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 3d1i_1_B DATA FIRST_RESID 5 DATA SEQUENCE NLKPVDAMQC FDCHTQIEDM HTVGKHATVN CVHCHDATEH VETASSRRMG DATA SEQUENCE ERPVTRMDLE ACATCHTAQF NSFVEVRHES HPRLEKATPT SRSPMFDKLI DATA SEQUENCE AGHGFAFEHA EPRSHAFMLV DHFVVDRAYG GRFQFKNWQK VTDGMGAVRG DATA SEQUENCE AWTVLTDADP ESSDQRRFLS QTATAANPVC LNCKTQDHIL DWAYMGDEHE DATA SEQUENCE AAKWSRTSEV VEFARDLNHP LNCFMCHDPH SAGPRVVRDG LINAVVDRGL DATA SEQUENCE GTYPHDPVKS EQQGMTKVTF QRGREDFRAI GLLDTADSNV MCAQCHVEYN DATA SEQUENCE CNPGYQLSDG SRVGMDDRRA NHFFWANVFD YKEAAQEIDF FDFRHATTGA DATA SEQUENCE ALPKLQHPEA ETFWGSVHER NGVACADCHM PKVQLENGKV YTSHSQRTPR DATA SEQUENCE DMMGQACLNC HAEWTEDQAL YAIDYIKNYT HGKIVKSEYW LAKMIDLFPV DATA SEQUENCE AKRAGVSEDV LNQARELHYD AHLYWEWWTA ENSVGFHNPD QARESLMTSI DATA SEQUENCE SKSKEAVSLL NDAIDAQVA 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 5 N HA 0.000 4.712 4.740 -0.047 0.000 0.220 5 N C 0.000 175.473 175.510 -0.062 0.000 1.280 5 N CA 0.000 53.023 53.050 -0.045 0.000 0.885 5 N CB 0.000 38.465 38.487 -0.036 0.000 1.341 6 L N 0.838 122.008 121.223 -0.088 0.000 2.456 6 L HA -0.011 4.258 4.340 -0.119 0.000 0.272 6 L C -0.602 176.204 176.870 -0.106 0.000 1.189 6 L CA 0.272 55.034 54.840 -0.129 0.000 0.846 6 L CB 0.439 42.353 42.059 -0.241 0.000 1.111 6 L HN 0.025 8.201 8.230 -0.089 0.000 0.475 7 K N 2.820 123.161 120.400 -0.099 0.000 2.376 7 K HA 0.394 4.676 4.320 -0.063 0.000 0.257 7 K C -2.325 174.228 176.600 -0.079 0.000 0.939 7 K CA -2.478 53.765 56.287 -0.073 0.000 0.809 7 K CB 1.492 33.961 32.500 -0.052 0.000 1.121 7 K HN 0.115 8.304 8.250 -0.101 0.000 0.425 8 P HA 0.018 4.533 4.420 -0.074 -0.139 0.274 8 P C -1.347 175.923 177.300 -0.050 0.000 1.231 8 P CA -0.548 62.518 63.100 -0.056 0.000 0.790 8 P CB 0.833 32.517 31.700 -0.027 0.000 0.951 9 V N -2.556 117.325 119.914 -0.055 0.000 3.093 9 V HA 0.304 4.393 4.120 -0.052 0.000 0.320 9 V C -1.285 174.763 176.094 -0.076 0.000 1.093 9 V CA -3.081 59.183 62.300 -0.060 0.000 1.016 9 V CB 2.087 33.874 31.823 -0.060 0.000 1.096 9 V HN -0.133 8.322 8.190 -0.056 -0.299 0.452 10 D N 0.573 120.923 120.400 -0.083 0.000 2.374 10 D HA 0.018 4.605 4.640 -0.088 0.000 0.240 10 D C 0.165 176.352 176.300 -0.188 0.000 1.229 10 D CA -0.671 53.268 54.000 -0.102 0.000 0.895 10 D CB 0.425 41.181 40.800 -0.072 0.000 1.046 10 D HN 0.190 8.516 8.370 -0.073 0.000 0.498 11 A N 7.770 130.421 122.820 -0.281 0.000 2.019 11 A HA -0.213 3.752 4.320 -0.592 0.000 0.219 11 A C 1.109 178.218 177.584 -0.791 0.000 1.164 11 A CA 2.435 54.096 52.037 -0.627 0.000 0.644 11 A CB 0.016 18.575 19.000 -0.735 0.000 0.805 11 A HN 0.434 8.453 8.150 -0.218 0.000 0.449 12 M N -2.727 116.669 119.600 -0.341 0.000 2.159 12 M HA -0.370 4.136 4.480 0.043 0.000 0.263 12 M C 1.894 178.154 176.300 -0.068 0.000 1.063 12 M CA 1.685 56.931 55.300 -0.089 0.000 1.110 12 M CB -1.481 31.133 32.600 0.024 0.000 1.374 12 M HN -0.456 7.881 8.290 -0.221 -0.180 0.411 13 Q N -0.292 119.440 119.800 -0.113 0.000 2.084 13 Q HA -0.342 3.970 4.340 -0.047 0.000 0.202 13 Q C 2.075 178.029 176.000 -0.078 0.000 0.978 13 Q CA 3.127 58.883 55.803 -0.079 0.000 0.844 13 Q CB 0.010 28.699 28.738 -0.082 0.000 0.898 13 Q HN -0.484 7.803 8.270 -0.135 -0.098 0.426 14 C N -1.302 117.911 119.300 -0.145 0.000 2.429 14 C HA -0.251 4.231 4.460 0.037 0.000 0.277 14 C C 2.694 177.751 174.990 0.110 0.000 1.262 14 C CA 3.256 62.252 59.018 -0.037 0.000 1.733 14 C CB -1.534 26.113 27.740 -0.154 0.000 2.010 14 C HN -0.579 7.431 8.230 -0.236 0.078 0.483 15 F N -1.422 118.548 119.950 0.032 0.000 2.333 15 F HA -0.233 4.335 4.527 0.068 0.000 0.300 15 F C 1.604 177.408 175.800 0.007 0.000 1.083 15 F CA -0.109 57.912 58.000 0.035 0.000 1.395 15 F CB -1.394 37.619 39.000 0.023 0.000 1.056 15 F HN 0.022 8.156 8.300 -0.139 0.082 0.529 16 D N -0.914 119.577 120.400 0.152 0.000 2.149 16 D HA -0.255 4.423 4.640 0.065 0.000 0.198 16 D C 1.004 177.301 176.300 -0.006 0.000 0.990 16 D CA 2.623 56.654 54.000 0.052 0.000 0.839 16 D CB 0.239 41.043 40.800 0.007 0.000 0.948 16 D HN -0.559 7.855 8.370 0.119 0.028 0.460 17 C N -4.304 114.956 119.300 -0.068 0.000 3.070 17 C HA 0.093 4.463 4.460 -0.150 0.000 0.280 17 C C -0.633 174.202 174.990 -0.258 0.000 1.264 17 C CA -0.732 58.158 59.018 -0.213 0.000 1.690 17 C CB -0.039 27.459 27.740 -0.403 0.000 2.049 17 C HN -0.665 7.525 8.230 -0.056 0.006 0.636 18 H N 1.079 120.207 119.070 0.097 0.000 2.317 18 H HA 0.291 4.899 4.556 0.087 0.000 0.231 18 H C 0.196 175.583 175.328 0.099 0.000 1.442 18 H CA -1.425 54.687 56.048 0.107 0.000 1.336 18 H CB -0.459 29.369 29.762 0.111 0.000 1.533 18 H HN -0.673 7.571 8.280 0.154 0.129 0.522 19 T N 2.411 117.040 114.554 0.126 0.000 2.746 19 T HA -0.305 4.054 4.350 0.014 0.000 0.267 19 T C 1.765 176.477 174.700 0.021 0.000 1.039 19 T CA 5.068 67.193 62.100 0.042 0.000 1.142 19 T CB 0.283 69.159 68.868 0.014 0.000 0.866 19 T HN 0.190 8.486 8.240 0.094 0.000 0.444 20 Q N 0.179 120.022 119.800 0.071 0.000 2.061 20 Q HA -0.319 4.030 4.340 0.014 0.000 0.204 20 Q C 2.090 178.141 176.000 0.085 0.000 0.984 20 Q CA 3.324 59.165 55.803 0.064 0.000 0.846 20 Q CB -0.584 28.208 28.738 0.090 0.000 0.902 20 Q HN 0.198 8.529 8.270 0.102 0.000 0.421 21 I N -2.162 118.471 120.570 0.106 0.000 2.226 21 I HA -0.409 3.773 4.170 0.020 0.000 0.245 21 I C 1.973 178.072 176.117 -0.029 0.000 1.100 21 I CA 1.974 63.289 61.300 0.025 0.000 1.374 21 I CB -1.414 36.535 38.000 -0.085 0.000 1.057 21 I HN -0.272 8.030 8.210 0.153 0.000 0.413 22 E N 1.797 121.853 120.200 -0.239 0.000 2.070 22 E HA -0.514 2.808 4.350 -1.713 0.000 0.197 22 E C 2.208 178.570 176.600 -0.396 0.000 1.004 22 E CA 3.758 59.630 56.400 -0.881 0.000 0.805 22 E CB -0.203 28.981 29.700 -0.860 0.000 0.744 22 E HN -0.081 8.218 8.360 -0.102 0.000 0.451 23 D N -2.042 118.250 120.400 -0.181 0.000 2.182 23 D HA -0.220 4.357 4.640 -0.105 0.000 0.201 23 D C 1.829 178.117 176.300 -0.020 0.000 0.986 23 D CA 2.687 56.635 54.000 -0.087 0.000 0.847 23 D CB -0.286 40.486 40.800 -0.047 0.000 0.942 23 D HN -0.253 8.031 8.370 -0.143 0.000 0.467 24 M N -1.921 117.701 119.600 0.036 0.000 2.216 24 M HA -0.150 4.380 4.480 0.084 0.000 0.264 24 M C 1.550 177.939 176.300 0.148 0.000 1.080 24 M CA 3.537 58.904 55.300 0.111 0.000 1.153 24 M CB 0.752 33.466 32.600 0.189 0.000 1.356 24 M HN -0.766 7.434 8.290 0.035 0.112 0.432 25 H N 0.208 119.331 119.070 0.087 0.000 2.357 25 H HA -0.108 4.814 4.556 0.227 -0.230 0.301 25 H C 2.599 177.998 175.328 0.117 0.000 1.082 25 H CA 3.930 60.083 56.048 0.175 0.000 1.342 25 H CB 1.430 31.373 29.762 0.302 0.000 1.389 25 H HN 0.294 8.718 8.280 0.241 0.000 0.511 26 T N -3.717 110.912 114.554 0.125 0.000 2.962 26 T HA -0.142 4.307 4.350 0.164 0.000 0.270 26 T C 1.337 176.053 174.700 0.027 0.000 1.088 26 T CA 3.258 65.406 62.100 0.080 0.000 1.127 26 T CB -0.290 68.569 68.868 -0.015 0.000 0.883 26 T HN -0.231 8.033 8.240 0.041 0.000 0.493 27 V N 0.208 120.129 119.914 0.012 0.000 3.263 27 V HA 0.042 4.166 4.120 0.007 0.000 0.248 27 V C 0.556 176.650 176.094 0.001 0.000 1.145 27 V CA 0.760 63.064 62.300 0.007 0.000 1.107 27 V CB 0.930 32.757 31.823 0.006 0.000 0.797 27 V HN -0.743 7.413 8.190 0.018 0.044 0.467 28 G N -1.285 107.511 108.800 -0.007 0.000 2.532 28 G HA2 0.204 4.155 3.960 -0.014 0.000 0.291 28 G HA3 0.204 4.316 3.960 -0.023 -0.165 0.291 28 G C -0.475 174.405 174.900 -0.034 0.000 1.349 28 G CA -0.868 44.220 45.100 -0.021 0.000 1.038 28 G HN -0.883 7.404 8.290 -0.005 0.000 0.518 29 K N -1.182 119.188 120.400 -0.051 0.000 2.505 29 K HA -0.041 4.279 4.320 -0.001 0.000 0.192 29 K C 0.147 176.784 176.600 0.062 0.000 1.025 29 K CA 1.205 57.479 56.287 -0.022 0.000 1.086 29 K CB -0.045 32.430 32.500 -0.041 0.000 0.840 29 K HN -0.026 8.178 8.250 -0.077 0.000 0.514 30 H N -2.668 116.337 119.070 -0.109 0.000 2.528 30 H HA 0.262 4.760 4.556 -0.097 0.000 0.282 30 H C 0.317 175.406 175.328 -0.398 0.000 1.097 30 H CA -1.107 54.845 56.048 -0.159 0.000 1.121 30 H CB 0.103 29.808 29.762 -0.095 0.000 1.590 30 H HN -0.148 8.080 8.280 0.005 0.056 0.553 31 A N 0.142 122.838 122.820 -0.208 0.000 2.024 31 A HA -0.178 3.964 4.320 -0.521 -0.135 0.220 31 A C 0.216 177.793 177.584 -0.011 0.000 1.164 31 A CA 2.691 54.590 52.037 -0.230 0.000 0.643 31 A CB -0.071 18.909 19.000 -0.033 0.000 0.806 31 A HN -0.754 7.279 8.150 -0.097 0.059 0.451 32 T N -7.061 107.503 114.554 0.016 0.000 3.107 32 T HA -0.092 4.325 4.350 0.112 0.000 0.249 32 T C -0.018 174.732 174.700 0.083 0.000 1.096 32 T CA 0.220 62.363 62.100 0.072 0.000 1.012 32 T CB 0.030 68.922 68.868 0.040 0.000 0.977 32 T HN -0.299 7.923 8.240 -0.001 0.017 0.527 33 V N 5.178 125.135 119.914 0.071 0.000 2.368 33 V HA -0.053 4.064 4.120 -0.005 0.000 0.266 33 V C -1.192 175.064 176.094 0.270 0.000 1.045 33 V CA -0.155 62.173 62.300 0.047 0.000 0.899 33 V CB 0.034 31.709 31.823 -0.248 0.000 1.006 33 V HN -0.263 7.770 8.190 0.029 0.174 0.470 34 N N 6.321 125.176 118.700 0.257 0.000 2.508 34 N HA -0.071 4.761 4.740 0.153 0.000 0.264 34 N C 1.265 176.881 175.510 0.176 0.000 1.216 34 N CA 0.678 53.845 53.050 0.194 0.000 0.943 34 N CB 2.153 40.709 38.487 0.116 0.000 1.113 34 N HN 0.218 8.761 8.380 0.271 0.000 0.447 35 C N 2.493 121.835 119.300 0.069 0.000 2.411 35 C HA -0.222 4.344 4.460 0.177 0.000 0.279 35 C C 1.899 176.940 174.990 0.085 0.000 1.288 35 C CA 1.781 60.862 59.018 0.105 0.000 1.764 35 C CB -1.584 26.178 27.740 0.035 0.000 1.974 35 C HN 0.821 9.051 8.230 -0.000 0.000 0.498 36 V N 0.655 120.565 119.914 -0.006 0.000 2.867 36 V HA -0.342 3.968 4.120 -0.035 -0.210 0.260 36 V C 0.743 176.742 176.094 -0.158 0.000 1.099 36 V CA 2.766 65.015 62.300 -0.084 0.000 1.122 36 V CB -0.033 31.702 31.823 -0.146 0.000 0.708 36 V HN -0.680 7.737 8.190 -0.021 -0.240 0.490 37 H N -2.572 116.464 119.070 -0.056 0.000 2.456 37 H HA -0.190 4.314 4.556 -0.086 0.000 0.296 37 H C 0.387 175.637 175.328 -0.130 0.000 1.079 37 H CA 3.311 59.304 56.048 -0.092 0.000 1.322 37 H CB 0.401 30.098 29.762 -0.108 0.000 1.388 37 H HN -0.563 7.690 8.280 0.007 0.031 0.538 38 C N -6.679 112.566 119.300 -0.091 0.000 3.882 38 