1.007 336 F HN -0.758 7.515 8.300 0.037 0.049 0.536 337 F N 3.359 122.972 119.950 -0.561 0.000 2.063 337 F HA -0.423 3.900 4.527 -0.339 0.000 0.298 337 F C 1.379 177.346 175.800 0.278 0.000 1.109 337 F CA 4.153 62.005 58.000 -0.247 0.000 1.212 337 F CB 0.129 38.976 39.000 -0.256 0.000 0.973 337 F HN 0.061 7.897 8.300 -0.483 0.174 0.480 338 T N -1.807 112.916 114.554 0.282 0.000 2.918 338 T HA -0.501 4.098 4.350 0.415 0.000 0.271 338 T C 0.847 175.639 174.700 0.154 0.000 1.104 338 T CA 3.354 65.621 62.100 0.280 0.000 1.114 338 T CB -1.092 67.910 68.868 0.223 0.000 0.855 338 T HN 0.151 8.587 8.240 0.326 0.000 0.518 339 A N -0.694 122.207 122.820 0.135 0.000 2.251 339 A HA -0.052 4.220 4.320 -0.081 0.000 0.209 339 A C -0.262 177.119 177.584 -0.339 0.000 1.187 339 A CA 0.605 52.607 52.037 -0.057 0.000 0.823 339 A CB -0.033 18.951 19.000 -0.026 0.000 0.846 339 A HN -0.645 7.582 8.150 0.251 0.074 0.486 340 Y N -1.883 118.192 120.300 -0.376 0.000 2.811 340 Y HA 0.046 4.392 4.550 -0.340 0.000 0.330 340 Y C -0.778 174.480 175.900 -1.070 0.000 1.081 340 Y CA -1.590 56.207 58.100 -0.506 0.000 1.408 340 Y CB -1.368 36.898 38.460 -0.323 0.000 1.235 340 Y HN -0.157 7.993 8.280 0.060 0.166 0.529 341 G N -0.290 107.920 108.800 -0.983 0.000 2.712 341 G HA2 -0.038 2.464 3.960 -2.430 0.000 0.258 341 G HA3 -0.038 3.562 3.960 -0.599 0.000 0.258 341 G C -1.230 173.314 174.900 -0.593 0.000 1.241 341 G CA -1.317 43.107 45.100 -1.128 0.000 0.923 341 G HN -0.294 7.512 8.290 -0.612 0.116 0.548 342 P HA 0.206 4.555 4.420 -0.118 0.000 0.262 342 P C -1.397 175.918 177.300 0.025 0.000 1.304 342 P CA 0.684 63.699 63.100 -0.142 0.000 0.859 342 P CB 0.162 31.850 31.700 -0.020 0.000 1.310 343 D N -1.903 118.433 120.400 -0.107 0.000 2.423 343 D HA -0.036 4.701 4.640 0.161 0.000 0.208 343 D C -0.441 175.967 176.300 0.180 0.000 1.068 343 D CA 0.655 54.700 54.000 0.075 0.000 0.860 343 D CB 0.891 41.696 40.800 0.007 0.000 0.992 343 D HN -0.319 7.775 8.370 -0.277 0.110 0.504 344 Y N -3.570 116.720 120.300 -0.017 0.000 3.001 344 Y HA -0.486 4.179 4.550 -0.054 -0.147 0.207 344 Y C -1.262 174.669 175.900 0.052 0.000 1.231 344 Y CA 0.825 58.906 58.100 -0.033 0.000 1.024 344 Y CB -3.038 35.373 38.460 -0.082 0.000 1.267 344 Y HN -0.056 7.863 8.280 -0.602 0.000 0.501 345 V N -6.916 113.076 119.914 0.130 0.000 3.158 345 V HA 0.762 5.172 4.120 0.155 -0.197 0.311 345 V C -1.010 175.156 176.094 0.120 0.000 1.181 345 V CA -3.645 58.730 62.300 0.125 0.000 1.054 345 V CB 3.144 35.018 31.823 0.085 0.000 1.085 345 V HN -0.666 7.560 8.190 0.061 0.000 0.446 346 L N -0.269 121.026 121.223 0.120 0.000 2.354 346 L HA 0.178 4.594 4.340 0.127 0.000 0.212 346 L C 0.246 177.121 176.870 0.007 0.000 1.091 346 L CA 0.723 55.621 54.840 0.096 0.000 0.828 346 L CB 0.813 42.950 42.059 0.128 0.000 0.973 346 L HN 0.050 8.355 8.230 0.124 0.000 0.461 347 E N -1.630 118.565 120.200 -0.009 0.000 2.408 347 E HA -0.054 4.222 4.350 -0.124 0.000 0.259 347 E C -0.820 175.731 176.600 -0.081 0.000 1.110 347 E CA 1.090 57.447 56.400 -0.072 0.000 0.929 347 E CB 0.524 30.189 29.700 -0.058 0.000 0.971 347 E HN -0.465 7.908 8.360 0.021 0.000 0.438 348 I N 0.128 120.627 120.570 -0.118 0.000 2.569 348 I HA 0.142 4.252 4.170 -0.100 0.000 0.296 348 I C -0.983 175.073 176.117 -0.101 0.000 1.028 348 I CA -1.349 59.882 61.300 -0.115 0.000 1.082 348 I CB 1.913 39.826 38.000 -0.145 0.000 1.264 348 I HN -0.251 7.871 8.210 -0.147 0.000 0.429 349 T N 7.259 121.762 114.554 -0.084 0.000 2.823 349 T HA 0.350 4.658 4.350 -0.070 0.000 0.279 349 T C -2.344 172.315 174.700 -0.067 0.000 0.998 349 T CA -2.321 59.737 62.100 -0.069 0.000 0.994 349 T CB 0.353 69.189 68.868 -0.054 0.000 0.960 349 T HN 0.027 8.217 8.240 -0.083 0.000 0.448 350 P HA 0.049 4.474 4.420 -0.060 -0.041 0.271 350 P C -0.968 176.305 177.300 -0.045 0.000 1.218 350 P CA -0.336 62.732 63.100 -0.054 0.000 0.780 350 P CB 0.532 32.202 31.700 -0.050 0.000 0.901 351 S N 1.608 117.284 115.700 -0.040 0.000 2.608 351 S HA 0.018 4.466 4.470 -0.036 0.000 0.261 351 S C -0.232 174.352 174.600 -0.028 0.000 1.314 351 S CA 0.021 58.201 58.200 -0.033 0.000 0.992 351 S CB 0.471 63.654 63.200 -0.028 0.000 0.935 351 S HN 0.378 8.985 8.310 -0.040 -0.321 0.564 352 C N 3.343 122.629 119.300 -0.024 0.000 2.298 352 C HA 0.062 4.509 4.460 -0.022 0.000 0.451 352 C C -1.280 173.699 174.990 -0.018 0.000 1.028 352 C CA -0.831 58.175 59.018 -0.021 0.000 1.324 352 C CB -1.914 25.815 27.740 -0.018 0.000 1.534 352 C HN 0.205 8.421 8.230 -0.024 0.000 0.528 353 R N 6.493 126.981 120.500 -0.019 0.000 2.686 353 R HA 0.431 4.763 4.340 -0.014 0.000 0.283 353 R C -2.148 174.140 176.300 -0.020 0.000 0.978 353 R CA -3.077 53.013 56.100 -0.016 0.000 0.897 353 R CB 1.482 31.774 30.300 -0.013 0.000 1.192 353 R HN -0.473 7.742 8.270 -0.022 0.042 0.457 354 P HA -0.002 4.403 4.420 -0.024 0.000 0.270 354 P C -1.955 175.325 177.300 -0.033 0.000 1.223 354 P CA -0.322 62.764 63.100 -0.024 0.000 0.785 354 P CB 0.828 32.517 31.700 -0.019 0.000 0.923 355 D N 0.780 121.156 120.400 -0.040 0.000 2.280 355 D HA 0.053 4.776 4.640 -0.070 -0.125 0.236 355 D C 0.044 176.311 176.300 -0.054 0.000 1.082 355 D CA -0.547 53.417 54.000 -0.059 0.000 0.834 355 D CB 1.035 41.797 40.800 -0.062 0.000 1.100 355 D HN 0.070 8.420 8.370 -0.035 0.000 0.486 356 R N 3.827 124.290 120.500 -0.061 0.000 2.515 356 R HA 0.166 4.482 4.340 -0.040 0.000 0.294 356 R C -0.590 175.669 176.300 -0.067 0.000 1.021 356 R CA -1.667 54.402 56.100 -0.051 0.000 1.081 356 R CB 0.066 30.341 30.300 -0.041 0.000 1.263 356 R HN 0.515 8.742 8.270 -0.071 0.000 0.557 357 N N -0.155 118.494 118.700 -0.086 0.000 2.439 357 N HA 0.061 4.733 4.740 -0.113 0.000 0.249 357 N C -1.042 174.405 175.510 -0.104 0.000 1.003 357 N CA -0.438 52.546 53.050 -0.109 0.000 0.942 357 N CB 0.339 38.747 38.487 -0.133 0.000 1.115 357 N HN -0.300 8.055 8.380 -0.084 -0.026 0.505 358 E N 5.050 125.171 120.200 -0.132 0.000 2.180 358 E HA 0.290 4.604 4.350 -0.060 0.000 0.283 358 E C -0.560 175.906 176.600 -0.222 0.000 1.061 358 E CA -2.547 53.764 56.400 -0.148 0.000 0.861 358 E CB 0.587 30.126 29.700 -0.268 0.000 1.056 358 E HN 0.226 8.499 8.360 -0.145 0.000 0.407 359 P HA -0.196 4.167 4.420 -0.095 0.000 0.223 359 P C 0.325 177.588 177.300 -0.061 0.000 1.144 359 P CA 2.185 65.243 63.100 -0.071 0.000 0.783 359 P CB 0.086 31.779 31.700 -0.013 0.000 0.771 360 H N -3.693 115.357 119.070 -0.034 0.000 2.431 360 H HA 0.029 4.567 4.556 -0.031 0.000 0.295 360 H C 1.928 177.237 175.328 -0.032 0.000 1.038 360 H CA 2.395 58.425 56.048 -0.030 0.000 1.360 360 H CB -0.902 28.847 29.762 -0.021 0.000 1.433 360 H HN 0.023 8.124 8.280 -0.126 0.103 0.536 361 R N 1.156 121.243 120.500 -0.688 0.000 2.096 361 R HA -0.312 4.061 4.340 -0.169 -0.134 0.240 361 R C 2.059 178.252 176.300 -0.179 0.000 1.139 361 R CA 2.666 58.564 56.100 -0.336 0.000 0.952 361 R CB -1.120 28.966 30.300 -0.357 0.000 0.854 361 R HN -0.634 6.832 8.270 -1.341 0.000 0.436 362 I N -2.548 117.908 120.570 -0.190 0.000 2.248 362 I HA -0.395 3.687 4.170 -0.147 0.000 0.248 362 I C 1.816 177.873 176.117 -0.100 0.000 1.107 362 I CA 3.128 64.343 61.300 -0.142 0.000 1.373 362 I CB -1.482 36.434 38.000 -0.141 0.000 1.055 362 I HN -0.573 7.491 8.210 -0.245 -0.001 0.418 363 Q N -0.514 119.244 119.800 -0.070 0.000 2.119 363 Q HA -0.335 3.979 4.340 -0.044 0.000 0.201 363 Q C 2.397 178.390 176.000 -0.011 0.000 0.972 363 Q CA 2.983 58.767 55.803 -0.031 0.000 0.847 363 Q CB -0.644 28.096 28.738 0.004 0.000 0.903 363 Q HN -0.370 7.721 8.270 -0.078 0.132 0.433 364 Q N 0.397 120.195 119.800 -0.004 0.000 2.050 364 Q HA -0.345 4.022 4.340 0.044 0.000 0.202 364 Q C 2.657 178.669 176.000 0.020 0.000 0.980 364 Q CA 3.420 59.238 55.803 0.024 0.000 0.840 364 Q CB -0.081 28.673 28.738 0.027 0.000 0.898 364 Q HN 0.110 8.249 8.270 -0.019 0.119 0.424 365 I N 0.367 120.912 120.570 -0.042 0.000 2.113 365 I HA -0.557 3.565 4.170 -0.081 0.000 0.238 365 I C 1.684 177.791 176.117 -0.017 0.000 1.070 365 I CA 4.320 65.579 61.300 -0.069 0.000 1.332 365 I CB -0.123 37.792 38.000 -0.142 0.000 1.044 365 I HN 0.157 8.326 8.210 -0.068 0.000 0.402 366 L N -1.643 119.553 121.223 -0.045 0.000 2.051 366 L HA -0.583 3.725 4.340 -0.053 0.000 0.214 366 L C 2.152 179.019 176.870 -0.006 0.000 1.076 366 L CA 3.686 58.500 54.840 -0.042 0.000 0.758 366 L CB -0.941 41.079 42.059 -0.064 0.000 0.890 366 L HN 0.343 8.533 8.230 -0.067 0.000 0.433 367 N N -0.945 117.762 118.700 0.011 0.000 2.025 367 N HA -0.369 4.367 4.740 -0.007 0.000 0.194 367 N C 2.062 177.594 175.510 0.037 0.000 1.044 367 N CA 2.926 55.986 53.050 0.016 0.000 0.851 367 N CB -0.598 37.903 38.487 0.025 0.000 1.036 367 N HN -0.213 