C HA 0.224 4.566 4.460 -0.196 0.000 0.340 38 C C -1.828 172.909 174.990 -0.422 0.000 1.563 38 C CA -0.251 58.598 59.018 -0.282 0.000 1.870 38 C CB 1.878 29.356 27.740 -0.437 0.000 2.795 38 C HN -0.349 7.812 8.230 -0.071 0.027 0.692 39 H N -0.688 118.369 119.070 -0.023 0.000 2.679 39 H HA 0.876 5.640 4.556 -0.037 -0.231 0.360 39 H C -2.218 173.089 175.328 -0.036 0.000 1.105 39 H CA -1.453 54.574 56.048 -0.035 0.000 1.196 39 H CB 3.479 33.216 29.762 -0.041 0.000 1.636 39 H HN -0.089 8.171 8.280 -0.033 0.000 0.531 40 D N 2.308 122.764 120.400 0.094 0.000 2.460 40 D HA 0.308 4.970 4.640 0.036 0.000 0.232 40 D C -1.393 174.939 176.300 0.054 0.000 1.079 40 D CA -0.831 53.198 54.000 0.048 0.000 0.864 40 D CB 0.915 41.730 40.800 0.025 0.000 1.048 40 D HN -0.062 8.364 8.370 0.094 0.000 0.523 41 A N 6.140 128.995 122.820 0.059 0.000 2.589 41 A HA 0.316 4.694 4.320 0.096 0.000 0.283 41 A C 0.441 178.082 177.584 0.094 0.000 1.187 41 A CA -0.347 51.746 52.037 0.094 0.000 0.957 41 A CB 1.167 20.233 19.000 0.109 0.000 1.175 41 A HN 0.512 8.691 8.150 0.049 0.000 0.532 42 T N 2.125 116.708 114.554 0.049 0.000 2.708 42 T HA -0.462 3.896 4.350 0.013 0.000 0.266 42 T C 1.604 176.322 174.700 0.029 0.000 1.037 42 T CA 5.515 67.630 62.100 0.025 0.000 1.146 42 T CB -0.103 68.770 68.868 0.009 0.000 0.865 42 T HN -0.599 7.848 8.240 0.039 -0.184 0.435 43 E N -1.556 118.670 120.200 0.044 0.000 2.150 43 E HA -0.287 4.230 4.350 0.020 -0.154 0.193 43 E C 1.360 178.000 176.600 0.067 0.000 0.985 43 E CA 2.812 59.237 56.400 0.041 0.000 0.814 43 E CB -0.355 29.369 29.700 0.040 0.000 0.752 43 E HN 0.283 8.670 8.360 0.046 0.000 0.466 44 H N 0.536 119.601 119.070 -0.009 0.000 2.319 44 H HA -0.260 4.411 4.556 -0.008 -0.120 0.299 44 H C 1.950 177.271 175.328 -0.013 0.000 1.092 44 H CA 2.948 58.991 56.048 -0.009 0.000 1.302 44 H CB -0.304 29.455 29.762 -0.006 0.000 1.373 44 H HN -0.308 8.086 8.280 0.190 0.000 0.497 45 V N -1.746 118.098 119.914 -0.116 0.000 2.490 45 V HA -0.450 3.480 4.120 -0.317 0.000 0.250 45 V C 1.039 177.050 176.094 -0.138 0.000 1.061 45 V CA 3.292 65.479 62.300 -0.189 0.000 1.064 45 V CB -0.166 31.603 31.823 -0.090 0.000 0.670 45 V HN -0.251 7.943 8.190 0.006 0.000 0.461 46 E N -3.358 116.796 120.200 -0.077 0.000 2.274 46 E HA -0.146 4.170 4.350 -0.056 0.000 0.194 46 E C 1.017 177.582 176.600 -0.059 0.000 0.996 46 E CA 2.092 58.459 56.400 -0.055 0.000 0.840 46 E CB 0.401 30.084 29.700 -0.028 0.000 0.772 46 E HN -0.592 7.627 8.360 -0.050 0.111 0.491 47 T N -5.939 108.574 114.554 -0.069 0.000 2.958 47 T HA 0.085 4.409 4.350 -0.043 0.000 0.256 47 T C 0.090 174.747 174.700 -0.071 0.000 0.983 47 T CA -0.438 61.633 62.100 -0.050 0.000 0.924 47 T CB 1.857 70.718 68.868 -0.012 0.000 1.136 47 T HN -0.601 7.442 8.240 -0.082 0.147 0.506 48 A N 3.050 125.780 122.820 -0.150 0.000 2.366 48 A HA 0.003 4.374 4.320 -0.083 -0.101 0.249 48 A C -0.758 176.748 177.584 -0.129 0.000 1.084 48 A CA -0.195 51.743 52.037 -0.165 0.000 0.794 48 A CB 0.910 19.664 19.000 -0.410 0.000 1.034 48 A HN -0.239 7.781 8.150 -0.216 0.000 0.491 49 S N 1.307 116.950 115.700 -0.094 0.000 2.751 49 S HA 0.328 4.744 4.470 -0.091 0.000 0.310 49 S C 0.448 174.991 174.600 -0.095 0.000 1.128 49 S CA -1.254 56.896 58.200 -0.084 0.000 0.931 49 S CB 2.369 65.536 63.200 -0.055 0.000 1.177 49 S HN -0.060 8.207 8.310 -0.072 0.000 0.530 50 S N -1.132 114.518 115.700 -0.083 0.000 2.400 50 S HA -0.191 4.207 4.470 -0.119 0.000 0.232 50 S C 1.543 176.101 174.600 -0.069 0.000 1.025 50 S CA 2.350 60.498 58.200 -0.088 0.000 0.993 50 S CB 0.088 63.250 63.200 -0.064 0.000 0.808 50 S HN 0.342 8.609 8.310 -0.072 0.000 0.478 51 R N -3.062 117.411 120.500 -0.046 0.000 2.419 51 R HA 0.169 4.497 4.340 -0.021 0.000 0.235 51 R C -1.305 174.987 176.300 -0.013 0.000 0.899 51 R CA -0.016 56.069 56.100 -0.025 0.000 1.048 51 R CB 1.250 31.539 30.300 -0.019 0.000 1.182 51 R HN -0.687 7.534 8.270 -0.045 0.022 0.544 52 R N -0.665 119.825 120.500 -0.017 0.000 2.562 52 R HA 0.361 4.701 4.340 -0.001 0.000 0.298 52 R C 0.031 176.342 176.300 0.019 0.000 0.961 52 R CA -2.281 53.816 56.100 -0.004 0.000 0.881 52 R CB 1.403 31.696 30.300 -0.012 0.000 1.159 52 R HN -0.269 7.984 8.270 -0.029 0.000 0.450 53 M N 3.327 122.956 119.600 0.049 0.000 2.229 53 M HA -0.278 4.333 4.480 0.220 0.000 0.264 53 M C 0.403 176.802 176.300 0.166 0.000 1.063 53 M CA 2.979 58.362 55.300 0.139 0.000 1.114 53 M CB 0.473 33.122 32.600 0.081 0.000 1.387 53 M HN 0.691 8.998 8.290 0.028 0.000 0.420 54 G N -3.486 105.358 108.800 0.074 0.000 2.552 54 G HA2 -0.488 3.490 3.960 0.030 0.000 0.265 54 G HA3 -0.488 3.606 3.960 0.054 -0.102 0.265 54 G C -0.492 174.462 174.900 0.090 0.000 1.234 54 G CA -0.397 44.740 45.100 0.062 0.000 0.944 54 G HN -0.252 8.063 8.290 0.042 0.000 0.568 55 E N 2.306 122.565 120.200 0.098 0.000 2.392 55 E HA -0.106 4.273 4.350 0.048 0.000 0.264 55 E C -0.704 175.956 176.600 0.101 0.000 1.024 55 E CA -0.183 56.266 56.400 0.081 0.000 0.903 55 E CB 0.942 30.683 29.700 0.069 0.000 0.963 55 E HN -0.171 8.241 8.360 0.087 0.000 0.432 56 R N 2.804 123.318 120.500 0.023 0.000 2.340 56 R HA 0.062 4.340 4.340 -0.103 0.000 0.300 56 R C -1.734 174.520 176.300 -0.076 0.000 1.069 56 R CA -2.171 53.897 56.100 -0.054 0.000 0.984 56 R CB 0.519 30.797 30.300 -0.035 0.000 1.003 56 R HN 0.282 8.562 8.270 0.018 0.000 0.459 57 P HA 0.037 4.518 4.420 -0.037 -0.083 0.274 57 P C -1.614 175.665 177.300 -0.036 0.000 1.237 57 P CA -0.632 62.396 63.100 -0.121 0.000 0.793 57 P CB 1.459 33.005 31.700 -0.258 0.000 0.977 58 V N 1.447 121.374 119.914 0.021 0.000 2.530 58 V HA -0.017 4.129 4.120 0.044 0.000 0.282 58 V C -0.391 175.757 176.094 0.089 0.000 1.048 58 V CA 0.209 62.537 62.300 0.047 0.000 0.997 58 V CB 0.589 32.437 31.823 0.040 0.000 0.987 58 V HN 0.026 8.233 8.190 0.027 0.000 0.477 59 T N 8.600 123.204 114.554 0.084 0.000 2.812 59 T HA 0.458 5.028 4.350 0.046 -0.193 0.282 59 T C -0.799 173.895 174.700 -0.009 0.000 0.990 59 T CA -1.033 61.101 62.100 0.058 0.000 0.960 59 T CB 1.653 70.582 68.868 0.100 0.000 0.948 59 T HN 0.213 8.496 8.240 0.072 0.000 0.438 60 R N 6.964 127.415 120.500 -0.082 0.000 2.316 60 R HA -0.082 4.267 4.340 0.014 0.000 0.314 60 R C -0.556 175.740 176.300 -0.006 0.000 1.069 60 R CA 0.839 56.918 56.100 -0.036 0.000 0.959 60 R CB 0.369 30.628 30.300 -0.068 0.000 0.987 60 R HN 0.655 8.723 8.270 -0.156 0.108 0.446 61 M N 1.512 121.168 119.600 0.094 0.000 2.337 61 M HA 0.078 4.793 4.480 0.391 0.000 0.256 61 M C -1.111 175.204 176.300 0.025 0.000 1.075 61 M CA -2.263 53.187 55.300 0.250 0.000 1.024 61 M CB -0.044 32.776 32.600 0.366 0.000 1.429 61 M HN 0.444 8.803 8.290 0.116 0.000 0.497 62 D N -2.479 117.757 120.400 -0.273 0.000 2.372 62 D HA -0.152 3.608 4.640 -1.467 0.000 0.243 62 D C 1.103 177.228 176.300 -0.292 0.000 1.121 62 D CA -0.214 53.360 54.000 -0.711 0.000 0.898 62 D CB 0.864 41.360 40.800 -0.507 0.000 1.202 62 D HN -0.567 7.712 8.370 -0.152 0.000 0.428 63 L N 0.166 121.255 121.223 -0.223 0.000 2.291 63 L HA -0.156 4.151 4.340 -0.054 0.000 0.214 63 L C 1.964 178.794 176.870 -0.066 0.000 1.120 63 L CA 2.648 57.473 54.840 -0.024 0.000 0.799 63 L CB -0.123 42.038 42.059 0.171 0.000 0.925 63 L HN 0.473 8.544 8.230 -0.265 0.000 0.446 64 E N -1.507 118.575 120.200 -0.197 0.000 2.338 64 E HA -0.408 3.545 4.350 -0.660 0.000 0.197 64 E C 1.019 177.478 176.600 -0.236 0.000 1.007 64 E CA 2.003 58.175 56.400 -0.380 0.000 0.849 64 E CB -0.656 28.846 29.700 -0.329 0.000 0.774 64 E HN -0.032 8.261 8.360 -0.165 -0.032 0.506 65 A N -1.813 120.921 122.820 -0.143 0.000 2.024 65 A HA -0.173 4.099 4.320 -0.080 0.000 0.220 65 A C 0.628 178.162 177.584 -0.082 0.000 1.164 65 A CA 2.511 54.495 52.037 -0.088 0.000 0.643 65 A CB -0.327 18.638 19.000 -0.059 0.000 0.806 65 A HN -0.571 7.587 8.150 -0.135 -0.088 0.451 66 C N -3.224 116.034 119.300 -0.071 0.000 2.674 66 C HA 0.017 4.478 4.460 0.002 0.000 0.276 66 C C 1.116 176.074 174.990 -0.053 0.000 1.300 66 C CA 0.405 59.420 59.018 -0.005 0.000 1.732 66 C CB -0.259 27.528 27.740 0.079 0.000 2.076 66 C HN -0.500 7.549 8.230 -0.077 0.135 0.548 67 A N 0.042 122.745 122.820 -0.194 0.000 2.119 67 A HA -0.195 4.047 4.320 -0.129 0.000 0.217 67 A C 0.934 178.373 177.584 -0.240 0.000 1.153 67 A CA 2.546 54.407 52.037 -0.293 0.000 0.692 67 A CB -0.938 17.508 19.000 -0.923 0.000 0.799 67 A HN -0.288 7.588 8.150 -0.262 0.117 0.458 68 T N -2.447 111.975 114.554 -0.221 0.000 2.857 68 T HA -0.137 4.109 4.350 -0.173 0.000 0.266 68 T C 0.558 175.129 174.700 -0.215 0.000 1.048 68 T CA 3.401 65.390 62.100 -0.186 0.000 1.139 68 T CB -0.406 68.382 68.868 -0.133 0.000 0.874 68 T HN -0.045 8.031 8.240 -0.211 0.038 0.455 69 C N -2.449 116.660 119.300 -0.318 0.000 2.780 69 C HA 0.177 4.424 4.460 -0.355 0.000 0.267 69 C C 0.382 175.018 174.990 -0.590 0.000 1.266 69 C CA -0.250 58.480 59.018 -0.480 0.000 1.709 69 C CB 0.151 27.485 27.740 -0.676 0.000 1.975 69 C HN -0.135 7.900 8.230 -0.324 0.000 0.582 70 H N -0.442 118.559 119.070 -0.114 0.000 2.616 70 H HA 0.395 4.882 4.556 -0.115 0.000 0.229 70 H C -0.325 174.950 175.328 -0.089 0.000 1.418 70 H CA -1.174 54.809 56.048 -0.108 0.000 1.248 70 H CB -0.462 29.235 29.762 -0.107 0.000 1.822 70 H HN -0.359 7.719 8.280 -0.171 0.099 0.522 71 T N 4.482 119.024 114.554 -0.021 0.000 2.720 71 T HA -0.331 4.106 4.350 0.039 -0.064 0.268 71 T C 1.534 176.239 174.700 0.007 0.000 1.037 71 T CA 4.798 66.899 62.100 0.002 0.000 1.144 71 T CB -0.052 68.790 68.868 -0.042 0.000 0.864 71 T HN 0.455 8.655 8.240 -0.066 0.000 0.444 72 A N -0.263 122.472 122.820 -0.141 0.000 1.883 72 A HA -0.386 3.778 4.320 -0.261 0.000 0.217 72 A C 2.036 179.486 177.584 -0.223 0.000 1.186 72 A CA 3.413 55.244 52.037 -0.345 0.000 0.624 72 A CB -0.444 18.024 19.000 -0.886 0.000 0.822 72 A HN -0.052 8.001 8.150 -0.161 0.000 0.444 73 Q N -1.222 118.477 119.800 -0.169 0.000 2.084 73 Q HA -0.338 3.956 4.340 -0.075 0.000 0.202 73 Q C 2.091 178.063 176.000 -0.048 0.000 0.978 73 Q CA 3.366 59.061 55.803 -0.180 0.000 0.844 73 Q CB -0.408 28.037 28.738 -0.488 0.000 0.898 73 Q HN -0.326 7.843 8.270 -0.169 0.000 0.426 74 F N 2.006 121.903 119.950 -0.089 0.000 2.095 74 F HA -0.428 4.121 4.527 0.037 0.000 0.298 74 F C 1.262 177.106 175.800 0.073 0.000 1.104 74 F CA 3.569 61.574 58.000 0.008 0.000 1.232 74 F CB 0.237 39.226 39.000 -0.018 0.000 0.987 74 F HN -0.291 8.119 8.300 0.184 0.000 0.475 75 N N -1.473 117.296 118.700 0.116 0.000 2.166 75 N HA -0.408 4.298 4.740 -0.057 0.000 0.186 75 N C 2.158 177.640 175.510 -0.048 0.000 1.019 75 N CA 2.922 55.981 53.050 0.014 0.000 0.856 75 N CB -0.590 37.950 38.487 0.088 0.000 0.993 75 N HN 0.050 8.554 8.380 0.207 0.000 0.426 76 S N 0.403 116.127 115.700 0.039 0.000 2.356 76 S HA -0.288 4.416 4.470 0.065 -0.194 0.223 76 S C 1.907 176.532 174.600 0.041 0.000 1.032 76 S CA 2.688 60.944 58.200 0.093 0.000 1.005 76 S CB 0.081 63.437 63.200 0.260 0.000 0.867 76 S HN -0.608 7.742 8.310 0.067 0.000 0.449 77 F N 1.607 121.510 119.950 -0.077 0.000 2.095 77 F HA -0.231 4.524 4.527 -0.006 -0.232 0.298 77 F C 1.675 177.335 175.800 -0.233 0.000 1.104 77 F CA 2.750 60.683 58.000 -0.112 0.000 1.232 77 F CB 0.548 39.458 39.000 -0.149 0.000 0.987 77 F HN -0.367 8.042 8.300 0.183 0.000 0.475 78 V N -9.541 110.039 119.914 -0.557 0.000 3.461 78 V HA -0.087 3.517 4.120 -0.861 0.000 0.267 78 V C -0.511 175.295 176.094 -0.480 0.000 1.186 78 V CA -0.281 61.625 62.300 -0.656 0.000 1.154 78 V CB -0.214 31.245 31.823 -0.607 0.000 0.802 78 V HN -0.708 7.219 8.190 -0.438 0.000 0.474 79 E N 0.458 120.445 120.200 -0.356 0.000 2.502 79 E HA -0.245 3.972 4.350 -0.221 0.000 0.261 79 E C -0.536 175.869 176.600 -0.325 0.000 0.974 79 E CA 0.891 57.132 56.400 -0.265 0.000 0.936 79 E CB 0.712 30.303 29.700 -0.180 0.000 0.926 79 E HN -0.817 7.310 8.360 -0.315 0.044 0.459 80 V N 4.871 124.596 119.914 -0.315 0.000 2.394 80 V HA 0.055 4.012 4.120 -0.272 0.000 0.282 80 V C -0.911 174.915 176.094 -0.445 0.000 1.031 80 V CA -0.773 61.326 62.300 -0.336 0.000 0.881 80 V CB 0.984 32.650 31.823 -0.261 0.000 0.982 80 V HN -0.072 7.944 8.190 -0.290 0.000 0.451 81 R N 7.721 128.043 120.500 -0.297 0.000 2.308 81 R HA 0.161 4.349 4.340 -0.254 0.000 0.325 81 R C 0.441 176.607 176.300 -0.224 0.000 1.161 81 R CA -0.698 55.251 56.100 -0.251 0.000 1.022 81 R CB -0.372 29.822 30.300 -0.177 0.000 1.091 81 R HN 0.043 8.178 8.270 -0.225 0.000 0.497 82 H N 5.505 124.548 119.070 -0.045 0.000 2.456 82 H HA -0.294 4.243 4.556 -0.032 0.000 0.296 82 H C 0.854 176.129 175.328 -0.087 0.000 1.079 82 H CA 3.061 59.082 56.048 -0.045 0.000 1.322 82 H CB 0.095 29.842 29.762 -0.026 0.000 1.388 82 H HN 0.204 8.281 8.280 -0.338 0.000 0.538 83 E N -2.099 118.080 120.200 -0.036 0.000 2.418 83 E HA -0.174 4.095 4.350 -0.135 0.000 0.197 83 E C -0.309 176.070 176.600 -0.369 0.000 1.026 83 E CA 1.255 57.559 56.400 -0.160 0.000 0.862 83 E CB -0.630 28.993 29.700 -0.128 0.000 0.799 83 E HN 0.249 8.556 8.360 -0.040 0.030 0.518 84 S N 1.140 116.687 115.700 -0.255 0.000 2.494 84 S HA -0.030 4.228 4.470 -0.354 0.000 0.312 84 S C -0.688 173.782 174.600 -0.217 0.000 1.121 84 S CA -0.461 57.576 58.200 -0.271 0.000 1.068 84 S CB -0.054 63.047 63.200 -0.165 0.000 1.141 84 S HN -0.758 7.302 8.310 -0.175 0.145 0.527 85 H N 6.409 125.453 119.070 -0.044 0.000 3.125 85 H HA -0.052 4.482 4.556 -0.037 0.000 0.310 85 H C -1.111 174.182 175.328 -0.060 0.000 0.980 85 H CA -1.319 54.702 56.048 -0.045 0.000 1.422 85 H CB -0.762 28.973 29.762 -0.046 0.000 1.432 85 H HN -0.235 7.619 8.280 -0.711 0.000 0.577 86 P HA 0.189 4.573 4.420 -0.059 0.000 0.290 86 P C -0.644 176.653 177.300 -0.006 0.000 1.275 86 P CA -0.474 62.605 63.100 -0.034 0.000 0.841 86 P CB 1.233 32.867 31.700 -0.110 0.000 1.042 87 R N -1.891 118.601 120.500 -0.013 0.000 3.416 87 R HA -0.422 3.930 4.340 0.020 0.000 0.263 87 R C -1.521 174.792 176.300 0.021 0.000 1.053 87 R CA 0.541 56.653 56.100 0.021 0.000 0.705 87 R CB -1.120 29.217 30.300 0.062 0.000 1.124 87 R HN 0.400 8.651 8.270 -0.033 0.000 0.444 88 L N -0.051 121.175 121.223 0.004 0.000 2.259 88 L HA 0.161 4.496 4.340 -0.007 0.000 0.288 88 L C -1.414 175.439 176.870 -0.029 0.000 1.051 88 L CA -1.419 53.417 54.840 -0.007 0.000 0.824 88 L CB 0.924 42.988 42.059 0.008 0.000 1.206 88 L HN -0.175 8.054 8.230 -0.002 0.000 0.429 89 E N 6.938 127.131 120.200 -0.012 0.000 2.366 89 E HA -0.169 4.291 4.350 -0.015 -0.119 0.266 89 E C -0.217 176.358 176.600 -0.042 0.000 1.015 89 E CA 0.258 56.653 56.400 -0.008 0.000 0.906 89 E CB 0.157 29.881 29.700 0.040 0.000 0.979 89 E HN 0.516 8.876 8.360 -0.000 0.000 0.443 90 K N 5.540 125.873 120.400 -0.113 0.000 2.217 90 K HA -0.132 4.108 4.320 -0.133 0.000 0.202 90 K C 0.557 177.131 176.600 -0.044 0.000 1.051 90 K CA 2.324 58.512 56.287 -0.165 0.000 0.952 90 K CB 0.407 32.654 32.500 -0.421 0.000 0.736 90 K HN 0.374 8.537 8.250 -0.145 0.000 0.453 91 A N -1.909 120.951 122.820 0.067 0.000 2.916 91 A HA 0.260 4.958 4.320 0.242 -0.233 0.254 91 A C -0.584 177.080 177.584 0.134 0.000 1.544 91 A CA -0.959 51.199 52.037 0.200 0.000 1.224 91 A CB -0.835 18.380 19.000 0.359 0.000 1.012 91 A HN -0.553 7.964 8.150 0.082 -0.317 0.636 92 T N -2.827 111.780 114.554 0.087 0.000 2.906 92 T HA 0.406 4.797 4.350 0.069 0.000 0.295 92 T C -1.632 173.107 174.700 0.066 0.000 1.075 92 T CA -2.627 59.512 62.100 0.064 0.000 1.005 92 T CB 1.200 70.087 68.868 0.031 0.000 1.136 92 T HN -0.651 7.552 8.240 0.072 0.080 0.498 93 P HA -0.020 4.447 4.420 0.079 0.000 0.222 93 P C -0.315 177.021 177.300 0.060 0.000 1.147 93 P CA 1.901 65.037 63.100 0.061 0.000 0.790 93 P CB 0.049 31.774 31.700 0.041 0.000 0.780 94 T N -9.491 105.081 114.554 0.029 0.000 3.069 94 T HA 0.053 4.409 4.350 0.010 0.000 0.252 94 T C -0.228 174.465 174.700 -0.011 0.000 1.053 94 T CA -0.437 61.665 62.100 0.003 0.000 0.964 94 T CB 0.380 69.233 68.868 -0.026 0.000 1.005 94 T HN -0.212 8.007 8.240 0.020 0.032 0.532 95 S N 1.081 116.789 115.700 0.013 0.000 2.702 95 S HA 0.046 4.499 4.470 -0.030 0.000 0.272 95 S C -0.239 174.389 174.600 0.048 0.000 1.068 95 S CA -1.250 56.948 58.200 -0.004 0.000 0.964 95 S CB 1.400 64.584 63.200 -0.026 0.000 1.307 95 S HN -0.380 7.907 8.310 0.033 0.043 0.567 96 R N -1.127 119.387 120.500 0.023 0.000 2.115 96 R HA -0.001 4.418 4.340 0.132 0.000 0.226 96 R C -0.032 176.377 176.300 0.182 0.000 1.100 96 R CA 1.387 57.539 56.100 0.087 0.000 0.980 96 R CB 0.303 30.591 30.300 -0.019 0.000 0.875 96 R HN 0.334 8.587 8.270 -0.029 0.000 0.445 97 S N -2.294 113.488 115.700 0.138 0.000 2.312 97 S HA 0.612 5.404 4.470 0.324 -0.128 0.173 97 S C -2.066 172.686 174.600 0.253 0.000 1.488 97 S CA -3.368 54.985 58.200 0.255 0.000 1.239 97 S CB 0.639 63.994 63.200 0.258 0.000 1.215 97 S HN -0.533 7.825 8.310 0.080 0.000 0.438 98 P HA -0.191 4.471 4.420 0.139 -0.158 0.216 98 P C -0.218 177.178 177.300 0.159 0.000 1.150 98 P CA 2.066 65.259 63.100 0.154 0.000 0.843 98 P CB 0.272 32.042 31.700 0.117 0.000 0.787 99 M N -5.173 114.528 119.600 0.168 0.000 2.655 99 M HA 0.141 4.680 4.480 0.099 0.000 0.311 99 M C -0.147 176.273 176.300 0.201 0.000 1.229 99 M CA -0.660 54.709 55.300 0.116 0.000 0.972 99 M CB -0.244 32.355 32.600 -0.001 0.000 1.366 99 M HN -0.180 8.557 8.290 0.181 -0.339 0.500 100 F N 2.616 122.664 119.950 0.163 0.000 2.126 100 F HA -0.426 4.315 4.527 0.356 0.000 0.299 100 F C 0.860 176.777 175.800 0.196 0.000 1.096 100 F CA 4.015 62.172 58.000 0.262 0.000 1.255 100 F CB 0.212 39.389 39.000 0.296 0.000 0.997 100 F HN -0.374 8.144 8.300 0.473 0.065 0.479 101 D N -2.256 118.244 120.400 0.166 0.000 2.117 101 D HA -0.386 4.216 4.640 -0.065 0.000 0.197 101 D C 2.020 178.305 176.300 -0.025 0.000 0.987 101 D CA 4.265 58.271 54.000 0.011 0.000 0.829 101 D CB -0.242 40.580 40.800 0.036 0.000 0.961 101 D HN 0.378 8.888 8.370 0.233 0.000 0.460 102 K N -0.398 120.015 120.400 0.022 0.000 2.057 102 K HA -0.280 4.065 4.320 0.041 0.000 0.206 102 K C 2.223 178.910 176.600 0.144 0.000 1.050 102 K CA 2.878 59.192 56.287 0.045 0.000 0.935 102 K CB -0.243 32.264 32.500 0.012 0.000 0.715 102 K HN -0.615 7.659 8.250 0.039 0.000 0.439 103 L N -2.537 118.734 121.223 0.080 0.000 2.156 103 L HA -0.171 4.288 4.340 0.199 0.000 0.208 103 L C 1.910 179.002 176.870 0.370 0.000 1.095 103 L CA 2.866 57.800 54.840 0.156 0.000 0.770 103 L CB 0.143 42.090 42.059 -0.186 0.000 0.914 103 L HN -0.521 7.724 8.230 0.026 0.000 0.439 104 I N -4.135 116.462 120.570 0.045 0.000 3.956 104 I HA -0.081 4.222 4.170 0.221 0.000 0.333 104 I C -1.506 174.535 176.117 -0.128 0.000 1.302 104 I CA -2.188 59.057 61.300 -0.092 0.000 1.122 104 I CB 0.552 38.077 38.000 -0.791 0.000 1.013 104 I HN -0.124 8.009 8.210 -0.129 0.000 0.405 105 A N 0.604 123.340 122.820 -0.140 0.000 2.580 105 A HA -0.254 3.944 4.320 -0.203 0.000 0.244 105 A C 0.655 178.107 177.584 -0.220 0.000 1.045 105 A CA 2.080 53.968 52.037 -0.248 0.000 0.761 105 A CB -0.379 18.445 19.000 -0.294 0.000 0.962 105 A HN -0.495 7.566 8.150 -0.060 0.054 0.512 106 G N 2.137 110.869 108.800 -0.114 0.000 2.238 106 G HA2 -0.247 3.727 3.960 0.024 0.000 0.217 106 G HA3 -0.247 3.817 3.960 0.174 0.000 0.217 106 G C -0.871 174.008 174.900 -0.035 0.000 0.996 106 G CA -0.086 45.036 45.100 0.038 0.000 0.632 106 G HN 0.409 8.620 8.290 -0.131 0.000 0.503 107 H N 2.023 120.815 119.070 -0.463 0.000 2.479 107 H HA 0.284 4.549 4.556 -0.485 0.000 0.335 107 H C 0.833 176.081 175.328 -0.134 0.000 1.142 107 H CA -0.707 54.985 56.048 -0.593 0.000 1.234 107 H CB 3.048 32.053 29.762 -1.262 0.000 1.503 107 H HN -0.094 7.938 8.280 -0.312 0.062 0.510 108 G N 4.114 112.694 108.800 -0.367 0.000 2.470 108 G HA2 -0.257 3.919 3.960 0.361 0.000 0.220 108 G HA3 -0.257 3.718 3.960 0.026 0.000 0.220 108 G C 1.460 176.635 174.900 0.459 0.000 1.121 108 G CA 1.710 46.897 45.100 0.145 0.000 0.766 108 G HN 0.698 8.397 8.290 -0.986 0.000 0.553 109 F N 1.896 122.033 119.950 0.313 0.000 2.408 109 F HA -0.109 4.577 4.527 0.266 0.000 0.300 109 F C 1.777 177.738 175.800 0.267 0.000 1.090 109 F CA 0.668 58.844 58.000 0.293 0.000 1.427 109 F CB -0.756 38.406 39.000 0.270 0.000 1.070 109 F HN -0.507 8.445 8.300 1.135 0.028 0.549 110 A N -0.645 122.315 122.820 0.234 0.000 2.024 