8.163 8.380 0.006 0.008 0.422 368 Y N 1.611 121.878 120.300 -0.055 0.000 2.030 368 Y HA -0.506 4.017 4.550 -0.046 0.000 0.272 368 Y C 2.068 177.927 175.900 -0.067 0.000 1.185 368 Y CA 3.911 61.979 58.100 -0.054 0.000 1.120 368 Y CB 0.132 38.559 38.460 -0.055 0.000 0.955 368 Y HN -0.212 8.170 8.280 0.168 0.000 0.495 369 I N -1.804 118.888 120.570 0.203 0.000 2.091 369 I HA -0.673 3.768 4.170 0.146 -0.184 0.239 369 I C 2.171 178.280 176.117 -0.014 0.000 1.061 369 I CA 4.138 65.492 61.300 0.089 0.000 1.317 369 I CB -0.125 37.892 38.000 0.029 0.000 1.031 369 I HN 0.235 8.570 8.210 0.208 0.000 0.401 370 K N -1.499 118.882 120.400 -0.031 0.000 2.173 370 K HA -0.472 3.813 4.320 -0.058 0.000 0.207 370 K C 2.876 179.408 176.600 -0.114 0.000 1.046 370 K CA 3.418 59.668 56.287 -0.061 0.000 0.929 370 K CB -0.560 31.912 32.500 -0.047 0.000 0.720 370 K HN -0.019 8.224 8.250 -0.012 0.000 0.453 371 G N -2.005 106.705 108.800 -0.149 0.000 2.434 371 G HA2 -0.247 3.591 3.960 -0.203 0.000 0.214 371 G HA3 -0.247 3.561 3.960 -0.280 -0.016 0.214 371 G C 1.393 176.041 174.900 -0.420 0.000 1.202 371 G CA 1.475 46.423 45.100 -0.253 0.000 0.788 371 G HN -0.054 8.038 8.290 -0.113 0.130 0.539 372 N N 3.739 122.231 118.700 -0.347 0.000 2.091 372 N HA -0.413 4.050 4.740 -0.462 0.000 0.193 372 N C 2.633 177.976 175.510 -0.278 0.000 1.021 372 N CA 2.808 55.702 53.050 -0.261 0.000 0.862 372 N CB -0.109 38.423 38.487 0.075 0.000 1.018 372 N HN 0.066 8.294 8.380 -0.255 0.000 0.429 373 L N -1.513 119.600 121.223 -0.183 0.000 2.201 373 L HA -0.196 4.064 4.340 -0.134 0.000 0.212 373 L C 1.740 178.522 176.870 -0.147 0.000 1.105 373 L CA 2.434 57.189 54.840 -0.141 0.000 0.775 373 L CB -0.486 41.517 42.059 -0.092 0.000 0.913 373 L HN 0.552 8.592 8.230 -0.152 0.099 0.440 374 K N -2.506 117.780 120.400 -0.191 0.000 2.442 374 K HA -0.193 4.096 4.320 -0.052 0.000 0.198 374 K C 0.795 177.420 176.600 0.042 0.000 1.044 374 K CA 1.454 57.695 56.287 -0.077 0.000 0.948 374 K CB -0.685 31.782 32.500 -0.055 0.000 0.762 374 K HN 0.040 7.964 8.250 -0.261 0.169 0.472 375 H N -3.297 115.629 119.070 -0.241 0.000 2.520 375 H HA 0.097 4.521 4.556 -0.220 0.000 0.284 375 H C -0.723 174.535 175.328 -0.117 0.000 1.037 375 H CA -0.791 55.082 56.048 -0.291 0.000 1.168 375 H CB 0.822 30.103 29.762 -0.803 0.000 1.497 375 H HN -0.541 7.368 8.280 -0.286 0.199 0.547 376 V N 1.549 121.448 119.914 -0.025 0.000 2.370 376 V HA -0.133 3.949 4.120 -0.064 0.000 0.283 376 V C -1.402 174.715 176.094 0.037 0.000 1.023 376 V CA -0.276 61.955 62.300 -0.114 0.000 0.857 376 V CB 0.599 32.204 31.823 -0.365 0.000 0.985 376 V HN -0.294 7.679 8.190 -0.053 0.185 0.443 377 V N 0.000 120.027 119.914 0.188 0.000 2.409 377 V HA 0.000 4.155 4.120 0.058 0.000 0.244 377 V CA 0.000 62.378 62.300 0.129 0.000 1.235 377 V CB 0.000 31.887 31.823 0.108 0.000 1.184 377 V HN 0.000 8.430 8.190 0.400 0.000 0.556