110 A HA -0.259 4.097 4.320 0.061 0.000 0.220 110 A C 1.314 178.840 177.584 -0.096 0.000 1.164 110 A CA 2.275 54.304 52.037 -0.014 0.000 0.643 110 A CB -0.651 18.200 19.000 -0.249 0.000 0.806 110 A HN -0.545 7.691 8.150 0.184 0.025 0.451 111 F N -3.348 116.671 119.950 0.114 0.000 2.259 111 F HA -0.169 4.404 4.527 0.076 0.000 0.298 111 F C 0.563 176.419 175.800 0.094 0.000 1.088 111 F CA 2.764 60.813 58.000 0.083 0.000 1.358 111 F CB 0.963 39.991 39.000 0.046 0.000 1.040 111 F HN -0.626 7.760 8.300 0.354 0.127 0.505 112 E N -2.784 117.572 120.200 0.261 0.000 2.552 112 E HA 0.066 4.711 4.350 0.194 -0.179 0.297 112 E C -2.296 174.402 176.600 0.163 0.000 1.038 112 E CA 0.162 56.675 56.400 0.189 0.000 0.856 112 E CB 2.112 31.898 29.700 0.144 0.000 1.222 112 E HN -0.829 7.694 8.360 0.273 0.000 0.422 113 H N 6.363 125.456 119.070 0.037 0.000 3.162 113 H HA 0.256 4.702 4.556 -0.184 0.000 0.309 113 H C -2.709 172.596 175.328 -0.038 0.000 1.156 113 H CA -0.863 55.148 56.048 -0.062 0.000 1.586 113 H CB 1.700 31.493 29.762 0.052 0.000 1.740 113 H HN 0.169 9.040 8.280 0.225 -0.456 0.525 114 A N 6.463 129.253 122.820 -0.050 0.000 2.264 114 A HA 0.481 4.909 4.320 -0.117 -0.178 0.304 114 A C -0.066 177.396 177.584 -0.203 0.000 1.100 114 A CA -1.164 50.807 52.037 -0.109 0.000 0.839 114 A CB 1.936 20.922 19.000 -0.022 0.000 1.121 114 A HN 0.175 8.344 8.150 0.031 0.000 0.496 115 E N 0.951 121.055 120.200 -0.160 0.000 2.404 115 E HA -0.001 4.242 4.350 -0.179 0.000 0.261 115 E C -1.540 175.020 176.600 -0.068 0.000 1.074 115 E CA -1.457 54.865 56.400 -0.130 0.000 0.917 115 E CB -0.103 29.548 29.700 -0.081 0.000 0.965 115 E HN -0.315 7.970 8.360 -0.124 0.000 0.433 116 P HA 0.008 4.422 4.420 -0.009 0.000 0.274 116 P C -1.432 175.844 177.300 -0.041 0.000 1.231 116 P CA 0.131 63.215 63.100 -0.025 0.000 0.790 116 P CB 0.601 32.291 31.700 -0.016 0.000 0.951 117 R N 1.839 122.326 120.500 -0.021 0.000 3.236 117 R HA 0.360 4.663 4.340 -0.060 0.000 0.234 117 R C -0.789 175.509 176.300 -0.003 0.000 1.541 117 R CA -2.079 54.006 56.100 -0.024 0.000 1.038 117 R CB 1.350 31.634 30.300 -0.025 0.000 1.587 117 R HN 0.112 8.383 8.270 0.003 0.000 0.515 118 S N -1.075 114.651 115.700 0.044 0.000 2.568 118 S HA 0.064 4.417 4.470 -0.195 0.000 0.282 118 S C 1.417 176.002 174.600 -0.026 0.000 1.338 118 S CA 0.202 58.362 58.200 -0.067 0.000 1.045 118 S CB 0.797 63.935 63.200 -0.103 0.000 0.873 118 S HN 0.139 8.506 8.310 0.096 0.000 0.516 119 H N 4.337 123.292 119.070 -0.191 0.000 2.422 119 H HA -0.332 4.179 4.556 -0.074 0.000 0.298 119 H C 2.036 177.211 175.328 -0.255 0.000 1.098 119 H CA 3.113 59.058 56.048 -0.173 0.000 1.315 119 H CB 0.046 29.739 29.762 -0.115 0.000 1.382 119 H HN 0.771 8.899 8.280 -0.253 0.000 0.523 120 A N -0.729 121.838 122.820 -0.422 0.000 1.986 120 A HA -0.263 3.822 4.320 -0.391 0.000 0.220 120 A C 0.831 178.164 177.584 -0.419 0.000 1.171 120 A CA 2.304 54.016 52.037 -0.542 0.000 0.640 120 A CB -0.562 17.915 19.000 -0.872 0.000 0.811 120 A HN 0.409 8.216 8.150 -0.543 0.017 0.451 121 F N -5.093 114.817 119.950 -0.066 0.000 2.765 121 F HA 0.115 4.632 4.527 -0.017 0.000 0.302 121 F C 0.934 176.700 175.800 -0.056 0.000 1.111 121 F CA 0.042 58.023 58.000 -0.031 0.000 1.359 121 F CB -0.445 38.554 39.000 -0.001 0.000 1.097 121 F HN -0.790 7.417 8.300 -0.103 0.031 0.577 122 M N 0.328 119.965 119.600 0.061 0.000 2.108 122 M HA -0.371 4.127 4.480 0.031 0.000 0.261 122 M C 0.931 177.156 176.300 -0.125 0.000 1.066 122 M CA 4.713 60.005 55.300 -0.012 0.000 1.107 122 M CB -0.567 32.003 32.600 -0.050 0.000 1.356 122 M HN -0.411 7.843 8.290 0.029 0.053 0.406 123 L N -1.331 119.760 121.223 -0.221 0.000 2.044 123 L HA -0.208 3.802 4.340 -0.551 0.000 0.205 123 L C 1.427 177.962 176.870 -0.558 0.000 1.075 123 L CA 2.905 57.458 54.840 -0.478 0.000 0.747 123 L CB -0.283 41.482 42.059 -0.490 0.000 0.903 123 L HN -0.165 7.958 8.230 -0.178 0.000 0.435 124 V N -5.352 114.389 119.914 -0.289 0.000 2.407 124 V HA -0.516 3.419 4.120 -0.308 0.000 0.248 124 V C 1.644 177.621 176.094 -0.195 0.000 1.055 124 V CA 3.741 65.886 62.300 -0.259 0.000 1.049 124 V CB -0.376 31.346 31.823 -0.168 0.000 0.662 124 V HN -0.630 7.450 8.190 -0.182 0.000 0.455 125 D N 0.146 120.521 120.400 -0.041 0.000 2.117 125 D HA -0.322 4.325 4.640 0.011 0.000 0.197 125 D C 2.172 178.462 176.300 -0.016 0.000 0.987 125 D CA 3.356 57.359 54.000 0.005 0.000 0.829 125 D CB -0.638 40.199 40.800 0.061 0.000 0.961 125 D HN 0.141 8.521 8.370 0.017 0.000 0.460 126 H N 1.539 120.522 119.070 -0.145 0.000 2.352 126 H HA -0.286 4.250 4.556 -0.034 0.000 0.299 126 H C 2.057 177.436 175.328 0.085 0.000 1.097 126 H CA 3.268 59.252 56.048 -0.107 0.000 1.311 126 H CB 0.067 29.663 29.762 -0.277 0.000 1.377 126 H HN -0.609 7.660 8.280 -0.018 0.000 0.504 127 F N -4.227 115.612 119.950 -0.185 0.000 2.234 127 F HA -0.161 4.220 4.527 -0.244 0.000 0.299 127 F C 1.031 176.790 175.800 -0.069 0.000 1.087 127 F CA 2.056 59.908 58.000 -0.245 0.000 1.340 127 F CB 0.411 39.085 39.000 -0.543 0.000 1.031 127 F HN -0.439 7.625 8.300 -0.256 0.083 0.500 128 V N -8.829 111.100 119.914 0.026 0.000 3.644 128 V HA 0.273 4.566 4.120 0.011 -0.167 0.267 128 V C 0.193 176.299 176.094 0.020 0.000 1.277 128 V CA -0.369 61.911 62.300 -0.032 0.000 1.096 128 V CB 1.221 32.901 31.823 -0.239 0.000 0.828 128 V HN -0.816 7.348 8.190 -0.042 0.000 0.446 129 V N 1.198 121.130 119.914 0.030 0.000 2.872 129 V HA -0.441 3.707 4.120 0.046 0.000 0.307 129 V C 0.164 176.287 176.094 0.048 0.000 1.072 129 V CA 1.320 63.641 62.300 0.035 0.000 1.148 129 V CB 1.061 32.890 31.823 0.010 0.000 0.954 129 V HN -0.764 7.438 8.190 0.020 0.000 0.490 130 D N 6.879 127.320 120.400 0.068 0.000 2.310 130 D HA -0.187 4.494 4.640 0.068 0.000 0.212 130 D C 1.386 177.712 176.300 0.043 0.000 0.965 130 D CA 3.216 57.264 54.000 0.080 0.000 0.879 130 D CB -0.095 40.790 40.800 0.141 0.000 0.921 130 D HN 0.401 9.197 8.370 0.080 -0.378 0.510 131 R N -3.599 116.921 120.500 0.032 0.000 2.310 131 R HA -0.075 4.244 4.340 -0.035 0.000 0.202 131 R C 0.115 176.357 176.300 -0.097 0.000 0.933 131 R CA 1.885 57.978 56.100 -0.012 0.000 1.054 131 R CB -0.741 29.578 30.300 0.031 0.000 0.985 131 R HN 0.053 8.309 8.270 0.030 0.032 0.489 132 A N -0.470 122.292 122.820 -0.097 0.000 1.938 132 A HA 0.089 4.247 4.320 -0.269 0.000 0.207 132 A C -0.544 176.794 177.584 -0.410 0.000 1.292 132 A CA 1.818 53.711 52.037 -0.241 0.000 0.700 132 A CB 1.575 20.462 19.000 -0.189 0.000 0.947 132 A HN -0.524 7.545 8.150 -0.041 0.056 0.476 133 Y N -4.056 116.205 120.300 -0.065 0.000 2.696 133 Y HA 0.379 5.068 4.550 -0.065 -0.178 0.255 133 Y C 0.399 176.242 175.900 -0.095 0.000 1.103 133 Y CA -1.754 56.289 58.100 -0.095 0.000 1.126 133 Y CB 0.733 39.093 38.460 -0.168 0.000 1.197 133 Y HN -0.321 8.017 8.280 0.096 0.000 0.574 134 G N 0.319 109.130 108.800 0.019 0.000 2.233 134 G HA2 -0.481 3.454 3.960 -0.040 0.000 0.270 134 G HA3 -0.481 3.740 3.960 0.077 -0.215 0.270 134 G C 0.004 174.978 174.900 0.124 0.000 1.011 134 G CA 1.028 46.153 45.100 0.042 0.000 0.762 134 G HN 0.454 8.717 8.290 -0.046 0.000 0.511 135 G N -3.259 105.576 108.800 0.059 0.000 2.162 135 G HA2 -0.481 3.486 3.960 0.010 0.000 0.260 135 G HA3 -0.481 3.518 3.960 0.064 0.000 0.260 135 G C 0.223 175.041 174.900 -0.137 0.000 0.976 135 G CA 0.501 45.614 45.100 0.022 0.000 0.655 135 G HN 0.138 8.434 8.290 0.048 0.023 0.533 136 R N -0.611 119.698 120.500 -0.318 0.000 2.103 136 R HA -0.290 3.198 4.340 -1.421 0.000 0.242 136 R C -0.656 175.226 176.300 -0.696 0.000 1.142 136 R CA 3.014 58.554 56.100 -0.933 0.000 0.960 136 R CB 0.713 30.351 30.300 -1.103 0.000 0.858 136 R HN -0.440 7.570 8.270 -0.171 0.157 0.439 137 F N -5.155 114.637 119.950 -0.264 0.000 2.421 137 F HA 0.947 5.556 4.527 -0.245 -0.229 0.337 137 F C -0.389 175.262 175.800 -0.249 0.000 1.105 137 F CA -2.446 55.398 58.000 -0.259 0.000 1.049 137 F CB 1.006 39.818 39.000 -0.313 0.000 1.139 137 F HN -0.304 7.773 8.300 -0.372 0.000 0.479 138 Q N -0.857 118.903 119.800 -0.067 0.000 2.416 138 Q HA 0.249 4.453 4.340 -0.228 0.000 0.281 138 Q C -1.077 174.767 176.000 -0.260 0.000 1.067 138 Q CA -2.012 53.678 55.803 -0.188 0.000 0.809 138 Q CB 4.443 33.093 28.738 -0.147 0.000 1.418 138 Q HN 0.199 8.454 8.270 -0.024 0.000 0.411 139 F N 0.906 120.718 119.950 -0.230 0.000 2.595 139 F HA -0.158 4.421 4.527 -0.160 -0.148 0.359 139 F C 1.905 177.589 175.800 -0.194 0.000 1.147 139 F CA 2.027 59.897 58.000 -0.217 0.000 1.341 139 F CB 0.208 39.039 39.000 -0.283 0.000 1.104 139 F HN 0.404 8.550 8.300 -0.258 0.000 0.603 140 K N 0.596 121.048 120.400 0.086 0.000 2.103 140 K HA -0.376 3.954 4.320 0.016 0.000 0.207 140 K C -0.121 176.489 176.600 0.017 0.000 1.048 140 K CA 2.742 59.051 56.287 0.038 0.000 0.930 140 K CB 0.403 32.937 32.500 0.057 0.000 0.716 140 K HN 0.311 8.646 8.250 0.143 0.000 0.444 141 N N -5.769 112.939 118.700 0.013 0.000 3.106 141 N HA 0.065 4.778 4.740 -0.044 0.000 0.253 141 N C -0.778 174.698 175.510 -0.056 0.000 1.506 141 N CA -0.821 52.225 53.050 -0.005 0.000 0.876 141 N CB 0.415 38.949 38.487 0.078 0.000 1.452 141 N HN -0.710 7.701 8.380 0.042 -0.005 0.542 142 W N -1.898 119.408 121.300 0.009 0.000 2.825 142 W HA -0.081 4.540 4.660 -0.065 0.000 0.243 142 W C 1.562 178.016 176.519 -0.108 0.000 1.293 142 W CA 2.069 59.384 57.345 -0.050 0.000 1.403 142 W CB -0.004 29.435 29.460 -0.034 0.000 1.134 142 W HN 0.466 8.861 8.180 0.358 0.000 0.666 143 Q N -0.464 119.392 119.800 0.093 0.000 2.172 143 Q HA -0.267 4.087 4.340 0.022 0.000 0.200 143 Q C 2.025 177.986 176.000 -0.066 0.000 0.964 143 Q CA 2.803 58.617 55.803 0.019 0.000 0.855 143 Q CB -0.407 28.350 28.738 0.031 0.000 0.918 143 Q HN -0.164 8.375 8.270 0.109 -0.204 0.444 144 K N -1.909 118.423 120.400 -0.113 0.000 2.442 144 K HA -0.158 4.134 4.320 -0.045 0.000 0.198 144 K C 1.982 178.331 176.600 -0.419 0.000 1.042 144 K CA 1.107 57.310 56.287 -0.140 0.000 0.958 144 K CB -0.701 31.815 32.500 0.026 0.000 0.766 144 K HN -0.599 7.670 8.250 -0.091 -0.073 0.474 145 V N -4.754 114.747 119.914 -0.687 0.000 2.720 145 V HA -0.275 2.934 4.120 -1.518 0.000 0.256 145 V C 0.853 176.684 176.094 -0.439 0.000 1.082 145 V CA 3.166 64.925 62.300 -0.901 0.000 1.101 145 V CB -0.792 30.626 31.823 -0.676 0.000 0.693 145 V HN -0.699 7.116 8.190 -0.538 0.052 0.479 146 T N -3.598 110.864 114.554 -0.154 0.000 3.088 146 T HA -0.147 4.248 4.350 0.076 0.000 0.259 146 T C -0.161 174.694 174.700 0.258 0.000 1.122 146 T CA 1.385 63.522 62.100 0.061 0.000 1.095 146 T CB 0.011 68.905 68.868 0.044 0.000 0.930 146 T HN -0.628 7.486 8.240 -0.151 0.035 0.508 147 D N 3.274 123.812 120.400 0.231 0.000 2.522 147 D HA 0.163 4.881 4.640 0.131 0.000 0.218 147 D C 0.499 176.880 176.300 0.136 0.000 1.149 147 D CA -1.287 52.818 54.000 0.174 0.000 0.981 147 D CB -0.355 40.508 40.800 0.105 0.000 1.041 147 D HN -0.619 7.695 8.370 0.159 0.152 0.518 148 G N 2.873 111.636 108.800 -0.062 0.000 2.404 148 G HA2 -0.353 2.925 3.960 -1.136 0.000 0.215 148 G HA3 -0.353 3.198 3.960 -0.680 0.000 0.215 148 G C 0.781 175.488 174.900 -0.321 0.000 1.174 148 G CA 2.380 47.121 45.100 -0.598 0.000 0.780 148 G HN -0.238 8.070 8.290 0.030 0.000 0.537 149 M N 2.158 121.667 119.600 -0.151 0.000 2.108 149 M HA -0.243 4.194 4.480 -0.071 0.000 0.261 149 M C 2.047 178.349 176.300 0.003 0.000 1.066 149 M CA 1.468 56.736 55.300 -0.052 0.000 1.107 149 M CB -0.522 32.085 32.600 0.012 0.000 1.356 149 M HN -0.127 8.095 8.290 -0.113 0.000 0.406 150 G N -2.216 106.593 108.800 0.015 0.000 2.446 150 G HA2 -0.432 3.560 3.960 0.053 0.000 0.217 150 G HA3 -0.432 3.764 3.960 0.057 -0.202 0.217 150 G C 0.592 175.512 174.900 0.033 0.000 1.168 150 G CA 2.055 47.181 45.100 0.044 0.000 0.771 150 G HN -0.192 8.415 8.290 0.014 -0.308 0.551 151 A N 2.300 125.125 122.820 0.009 0.000 1.908 151 A HA -0.282 4.036 4.320 -0.004 0.000 0.218 151 A C 2.005 179.574 177.584 -0.025 0.000 1.181 151 A CA 2.607 54.636 52.037 -0.014 0.000 0.627 151 A CB -0.527 18.463 19.000 -0.016 0.000 0.818 151 A HN -0.476 7.673 8.150 -0.002 0.000 0.445 152 V N -1.204 118.697 119.914 -0.023 0.000 2.343 152 V HA -0.561 3.607 4.120 0.079 0.000 0.247 152 V C 1.704 177.916 176.094 0.196 0.000 1.051 152 V CA 3.959 66.304 62.300 0.074 0.000 1.036 152 V CB -0.191 31.663 31.823 0.052 0.000 0.654 152 V HN -0.302 7.845 8.190 -0.071 0.000 0.451 153 R N -0.344 120.250 120.500 0.157 0.000 2.105 153 R HA -0.303 4.160 4.340 0.205 0.000 0.239 153 R C 0.155 176.579 176.300 0.207 0.000 1.135 153 R CA 2.162 58.371 56.100 0.182 0.000 0.967 153 R CB 0.708 31.077 30.300 0.116 0.000 0.861 153 R HN -0.299 8.039 8.270 0.113 0.000 0.442 154 G N -6.717 102.133 108.800 0.082 0.000 2.341 154 G HA2 -0.048 4.000 3.960 -0.144 0.000 0.300 154 G HA3 -0.048 3.883 3.960 -0.049 0.000 0.300 154 G C -1.636 173.166 174.900 -0.162 0.000 1.706 154 G CA -0.223 44.840 45.100 -0.063 0.000 0.916 154 G HN -0.647 7.596 8.290 0.053 0.079 0.716 155 A N 3.218 125.829 122.820 -0.349 0.000 1.917 155 A HA -0.195 3.885 4.320 -0.400 0.000 0.219 155 A C 1.209 178.369 177.584 -0.707 0.000 1.182 155 A CA 3.068 54.752 52.037 -0.588 0.000 0.633 155 A CB 0.141 18.651 19.000 -0.817 0.000 0.819 155 A HN 0.409 8.229 8.150 -0.368 0.109 0.448 156 W N -6.312 114.906 121.300 -0.137 0.000 3.077 156 W HA -0.031 4.502 4.660 -0.211 0.000 0.245 156 W C 0.921 177.386 176.519 -0.090 0.000 1.316 156 W CA 0.023 57.269 57.345 -0.165 0.000 1.537 156 W CB -0.427 28.914 29.460 -0.199 0.000 1.131 156 W HN -0.155 7.755 8.180 -0.426 0.014 0.695 157 T N -2.229 112.350 114.554 0.041 0.000 3.055 157 T HA -0.162 4.232 4.350 0.074 0.000 0.265 157 T C 0.925 175.652 174.700 0.044 0.000 1.111 157 T CA 2.915 65.047 62.100 0.053 0.000 1.118 157 T CB 0.226 69.123 68.868 0.048 0.000 0.909 157 T HN -0.240 7.846 8.240 -0.015 0.145 0.501 158 V N -4.857 115.063 119.914 0.010 0.000 3.502 158 V HA 0.387 4.563 4.120 0.095 0.000 0.288 158 V C -1.819 174.298 176.094 0.038 0.000 1.461 158 V CA -0.467 61.877 62.300 0.074 0.000 1.029 158 V CB 1.011 32.941 31.823 0.178 0.000 0.843 158 V HN -0.670 7.459 8.190 -0.057 0.027 0.438 159 L N -0.461 120.705 121.223 -0.096 0.000 2.322 159 L HA 0.820 5.215 4.340 -0.168 -0.156 0.269 159 L C 0.089 176.991 176.870 0.053 0.000 1.012 159 L CA -1.716 53.032 54.840 -0.153 0.000 0.815 159 L CB 3.089 44.864 42.059 -0.475 0.000 1.295 159 L HN -0.748 7.415 8.230 -0.112 0.000 0.438 160 T N -3.159 111.425 114.554 0.050 0.000 2.930 160 T HA 0.299 4.713 4.350 0.107 0.000 0.290 160 T C -2.134 172.660 174.700 0.155 0.000 1.052 160 T CA -2.094 60.058 62.100 0.087 0.000 1.017 160 T CB 2.657 71.535 68.868 0.017 0.000 1.137 160 T HN 0.684 8.917 8.240 -0.011 0.000 0.511 161 D N 0.591 121.039 120.400 0.078 0.000 2.408 161 D HA 0.265 5.116 4.640 0.144 -0.125 0.243 161 D C 0.082 176.281 176.300 -0.169 0.000 1.075 161 D CA -1.730 52.287 54.000 0.029 0.000 0.832 161 D CB 2.512 43.306 40.800 -0.011 0.000 1.162 161 D HN -0.028 8.355 8.370 0.021 0.000 0.515 162 A N 5.000 127.584 122.820 -0.393 0.000 2.019 162 A HA -0.218 3.957 4.320 -0.241 0.000 0.219 162 A C 0.095 177.526 177.584 -0.255 0.000 1.164 162 A CA 1.675 53.461 52.037 -0.418 0.000 0.644 162 A CB 0.513 19.019 19.000 -0.823 0.000 0.805 162 A HN 0.508 8.332 8.150 -0.542 0.000 0.449 163 D N -4.669 115.582 120.400 -0.249 0.000 2.411 163 D HA 0.421 5.053 4.640 -0.013 0.000 0.239 163 D C -2.248 174.023 176.300 -0.049 0.000 1.307 163 D CA -1.931 52.046 54.000 -0.038 0.000 0.930 163 D CB 0.871 41.772 40.800 0.168 0.000 1.395 163 D HN -0.477 7.988 8.370 -0.345 -0.302 0.536 164 P HA -0.026 4.476 4.420 -0.093 -0.138 0.223 164 P C -0.398 176.881 177.300 -0.034 0.000 1.144 164 P CA 0.966 64.024 63.100 -0.069 0.000 0.783 164 P CB 0.453 32.106 31.700 -0.079 0.000 0.771 165 E N -4.530 115.666 120.200 -0.007 0.000 2.489 165 E HA 0.040 4.390 4.350 -0.001 0.000 0.193 165 E C -0.216 176.397 176.600 0.022 0.000 1.057 165 E CA -0.132 56.272 56.400 0.006 0.000 0.866 165 E CB 0.134 29.840 29.700 0.011 0.000 0.916 165 E HN -0.304 8.262 8.360 0.000 -0.206 0.500 166 S N -2.014 113.707 115.700 0.036 0.000 2.568 166 S HA 0.329 4.823 4.470 0.041 0.000 0.293 166 S C -0.736 173.897 174.600 0.055 0.000 1.089 166 S CA -1.340 56.890 58.200 0.050 0.000 0.945 166 S CB 2.374 65.616 63.200 0.069 0.000 1.077 166 S HN -0.617 7.676 8.310 0.036 0.038 0.485 167 S N 0.519 116.256 115.700 0.062 0.000 2.730 167 S HA 0.135 4.648 4.470 0.072 0.000 0.244 167 S C -1.039 173.616 174.600 0.091 0.000 1.022 167 S CA -0.784 57.462 58.200 0.078 0.000 1.014 167 S CB 1.009 64.264 63.200 0.092 0.000 0.963 167 S HN 0.469 8.814 8.310 0.058 0.000 0.540 168 D N -0.381 120.065 120.400 0.076 0.000 2.304 168 D HA -0.056 4.626 4.640 0.071 0.000 0.247 168 D C -0.781 175.565 176.300 0.076 0.000 1.089 168 D CA -0.855 53.184 54.000 0.065 0.000 0.910 168 D CB 1.100 41.917 40.800 0.029 0.000 1.199 168 D HN -0.668 7.743 8.370 0.069 0.000 0.426 169 Q N 0.599 120.439 119.800 0.066 0.000 2.281 169 Q HA -0.091 4.305 4.340 0.093 0.000 0.267 169 Q C -0.286 175.715 176.000 0.002 0.000 1.053 169 Q CA 0.678 56.514 55.803 0.055 0.000 0.905 169 Q CB -0.117 28.637 28.738 0.027 0.000 1.195 169 Q HN 0.412 8.720 8.270 0.063 0.000 0.398 170 R N 1.834 122.333 120.500 -0.001 0.000 2.752 170 R HA 0.331 4.603 4.340 -0.113 0.000 0.271 170 R C -0.554 175.659 176.300 -0.144 0.000 1.026 170 R CA -0.814 55.208 56.100 -0.130 0.000 0.901 170 R CB 0.732 30.875 30.300 -0.263 0.000 1.243 170 R HN 0.225 8.548 8.270 0.088 0.000 0.463 171 R N 1.881 122.260 120.500 -0.202 0.000 2.316 171 R HA 0.267 4.607 4.340 0.000 0.000 0.314 171 R C -0.554 175.584 176.300 -0.270 0.000 1.069 171 R CA 0.313 56.328 56.100 -0.143 0.000 0.959 171 R CB 0.520 30.745 30.300 -0.125 0.000 0.987 171 R HN 0.427 nan 8.270 nan 0.000 0.446 172 F N 3.325 123.234 119.950 -0.070 0.000 2.656 172 F HA 0.013 4.512 4.527 -0.046 0.000 0.291 172 F C -0.120 175.665 175.800 -0.026 0.000 1.122 172 F CA 1.408 59.378 58.000 -0.051 0.000 1.427 172 F CB 1.046 40.006 39.000 -0.067 0.000 1.125 172 F HN 0.769 9.158 8.300 0.332 0.110 0.583 173 L N -2.290 119.017 121.223 0.140 0.000 2.354 173 L HA 0.453 4.850 4.340 0.094 0.000 0.269 173 L C 0.139 177.044 176.870 0.058 0.000 1.005 173 L CA -1.539 53.360 54.840 0.097 0.000 0.819 173 L CB 2.778 44.902 42.059 0.108 0.000 1.311 173 L HN -0.710 7.601 8.230 0.136 0.000 0.423 174 S N 0.950 116.687 115.700 0.063 0.000 2.368 174 S HA -0.235 4.254 4.470 0.032 0.000 0.225 174 S C 0.677 175.334 174.600 0.096 0.000 1.030 174 S CA 2.302 60.537 58.200 0.059 0.000 0.999 174 S CB 0.137 63.376 63.200 0.065 0.000 0.844 174 S HN 0.327 8.679 8.310 0.070 0.000 0.459 175 Q N 2.108 121.997 119.800 0.148 0.000 3.035 175 Q HA 0.267 4.850 4.340 0.405 0.000 0.354 175 Q C -1.445 174.727 176.000 0.287 0.000 1.247 175 Q CA -0.962 55.019 55.803 0.298 0.000 1.068 175 Q CB -0.808 28.092 28.738 0.270 0.000 1.424 175 Q HN 0.302 8.652 8.270 0.134 0.000 0.486 176 T N -4.681 109.867 114.554 -0.010 0.000 2.888 176 T HA 0.472 4.862 4.350 -0.094 -0.097 0.288 176 T C -1.965 172.268 174.700 -0.779 0.000 1.063 176 T CA -1.831 60.136 62.100 -0.222 0.000 1.010 176 T CB 3.338 72.160 68.868 -0.078 0.000 1.214 176 T HN -0.722 7.414 8.240 -0.065 0.066 0.533 177 A N -1.089 121.333 122.820 -0.663 0.000 2.486 177 A HA 0.406 4.349 4.320 -0.629 0.000 0.289 177 A C -1.748 175.661 177.584 -0.293 0.000 1.176 177 A CA -1.046 50.620 52.037 -0.617 0.000 0.757 177 A CB 2.839 21.420 19.000 -0.699 0.000 1.337 177 A HN 0.095 7.995 8.150 -0.417 0.000 0.423 178 T N -3.076 111.339 114.554 -0.232 0.000 3.416 178 T HA 0.309 4.701 4.350 -0.194 -0.158 0.245 178 T C -0.452 174.147 174.700 -0.169 0.000 1.081 178 T CA -1.336 60.657 62.100 -0.178 0.000 1.190 178 T CB -0.335 68.461 68.868 -0.120 0.000 1.068 178 T HN 0.085 8.184 8.240 -0.235 0.000 0.580 179 A N 2.347 125.068 122.820 -0.164 0.000 2.066 179 A HA -0.074 4.203 4.320 -0.071 0.000 0.218 179 A C -0.190 177.343 177.584 -0.086 0.000 1.157 179 A CA 1.142 53.124 52.037 -0.090 0.000 0.670 179 A CB 0.257 19.245 19.000 -0.021 0.000 0.804 179 A HN -0.130 7.916 8.150 -0.172 0.000 0.453 180 A N -2.355 120.316 122.820 -0.247 0.000 2.483 180 A HA -0.138 4.158 4.320 -0.039 0.000 0.238 180 A C -0.849 176.696 177.584 -0.063 0.000 1.070 180 A CA 0.420 52.314 52.037 -0.238 0.000 0.770 180 A CB 0.669 19.105 19.000 -0.941 0.000 1.008 180 A HN -0.446 7.338 8.150 -0.382 0.137 0.497 181 N N 1.266 120.026 118.700 0.099 0.000 2.825 181 N HA 0.279 5.117 4.740 0.164 0.000 0.253 181 N C -1.695 173.964 175.510 0.248 0.000 1.426 181 N CA -1.624 51.526 53.050 0.166 0.000 0.851 181 N CB -0.151 38.424 38.487 0.146 0.000 1.470 181 N HN -0.623 7.846 8.380 0.149 0.000 0.517 182 P HA -0.136 4.642 4.420 0.595 0.000 0.218 182 P C 0.810 178.255 177.300 0.241 0.000 1.148 182 P CA 2.193 65.534 63.100 0.401 0.000 0.822 182 P CB 0.285 32.184 31.700 0.332 0.000 0.784 183 V N -1.697 118.364 119.914 0.245 0.000 2.407 183 V HA -0.563 3.649 4.120 0.152 0.000 0.248 183 V C 1.582 177.676 176.094 0.001 0.000 1.055 183 V CA 4.007 66.409 62.300 0.170 0.000 1.049 183 V CB -0.318 31.656 31.823 0.252 0.000 0.662 183 V HN -0.277 8.266 8.190 0.270 -0.191 0.455 184 C N -0.605 118.711 119.300 0.026 0.000 2.391 184 C HA -0.291 4.121 4.460 -0.081 0.000 0.276 184 C C 2.448 177.238 174.990 -0.333 0.000 1.217 184 C CA 3.897 62.856 59.018 -0.098 0.000 1.766 184 C CB -1.943 25.800 27.740 0.005 0.000 2.046 184 C HN -0.480 7.950 8.230 0.105 -0.138 0.475 185 L N -1.774 119.230 121.223 -0.366 0.000 2.265 185 L HA -0.251 3.683 4.340 -0.676 0.000 0.215 185 L C 2.117 178.739 176.870 -0.414 0.000 1.117 185 L CA 2.038 56.553 54.840 -0.543 0.000 0.782 185 L CB -1.628 40.008 42.059 -0.705 0.000 0.914 185 L HN -0.448 7.623 8.230 -0.233 0.019 0.441 186 N N -1.206 117.298 118.700 -0.327 0.000 2.453 186 N HA -0.171 4.540 4.740 -0.049 0.000 0.183 186 N C 0.154 175.559 175.510 -0.175 0.000 1.041 186 N CA 3.017 55.955 53.050 -0.186 0.000 0.900 186 N CB 0.231 38.597 38.487 -0.202 0.000 0.961 186 N HN -0.435 7.710 8.380 -0.330 0.037 0.443 187 C N -3.918 115.236 119.300 -0.244 0.000 2.778 187 C HA 0.222 4.555 4.460 -0.213 0.000 0.294 187 C C 0.229 175.042 174.990 -0.295 0.000 1.331 187 C CA -0.905 57.959 59.018 -0.257 0.000 1.741 187 C CB -1.343 26.212 27.740 -0.308 0.000 2.106 187 C HN -0.463 7.560 8.230 -0.287 0.035 0.603 188 K N -2.014 118.195 120.400 -0.319 0.000 2.474 188 K HA 0.318 4.458 4.320 -0.301 0.000 0.202 188 K C -0.702 175.729 176.600 -0.281 0.000 1.248 188 K CA -0.254 55.829 56.287 -0.341 0.000 0.946 188 K CB 3.009 35.206 32.500 -0.506 0.000 1.102 188 K HN 0.004 7.895 8.250 -0.317 0.169 0.541 189 T N -1.655 112.762 114.554 -0.228 0.000 2.830 189 T HA 0.334 4.676 4.350 -0.167 -0.093 0.322 189 T C -2.406 172.274 174.700 -0.035 0.000 1.501 189 T CA -0.561 61.453 62.100 -0.145 0.000 1.036 189 T CB 1.855 70.640 68.868 -0.139 0.000 1.379 189 T HN -0.290 7.823 8.240 -0.212 0.000 0.493 190 Q N 2.053 121.816 119.800 -0.063 0.000 2.115 190 Q HA 0.415 4.543 4.340 -0.352 0.000 0.249 190 Q C 0.388 176.440 176.000 0.087 0.000 0.830 190 Q CA -1.270 54.468 55.803 -0.108 0.000 1.104 190 Q CB 1.463 30.171 28.738 -0.051 0.000 1.207 190 Q HN 0.547 9.148 8.270 -0.106 -0.395 0.464 191 D N 1.056 121.578 120.400 0.202 0.000 2.228 191 D HA -0.347 4.496 4.640 0.338 0.000 0.203 191 D C 0.298 176.771 176.300 0.288 0.000 0.988 191 D CA 3.308 57.476 54.000 0.280 0.000 0.864 191 D CB -0.009 40.927 40.800 0.227 0.000 0.928 191 D HN -0.409 8.063 8.370 0.171 0.000 0.469 192 H N -7.024 112.168 119.070 0.203 0.000 2.533 192 H HA 0.054 4.856 4.556 0.409 0.000 0.271 192 H C 0.651 176.168 175.328 0.314 0.000 1.000 192 H CA -1.047 55.206 56.048 0.341 0.000 1.149 192 H CB -1.643 28.402 29.762 0.472 0.000 1.375 192 H HN -0.205 8.297 8.280 0.423 0.032 0.582 193 I N 1.654 122.161 120.570 -0.104 0.000 2.423 193 I HA -0.388 3.664 4.170 -0.197 0.000 0.254 193 I C -0.670 175.486 176.117 0.065 0.000 1.151 193 I CA 2.976 64.221 61.300 -0.092 0.000 1.421 193 I CB 0.020 37.987 38.000 -0.055 0.000 1.079 193 I HN -0.556 7.541 8.210 -0.067 0.073 0.431 194 L N -5.869 115.447 121.223 0.155 0.000 2.607 194 L HA -0.045 4.464 4.340 0.281 0.000 0.228 194 L C -0.321 176.808 176.870 0.431 0.000 1.123 194 L CA 0.128 55.122 54.840 0.256 0.000 0.890 194 L CB -0.388 41.761 42.059 0.149 0.000 1.103 194 L HN -0.200 8.101 8.230 0.159 0.024 0.468 195 D N -2.854 117.823 120.400 0.461 0.000 2.503 195 D HA 0.269 5.179 4.640 0.450 0.000 0.218 195 D C -2.157 174.507 176.300 0.607 0.000 1.183 195 D CA 0.175 54.486 54.000 0.517 0.000 0.827 195 D CB 2.537 43.664 40.800 0.545 0.000 1.034 195 D HN -0.113 8.345 8.370 0.442 0.177 0.510 196 W N 0.077 121.534 121.300 0.261 0.000 2.830 196 W HA 0.514 5.473 4.660 0.194 -0.182 0.335 196 W C -2.855 173.527 176.519 -0.229 0.000 1.043 196 W CA -1.685 55.749 57.345 0.149 0.000 1.239 196 W CB 2.941 32.602 29.460 0.336 0.000 1.378 196 W HN -0.955 7.496 8.180 0.450 0.000 0.456 197 A N 5.946 128.473 122.820 -0.487 0.000 2.351 197 A HA 0.053 3.854 4.320 -1.092 -0.136 0.257 197 A C -0.747 176.578 177.584 -0.433 0.000 1.087 197 A CA -0.969 50.696 52.037 -0.619 0.000 0.798 197 A CB 1.855 20.722 19.000 -0.221 0.000 1.033 197 A HN 0.451 8.354 8.150 -0.413 0.000 0.488 198 Y N 3.601 123.697 120.300 -0.340 0.000 2.944 198 Y HA -0.461 4.056 4.550 -0.055 0.000 0.340 198 Y C 0.216 176.033 175.900 -0.138 0.000 1.275 198 Y CA 2.724 60.738 58.100 -0.143 0.000 1.590 198 Y CB 0.328 38.734 38.460 -0.091 0.000 1.218 198 Y HN -0.003 8.198 8.280 -0.133 0.000 0.576 199 M N 3.839 123.197 119.600 -0.403 0.000 2.931 199 M HA -0.500 3.941 4.480 -0.225 -0.096 0.190 199 M C 0.716 176.875 176.300 -0.235 0.000 0.626 199 M CA 0.767 55.878 55.300 -0.315 0.000 0.722 199 M CB -2.302 30.058 32.600 -0.400 0.000 2.597 199 M HN 0.415 8.722 8.290 -0.307 -0.201 0.299 200 G N -2.873 105.493 108.800 -0.724 0.000 2.136 200 G HA2 -0.515 1.998 3.960 -2.412 0.000 0.242 200 G HA3 -0.515 2.703 3.960 -1.237 0.000 0.242 200 G C -1.004 173.508 174.900 -0.647 0.000 0.989 200 G CA 0.197 44.478 45.100 -1.364 0.000 0.682 200 G HN 0.537 8.143 8.290 -0.845 0.176 0.522 201 D N 0.741 120.914 120.400 -0.378 0.000 2.400 201 D HA -0.044 4.507 4.640 -0.149 0.000 0.238 201 D C -0.340 175.879 176.300 -0.135 0.000 1.157 201 D CA 0.720 54.615 54.000 -0.176 0.000 0.889 201 D CB 0.539 41.299 40.800 -0.066 0.000 1.199 201 D HN -0.879 7.236 8.370 -0.355 0.041 0.436 202 E N 1.136 121.294 120.200 -0.070 0.000 2.414 202 E HA -0.118 4.211 4.350 -0.036 0.000 0.263 202 E C -0.923 175.712 176.600 0.059 0.000 1.000 202 E CA 1.507 57.894 56.400 -0.023 0.000 0.914 202 E CB 0.219 29.903 29.700 -0.025 0.000 0.948 202 E HN 0.214 8.536 8.360 -0.064 0.000 0.444 203 H N 5.277 124.338 119.070 -0.015 0.000 3.086 203 H HA 0.300 4.876 4.556 0.034 0.000 0.353 203 H C 0.508 175.849 175.328 0.022 0.000 1.134 203 H CA 0.019 56.092 56.048 0.042 0.000 1.248 203 H CB 2.611 32.464 29.762 0.151 0.000 1.878 203 H HN -0.065 8.284 8.280 0.115 0.000 0.527 204 E N 5.937 126.187 120.200 0.083 0.000 2.204 204 E HA -0.229 4.137 4.350 0.027 0.000 0.195 204 E C -0.452 176.220 176.600 0.119 0.000 0.990 204 E CA 1.644 58.085 56.400 0.068 0.000 0.821 204 E CB -0.811 28.876 29.700 -0.022 0.000 0.750 204 E HN 0.681 8.940 8.360 -0.169 0.000 0.477 205 A N -0.623 122.374 122.820 0.295 0.000 2.218 205 A HA 0.083 4.327 4.320 -0.126 0.000 0.209 205 A C -0.717 176.801 177.584 -0.111 0.000 1.168 205 A CA 0.212 52.178 52.037 -0.118 0.000 0.804 205 A CB 0.888 19.541 19.000 -0.578 0.000 0.834 205 A HN -0.313 8.330 8.150 0.868 0.027 0.482 206 A N -1.788 121.118 122.820 0.143 0.000 2.260 206 A HA 0.165 4.668 4.320 0.305 0.000 0.314 206 A C -0.618 176.969 177.584 0.005 0.000 1.257 206 A CA -0.904 51.258 52.037 0.210 0.000 0.871 206 A CB 0.704 19.854 19.000 0.250 0.000 1.166 206 A HN -0.694 7.426 8.150 0.210 0.156 0.522 207 K N 5.062 125.391 120.400 -0.119 0.000 2.148 207 K HA -0.099 3.973 4.320 -0.414 0.000 0.204 207 K C 0.196 176.428 176.600 -0.614 0.000 1.050 207 K CA 1.841 57.833 56.287 -0.493 0.000 0.942 207 K CB 0.457 32.525 32.500 -0.719 0.000 0.724 207 K HN 0.352 8.578 8.250 -0.041 0.000 0.446 208 W N -3.377 117.965 121.300 0.070 0.000 2.781 208 W HA 0.235 4.827 4.660 -0.113 0.000 0.345 208 W C -1.321 175.129 176.519 -0.115 0.000 1.085 208 W CA -1.819 55.486 57.345 -0.067 0.000 1.198 208 W CB 3.053 32.353 29.460 -0.267 0.000 1.423 208 W HN -0.476 7.738 8.180 0.089 0.020 0.532 209 S N -1.703 114.031 115.700 0.056 0.000 2.727 209 S HA 0.473 4.444 4.470 -0.832 0.000 0.278 209 S C 0.710 175.248 174.600 -0.104 0.000 1.186 209 S CA -1.205 56.809 58.200 -0.311 0.000 0.836 209 S CB 2.349 65.432 63.200 -0.194 0.000 1.186 209 S HN 0.440 8.838 8.310 0.148 0.000 0.499 210 R N -0.722 119.673 120.500 -0.176 0.000 2.159 210 R HA -0.201 4.292 4.340 0.256 0.000 0.237 210 R C 0.977 177.335 176.300 0.096 0.000 1.131 210 R CA 3.096 59.245 56.100 0.082 0.000 0.982 210 R CB 0.140 30.468 30.300 0.047 0.000 0.868 210 R HN 0.280 8.352 8.270 -0.330 0.000 0.453 211 T N -5.751 108.833 114.554 0.049 0.000 3.122 211 T HA 0.051 4.445 4.350 0.073 0.000 0.250 211 T C 0.378 175.139 174.700 0.100 0.000 1.067 211 T CA -0.386 61.754 62.100 0.066 0.000 0.966 211 T CB 0.198 69.087 68.868 0.035 0.000 1.002 211 T HN -0.648 7.570 8.240 0.010 0.028 0.542 212 S N 2.576 118.359 115.700 0.139 0.000 2.589 212 S HA -0.160 4.433 4.470 0.206 0.000 0.265 212 S C -0.409 174.321 174.600 0.217 0.000 1.342 212 S CA 1.197 59.527 58.200 0.216 0.000 1.005 212 S CB 0.799 64.203 63.200 0.340 0.000 0.909 212 S HN -0.650 7.686 8.310 0.133 0.054 0.555 213 E N 1.970 122.323 120.200 0.255 0.000 2.159 213 E HA 0.025 4.488 4.350 0.188 0.000 0.272 213 E C 0.006 176.766 176.600 0.267 0.000 1.138 213 E CA -0.246 56.292 56.400 0.229 0.000 0.915 213 E CB -0.211 29.619 29.700 0.216 0.000 1.028 213 E HN 0.553 9.088 8.360 0.292 0.000 0.423 214 V N 6.694 126.770 119.914 0.269 0.000 2.594 214 V HA -0.374 3.989 4.120 0.405 0.000 0.253 214 V C 0.583 176.920 176.094 0.404 0.000 1.069 214 V CA 2.781 65.302 62.300 0.368 0.000 1.082 214 V CB 0.248 32.285 31.823 0.356 0.000 0.680 214 V HN 0.698 9.027 8.190 0.233 0.000 0.469 215 V N -0.170 119.949 119.914 0.341 0.000 2.358 215 V HA -0.512 3.840 4.120 0.387 0.000 0.246 215 V C 1.820 178.014 176.094 0.166 0.000 1.047 215 V CA 4.341 66.815 62.300 0.291 0.000 1.035 215 V CB -0.473 31.463 31.823 0.189 0.000 0.658 215 V HN 0.112 8.463 8.190 0.292 0.014 0.452 216 E N -1.075 119.230 120.200 0.175 0.000 2.077 216 E HA -0.321 4.108 4.350 0.131 0.000 0.193 216 E C 2.040 178.646 176.600 0.009 0.000 0.989 216 E CA 2.667 59.176 56.400 0.182 0.000 0.800 216 E CB -0.550 29.374 29.700 0.375 0.000 0.746 216 E HN -0.707 7.779 8.360 0.210 0.000 0.452 217 F N -0.134 119.520 119.950 -0.493 0.000 2.069 217 F HA -0.350 2.733 4.527 -2.407 0.000 0.298 217 F C 1.710 177.201 175.800 -0.514 0.000 1.113 217 F CA 1.498 58.785 58.000 -1.188 0.000 1.214 217 F CB -0.274 38.218 39.000 -0.847 0.000 0.978 217 F HN -0.552 7.766 8.300 0.030 0.000 0.474 218 A N -0.437 122.270 122.820 -0.188 0.000 1.903 218 A HA -0.443 3.859 4.320 -0.031 0.000 0.219 218 A C 2.186 179.657 177.584 -0.188 0.000 1.191 218 A CA 3.193 55.144 52.037 -0.144 0.000 0.638 218 A CB -0.782 18.100 19.000 -0.197 0.000 0.823 218 A HN 0.275 8.429 8.150 0.007 0.000 0.451 219 R N -4.052 116.251 120.500 -0.327 0.000 2.237 219 R HA -0.206 3.463 4.340 -1.118 0.000 0.219 219 R C 1.061 177.194 176.300 -0.279 0.000 1.080 219 R CA 2.120 57.870 56.100 -0.584 0.000 0.995 219 R CB -0.182 29.813 30.300 -0.508 0.000 0.875 219 R HN -0.672 7.432 8.270 -0.256 0.012 0.462 220 D N -2.895 117.461 120.400 -0.073 0.000 2.350 220 D HA 0.032 4.729 4.640 0.094 0.000 0.213 220 D C -0.798 175.555 176.300 0.088 0.000 1.031 220 D CA 0.878 54.928 54.000 0.085 0.000 0.861 220 D CB 0.842 41.828 40.800 0.312 0.000 0.926 220 D HN -0.425 7.713 8.370 -0.121 0.160 0.520 221 L N -2.592 118.675 121.223 0.074 0.000 2.334 221 L HA 0.160 4.506 4.340 0.010 0.000 0.276 221 L C -1.691 175.227 176.870 0.081 0.000 1.014 221 L CA -0.930 53.928 54.840 0.030 0.000 0.815 221 L CB 1.886 43.867 42.059 -0.129 0.000 1.268 221 L HN -0.687 7.458 8.230 0.123 0.159 0.428 222 N N -1.266 117.341 118.700 -0.155 0.000 2.509 222 N HA 0.215 4.789 4.740 -0.277 0.000 0.254 222 N C -0.822 174.403 175.510 -0.474 0.000 1.064 222 N CA 0.700 53.511 53.050 -0.398 0.000 0.865 222 N CB 3.403 41.481 38.487 -0.682 0.000 1.659 222 N HN 0.634 9.260 8.380 -0.174 -0.350 0.495 223 H N 0.157 119.203 119.070 -0.040 0.000 2.472 223 H HA 0.585 5.107 4.556 -0.057 0.000 0.338 223 H C -2.576 172.681 175.328 -0.118 0.000 1.133 223 H CA -2.222 53.790 56.048 -0.061 0.000 1.216 223 H CB 0.832 30.577 29.762 -0.028 0.000 1.497 223 H HN -0.204 8.205 8.280 -0.285 -0.300 0.500 224 P HA 0.235 4.797 4.420 -0.132 -0.221 0.281 224 P C -0.452 176.791 177.300 -0.096 0.000 1.249 224 P CA -1.310 61.750 63.100 -0.067 0.000 0.810 224 P CB 1.601 33.287 31.700 -0.024 0.000 1.008 225 L N -0.554 120.560 121.223 -0.182 0.000 3.995 225 L HA -0.412 3.736 4.340 -0.320 0.000 0.513 225 L C -1.742 174.857 176.870 -0.451 0.000 1.147 225 L CA 0.546 55.209 54.840 -0.295 0.000 0.703 225 L CB -1.418 40.492 42.059 -0.248 0.000 1.306 225 L HN -0.246 7.868 8.230 -0.192 0.000 0.779 226 N N -1.147 117.240 118.700 -0.522 0.000 2.407 226 N HA -0.168 4.226 4.740 -0.576 0.000 0.250 226 N C 1.709 176.758 175.510 -0.769 0.000 1.236 226 N CA 0.801 53.389 53.050 -0.770 0.000 0.879 226 N CB 0.909 38.531 38.487 -1.443 0.000 1.088 226 N HN -0.410 7.681 8.380 -0.481 0.000 0.450 227 C N -0.091 118.866 119.300 -0.571 0.000 2.411 227 C HA -0.234 4.023 4.460 -0.338 0.000 0.279 227 C C 1.526 176.417 174.990 -0.165 0.000 1.288 227 C CA 2.878 61.711 59.018 -0.310 0.000 1.764 227 C CB -0.949 26.725 27.740 -0.110 0.000 1.974 227 C HN 0.863 8.800 8.230 -0.487 0.000 0.498 228 F N -3.676 116.235 119.950 -0.065 0.000 2.802 228 F HA 0.278 4.987 4.527 0.009 -0.176 0.300 228 F C 1.004 176.755 175.800 -0.081 0.000 1.168 228 F CA -1.181 56.793 58.000 -0.044 0.000 1.433 228 F CB -2.154 36.809 39.000 -0.060 0.000 1.115 228 F HN -0.473 7.402 8.300 -0.672 0.022 0.582 229 M N 0.877 120.333 119.600 -0.241 0.000 2.374 229 M HA -0.380 4.080 4.480 -0.033 0.000 0.264 229 M C 0.020 176.245 176.300 -0.124 0.000 1.067 229 M CA 4.093 59.303 55.300 -0.151 0.000 1.103 229 M CB -0.158 32.286 32.600 -0.259 0.000 1.402 229 M HN -0.273 7.578 8.290 -0.474 0.154 0.444 230 C N -6.625 112.542 119.300 -0.221 0.000 3.403 230 C HA 0.512 5.052 4.460 -0.204 -0.203 0.317 230 C C -0.939 173.838 174.990 -0.355 0.000 1.346 230 C CA -1.363 57.456 59.018 -0.332 0.000 1.743 230 C CB 1.179 28.602 27.740 -0.528 0.000 2.308 230 C HN -0.793 7.260 8.230 -0.256 0.023 0.675 231 H N -0.607 118.473 119.070 0.017 0.000 2.823 231 H HA 0.505 5.215 4.556 -0.005 -0.157 0.332 231 H C -1.663 173.686 175.328 0.036 0.000 0.980 231 H CA -1.884 54.168 56.048 0.006 0.000 1.286 231 H CB 1.757 31.505 29.762 -0.023 0.000 1.541 231 H HN -0.609 7.570 8.280 0.006 0.104 0.521 232 D N 4.100 124.582 120.400 0.136 0.000 2.450 232 D HA 0.037 4.731 4.640 0.091 0.000 0.247 232 D C -0.041 176.279 176.300 0.033 0.000 1.162 232 D CA -0.943 53.111 54.000 0.090 0.000 0.879 232 D CB 2.057 42.923 40.800 0.109 0.000 1.163 232 D HN 0.103 8.548 8.370 0.125 0.000 0.472 233 P HA -0.137 4.343 4.420 0.100 0.000 0.223 233 P C 0.913 178.209 177.300 -0.005 0.000 1.151 233 P CA 1.616 64.661 63.100 -0.092 0.000 0.787 233 P CB 0.389 31.887 31.700 -0.337 0.000 0.788 234 H N -1.068 118.149 119.070 0.245 0.000 2.370 234 H HA -0.031 4.796 4.556 0.452 0.000 0.304 234 H C 2.448 177.907 175.328 0.218 0.000 1.055 234 H CA 3.447 59.688 56.048 0.321 0.000 1.373 234 H CB 0.982 30.911 29.762 0.278 0.000 1.423 234 H HN 0.141 8.568 8.280 -0.148 -0.236 0.533 235 S N -1.654 114.165 115.700 0.198 0.000 2.501 235 S HA 0.061 4.688 4.470 0.068 -0.117 0.220 235 S C 0.177 174.723 174.600 -0.090 0.000 0.997 235 S CA 0.705 58.947 58.200 0.070 0.000 0.919 235 S CB 1.346 64.595 63.200 0.081 0.000 0.778 235 S HN -0.351 8.354 8.310 0.198 -0.276 0.523 236 A N 0.263 122.967 122.820 -0.193 0.000 3.153 236 A HA -0.363 3.844 4.320 -0.402 -0.129 0.265 236 A C -0.390 177.104 177.584 -0.150 0.000 1.212 236 A CA 0.939 52.737 52.037 -0.398 0.000 1.018 236 A CB -1.865 16.628 19.000 -0.846 0.000 1.130 236 A HN -0.151 7.938 8.150 -0.102 0.000 0.873 237 G N -2.106 106.675 108.800 -0.032 0.000 2.562 237 G HA2 0.300 4.269 3.960 0.015 0.000 0.275 237 G HA3 0.300 4.280 3.960 0.033 0.000 0.275 237 G C -2.920 172.034 174.900 0.090 0.000 1.196 237 G CA -2.295 42.821 45.100 0.028 0.000 0.908 237 G HN -0.429 7.798 8.290 -0.012 0.055 0.524 238 P HA 0.428 5.089 4.420 0.117 -0.170 0.275 238 P C -1.114 176.224 177.300 0.064 0.000 1.227 238 P CA -0.560 62.596 63.100 0.093 0.000 0.781 238 P CB 0.924 32.674 31.700 0.083 0.000 0.906 239 R N -2.231 118.291 120.500 0.036 0.000 2.747 239 R HA 0.784 5.277 4.340 0.048 -0.124 0.272 239 R C -2.094 174.213 176.300 0.012 0.000 1.032 239 R CA -1.269 54.855 56.100 0.040 0.000 0.896 239 R CB 3.720 34.060 30.300 0.067 0.000 1.253 239 R HN 0.058 8.329 8.270 0.003 0.000 0.461 240 V N -6.273 113.654 119.914 0.022 0.000 2.960 240 V HA 0.904 5.250 4.120 -0.010 -0.231 0.315 240 V C -0.639 175.471 176.094 0.026 0.000 1.087 240 V CA -3.181 59.123 62.300 0.006 0.000 0.982 240 V CB 4.153 35.974 31.823 -0.003 0.000 1.039 240 V HN 0.452 8.661 8.190 0.032 0.000 0.437 241 V N -4.890 115.033 119.914 0.015 0.000 3.604 241 V HA 0.420 4.576 4.120 0.060 0.000 0.277 241 V C -0.604 175.495 176.094 0.007 0.000 1.399 241 V CA -1.738 60.584 62.300 0.035 0.000 1.034 241 V CB 1.761 33.620 31.823 0.061 0.000 0.824 241 V HN 0.375 8.904 8.190 -0.005 -0.341 0.439 242 R N 2.544 123.020 120.500 -0.041 0.000 2.351 242 R HA -0.083 4.211 4.340 -0.077 0.000 0.318 242 R C 0.333 176.537 176.300 -0.160 0.000 1.055 242 R CA -1.041 55.002 56.100 -0.095 0.000 0.968 242 R CB -0.200 30.039 30.300 -0.101 0.000 0.974 242 R HN -0.879 7.549 8.270 -0.043 -0.183 0.439 243 D N 8.027 128.358 120.400 -0.115 0.000 2.116 243 D HA -0.274 4.383 4.640 0.029 0.000 0.193 243 D C 1.701 177.738 176.300 -0.438 0.000 0.998 243 D CA 3.445 57.337 54.000 -0.181 0.000 0.836 243 D CB -0.898 39.770 40.800 -0.220 0.000 0.951 243 D HN 0.176 8.512 8.370 -0.056 0.000 0.449 244 G N -1.127 107.288 108.800 -0.641 0.000 2.432 244 G HA2 -0.255 3.317 3.960 -0.647 0.000 0.219 244 G HA3 -0.255 2.945 3.960 -1.267 0.000 0.219 244 G C 1.273 175.398 174.900 -1.293 0.000 1.135 244 G CA 1.610 46.115 45.100 -0.992 0.000 0.767 244 G HN 0.235 8.190 8.290 -0.560 0.000 0.550 245 L N 2.185 122.621 121.223 -1.310 0.000 2.044 245 L HA -0.189 3.643 4.340 -0.847 0.000 0.205 245 L C 1.468 178.042 176.870 -0.493 0.000 1.075 245 L CA 2.297 56.648 54.840 -0.814 0.000 0.747 245 L CB -0.059 41.754 42.059 -0.409 0.000 0.903 245 L HN -0.863 6.655 8.230 -1.165 0.013 0.435 246 I N -0.521 119.873 120.570 -0.293 0.000 2.208 246 I HA -0.575 3.525 4.170 -0.117 0.000 0.245 246 I C 2.228 178.298 176.117 -0.077 0.000 1.097 246 I CA 4.409 65.645 61.300 -0.108 0.000 1.363 246 I CB -0.588 37.453 38.000 0.069 0.000 1.051 246 I HN -0.556 7.488 8.210 -0.278 0.000 0.413 247 N N -0.254 118.382 118.700 -0.108 0.000 2.120 247 N HA -0.415 4.547 4.740 0.071 -0.179 0.188 247 N C 1.602 177.037 175.510 -0.125 0.000 1.024 247 N CA 3.821 56.831 53.050 -0.067 0.000 0.852 247 N CB 0.347 38.731 38.487 -0.171 0.000 1.003 247 N HN -0.115 8.141 8.380 -0.198 0.005 0.424 248 A N 0.153 122.810 122.820 -0.270 0.000 1.855 248 A HA -0.270 3.976 4.320 -0.123 0.000 0.215 248 A C 2.099 179.541 177.584 -0.236 0.000 1.191 248 A CA 3.112 54.987 52.037 -0.270 0.000 0.613 248 A CB -0.290 18.416 19.000 -0.490 0.000 0.829 248 A HN -0.661 7.263 8.150 -0.378 0.000 0.442 249 V N -2.329 117.382 119.914 -0.339 0.000 2.379 249 V HA -0.413 3.663 4.120 -0.073 0.000 0.245 249 V C 2.316 178.395 176.094 -0.025 0.000 1.044 249 V CA 4.260 66.466 62.300 -0.157 0.000 1.036 249 V CB 0.311 32.036 31.823 -0.162 0.000 0.664 249 V HN -0.336 7.606 8.190 -0.414 0.000 0.453 250 V N -1.044 118.847 119.914 -0.039 0.000 2.602 250 V HA -0.303 3.825 4.120 0.013 0.000 0.235 250 V C 2.233 178.336 176.094 0.014 0.000 1.087 250 V CA 3.451 65.750 62.300 -0.002 0.000 1.117 250 V CB 0.476 32.293 31.823 -0.011 0.000 0.820 250 V HN 0.102 8.250 8.190 -0.070 0.000 0.490 251 D N 2.205 122.618 120.400 0.021 0.000 2.104 251 D HA -0.201 4.460 4.640 0.035 0.000 0.194 251 D C 1.801 178.128 176.300 0.045 0.000 0.994 251 D CA 3.063 57.088 54.000 0.042 0.000 0.830 251 D CB -0.308 40.541 40.800 0.081 0.000 0.959 251 D HN -0.651 7.732 8.370 0.020 0.000 0.452 252 R N -4.019 116.508 120.500 0.045 0.000 2.310 252 R HA 0.105 4.487 4.340 0.070 0.000 0.202 252 R C 0.259 176.607 176.300 0.080 0.000 0.933 252 R CA -0.238 55.903 56.100 0.068 0.000 1.054 252 R CB 0.145 30.496 30.300 0.085 0.000 0.985 252 R HN -0.363 7.924 8.270 0.028 0.000 0.489 253 G N -0.693 108.147 108.800 0.067 0.000 2.203 253 G HA2 -0.324 3.730 3.960 0.065 0.000 0.263 253 G HA3 -0.324 3.678 3.960 0.070 0.000 0.263 253 G C 0.363 175.328 174.900 0.108 0.000 1.012 253 G CA 1.293 46.438 45.100 0.075 0.000 0.749 253 G HN -0.406 7.737 8.290 0.051 0.177 0.512 254 L N -1.542 119.770 121.223 0.148 0.000 2.313 254 L HA -0.125 4.327 4.340 0.187 0.000 0.214 254 L C 0.184 177.198 176.870 0.239 0.000 1.119 254 L CA 0.790 55.766 54.840 0.228 0.000 0.809 254 L CB 0.197 42.491 42.059 0.392 0.000 0.933 254 L HN -0.821 7.469 8.230 0.133 0.021 0.449 255 G N -5.327 103.603 108.800 0.217 0.000 2.730 255 G HA2 -0.355 3.708 3.960 0.171 0.000 0.686 255 G HA3 -0.355 3.719 3.960 0.190 0.000 0.686 255 G C 0.101 175.203 174.900 0.338 0.000 1.343 255 G CA -0.608 44.621 45.100 0.215 0.000 0.826 255 G HN -0.604 7.765 8.290 0.172 0.023 0.582 256 T N -1.671 113.053 114.554 0.283 0.000 2.915 256 T HA -0.289 4.297 4.350 0.392 0.000 0.269 256 T C -0.725 173.956 174.700 -0.031 0.000 1.071 256 T CA 2.892 65.157 62.100 0.274 0.000 1.132 256 T CB 0.375 69.392 68.868 0.250 0.000 0.878 256 T HN 0.402 8.793 8.240 0.252 0.000 0.479 257 Y N 0.609 120.949 120.300 0.066 0.000 2.749 257 Y HA 0.460 4.703 4.550 -0.513 0.000 0.343 257 Y C -1.924 173.784 175.900 -0.319 0.000 1.015 257 Y CA -2.444 55.505 58.100 -0.252 0.000 1.270 257 Y CB 0.410 38.793 38.460 -0.129 0.000 1.097 257 Y HN -0.367 8.098 8.280 0.309 0.000 0.571 258 P HA 0.024 4.609 4.420 -0.029 -0.182 0.222 258 P C -0.438 176.843 177.300 -0.032 0.000 1.147 258 P CA 1.172 64.157 63.100 -0.191 0.000 0.790 258 P CB 0.425 31.952 31.700 -0.288 0.000 0.780 259 H N -4.799 114.072 119.070 -0.332 0.000 2.551 259 H HA 0.041 4.529 4.556 -0.113 0.000 0.266 259 H C -0.304 174.977 175.328 -0.078 0.000 0.977 259 H CA 0.091 56.044 56.048 -0.160 0.000 1.163 259 H CB 0.191 29.872 29.762 -0.135 0.000 1.381 259 H HN -0.297 7.809 8.280 -0.242 0.029 0.581 260 D N -1.320 119.117 120.400 0.060 0.000 2.330 260 D HA 0.393 5.049 4.640 0.028 0.000 0.249 260 D C -2.088 174.238 176.300 0.043 0.000 1.306 260 D CA -2.930 51.093 54.000 0.037 0.000 0.956 260 D CB 1.010 41.812 40.800 0.003 0.000 1.261 260 D HN -0.323 7.915 8.370 0.048 0.162 0.544 261 P HA -0.099 4.358 4.420 0.061 0.000 0.218 261 P C 1.156 178.476 177.300 0.033 0.000 1.149 261 P CA 1.775 64.901 63.100 0.043 0.000 0.817 261 P CB 0.849 32.569 31.700 0.033 0.000 0.785 262 V N -0.735 119.185 119.914 0.010 0.000 2.270 262 V HA -0.503 3.620 4.120 0.006 0.000 0.245 262 V C 1.578 177.661 176.094 -0.018 0.000 1.043 262 V CA 4.358 66.656 62.300 -0.003 0.000 1.014 262 V CB -0.243 31.571 31.823 -0.016 0.000 0.645 262 V HN -0.413 7.897 8.190 0.004 -0.117 0.447 263 K N -0.210 120.154 120.400 -0.061 0.000 2.147 263 K HA -0.301 4.087 4.320 -0.146 -0.156 0.205 263 K C 2.504 179.081 176.600 -0.037 0.000 1.049 263 K CA 2.935 59.129 56.287 -0.155 0.000 0.936 263 K CB -0.221 32.040 32.500 -0.398 0.000 0.722 263 K HN -0.573 7.913 8.250 -0.064 -0.274 0.446 264 S N -0.311 115.446 115.700 0.095 0.000 2.382 264 S HA -0.316 4.376 4.470 0.370 0.000 0.228 264 S C 1.067 175.752 174.600 0.142 0.000 1.027 264 S CA 3.236 61.567 58.200 0.218 0.000 0.991 264 S CB 0.021 63.334 63.200 0.189 0.000 0.823 264 S HN -0.202 8.143 8.310 0.075 0.010 0.469 265 E N 0.296 120.545 120.200 0.082 0.000 2.107 265 E HA -0.296 4.095 4.350 0.069 0.000 0.191 265 E C 2.596 179.229 176.600 0.055 0.000 0.982 265 E CA 2.310 58.747 56.400 0.062 0.000 0.809 265 E CB -0.065 29.660 29.700 0.041 0.000 0.756 265 E HN -0.676 7.630 8.360 0.063 0.092 0.459 266 Q N -1.944 117.879 119.800 0.039 0.000 2.172 266 Q HA -0.169 4.189 4.340 0.030 0.000 0.200 266 Q C 1.717 177.750 176.000 0.056 0.000 0.964 266 Q CA 1.950 57.772 55.803 0.031 0.000 0.855 266 Q CB 0.836 29.574 28.738 0.000 0.000 0.918 266 Q HN -0.620 7.666 8.270 0.027 0.000 0.444 267 Q N -1.807 118.048 119.800 0.091 0.000 2.773 267 Q HA 0.237 4.655 4.340 0.130 0.000 0.373 267 Q C -0.881 175.245 176.000 0.209 0.000 0.940 267 Q CA -1.412 54.485 55.803 0.157 0.000 1.015 267 Q CB 0.748 29.605 28.738 0.199 0.000 1.349 267 Q HN -0.229 8.097 8.270 0.093 0.000 0.413 268 G N -0.604 108.282 108.800 0.143 0.000 2.557 268 G HA2 0.283 4.392 3.960 0.160 0.000 0.302 268 G HA3 0.283 4.330 3.960 0.106 -0.024 0.302 268 G C -2.815 172.150 174.900 0.107 0.000 1.311 268 G CA -1.886 43.292 45.100 0.132 0.000 1.030 268 G HN 0.125 8.795 8.290 0.113 -0.313 0.509 269 M N -0.701 118.949 119.600 0.083 0.000 2.393 269 M HA 0.825 5.540 4.480 0.061 -0.198 0.299 269 M C -1.342 174.981 176.300 0.037 0.000 1.103 269 M CA -0.634 54.701 55.300 0.059 0.000 0.910 269 M CB 4.224 36.853 32.600 0.047 0.000 1.659 269 M HN 0.156 8.494 8.290 0.081 0.000 0.445 270 T N 6.838 121.408 114.554 0.027 0.000 2.791 270 T HA 0.335 4.688 4.350 0.004 0.000 0.288 270 T C -1.798 172.898 174.700 -0.007 0.000 0.999 270 T CA -0.590 61.515 62.100 0.008 0.000 0.952 270 T CB 1.254 70.128 68.868 0.009 0.000 0.938 270 T HN 0.531 8.790 8.240 0.032 0.000 0.444 271 K N 8.919 129.301 120.400 -0.029 0.000 2.383 271 K HA 0.162 4.650 4.320 -0.045 -0.195 0.286 271 K C -0.569 175.978 176.600 -0.088 0.000 1.051 271 K CA 0.140 56.391 56.287 -0.060 0.000 0.974 271 K CB 0.525 32.970 32.500 -0.091 0.000 0.968 271 K HN 0.370 8.603 8.250 -0.029 0.000 0.475 272 V N 9.472 129.331 119.914 -0.091 0.000 2.448 272 V HA 0.216 4.218 4.120 -0.197 0.000 0.295 272 V C -1.299 174.641 176.094 -0.257 0.000 1.025 272 V CA -0.863 61.330 62.300 -0.179 0.000 0.859 272 V CB 2.461 34.198 31.823 -0.143 0.000 0.988 272 V HN 0.631 8.790 8.190 -0.053 0.000 0.431 273 T N 8.161 122.504 114.554 -0.351 0.000 2.823 273 T HA 0.464 4.858 4.350 -0.177 -0.151 0.279 273 T C -0.982 173.448 174.700 -0.451 0.000 0.998 273 T CA -0.632 61.298 62.100 -0.284 0.000 0.994 273 T CB 1.773 70.525 68.868 -0.194 0.000 0.960 273 T HN 0.138 8.173 8.240 -0.342 0.000 0.448 274 F N 4.780 124.744 119.950 0.025 0.000 2.443 274 F HA 0.277 4.846 4.527 0.071 0.000 0.335 274 F C -1.062 174.822 175.800 0.140 0.000 1.104 274 F CA -1.086 56.964 58.000 0.083 0.000 1.013 274 F CB 2.761 41.825 39.000 0.106 0.000 1.136 274 F HN 0.389 8.808 8.300 0.200 0.000 0.470 275 Q N 1.614 121.579 119.800 0.274 0.000 2.248 275 Q HA 0.577 5.206 4.340 0.255 -0.137 0.263 275 Q C -0.374 175.731 176.000 0.174 0.000 1.007 275 Q CA -1.106 54.828 55.803 0.218 0.000 0.877 275 Q CB 3.357 32.171 28.738 0.126 0.000 1.315 275 Q HN 0.229 8.651 8.270 0.253 0.000 0.454 276 R N -0.511 120.054 120.500 0.107 0.000 2.532 276 R HA 0.342 4.671 4.340 -0.018 0.000 0.297 276 R C 0.261 176.582 176.300 0.036 0.000 0.984 276 R CA -1.441 54.647 56.100 -0.021 0.000 0.884 276 R CB 2.496 32.629 30.300 -0.278 0.000 1.182 276 R HN 0.311 8.679 8.270 0.163 0.000 0.442 277 G N 6.028 114.837 108.800 0.016 0.000 2.305 277 G HA2 -0.400 3.564 3.960 0.007 0.000 0.287 277 G HA3 -0.400 3.565 3.960 0.009 0.000 0.287 277 G C -0.442 174.474 174.900 0.028 0.000 1.036 277 G CA 0.657 45.766 45.100 0.015 0.000 0.887 277 G HN 0.814 9.108 8.290 0.007 0.000 0.505 278 R N -6.658 113.865 120.500 0.039 0.000 3.758 278 R HA -0.441 4.088 4.340 0.044 -0.162 0.299 278 R C -0.713 175.617 176.300 0.051 0.000 1.182 278 R CA 0.747 56.870 56.100 0.039 0.000 0.809 278 R CB -2.750 27.561 30.300 0.018 0.000 1.249 278 R HN 0.274 8.561 8.270 0.043 0.009 0.497 279 E N 0.260 120.512 120.200 0.088 0.000 2.199 279 E HA 0.222 4.619 4.350 0.079 0.000 0.269 279 E C -1.585 175.139 176.600 0.207 0.000 0.899 279 E CA -1.821 54.649 56.400 0.117 0.000 0.772 279 E CB 2.687 32.449 29.700 0.104 0.000 1.155 279 E HN -0.536 7.732 8.360 0.102 0.154 0.408 280 D N 4.706 125.210 120.400 0.174 0.000 2.525 280 D HA -0.177 4.558 4.640 0.158 0.000 0.235 280 D C -0.575 175.943 176.300 0.363 0.000 1.137 280 D CA 2.110 56.224 54.000 0.189 0.000 0.868 280 D CB -0.250 40.603 40.800 0.088 0.000 1.180 280 D HN 0.395 8.838 8.370 0.121 0.000 0.465 281 F N 5.306 125.304 119.950 0.079 0.000 2.268 281 F HA 0.399 4.789 4.527 -0.228 0.000 0.262 281 F C -2.174 173.621 175.800 -0.008 0.000 0.910 281 F CA -0.095 57.854 58.000 -0.086 0.000 1.142 281 F CB 4.173 43.079 39.000 -0.157 0.000 1.229 281 F HN 0.357 8.828 8.300 0.286 0.000 0.781 282 R N -3.802 116.613 120.500 -0.142 0.000 2.888 282 R HA 0.378 4.609 4.340 -0.182 0.000 0.264 282 R C -2.838 173.487 176.300 0.041 0.000 1.045 282 R CA -1.760 54.238 56.100 -0.171 0.000 0.962 282 R CB 3.141 33.278 30.300 -0.273 0.000 1.210 282 R HN -0.527 7.821 8.270 0.130 0.000 0.479 283 A N -1.195 121.665 122.820 0.067 0.000 2.587 283 A HA 1.092 5.649 4.320 0.084 -0.186 0.293 283 A C -2.092 175.568 177.584 0.127 0.000 1.087 283 A CA -1.229 50.824 52.037 0.028 0.000 0.692 283 A CB 3.401 22.210 19.000 -0.318 0.000 1.291 283 A HN 0.222 8.441 8.150 0.115 0.000 0.407 284 I N -6.053 114.594 120.570 0.128 0.000 3.145 284 I HA 0.566 4.800 4.170 0.106 0.000 0.313 284 I C -2.081 174.074 176.117 0.064 0.000 1.122 284 I CA -2.688 58.686 61.300 0.123 0.000 0.987 284 I CB 3.778 41.893 38.000 0.192 0.000 1.236 284 I HN 0.284 8.560 8.210 0.110 0.000 0.453 285 G N 0.166 108.999 108.800 0.055 0.000 2.814 285 G HA2 0.570 4.722 3.960 0.021 0.000 0.300 285 G HA3 0.570 4.543 3.960 0.021 0.000 0.300 285 G C -1.921 173.007 174.900 0.047 0.000 1.406 285 G CA -0.850 44.269 45.100 0.033 0.000 1.041 285 G HN 0.424 8.750 8.290 0.060 0.000 0.532 286 L N 6.602 127.855 121.223 0.050 0.000 2.367 286 L HA 0.071 4.450 4.340 0.066 0.000 0.275 286 L C -0.384 176.520 176.870 0.055 0.000 1.129 286 L CA 0.063 54.937 54.840 0.058 0.000 0.839 286 L CB 0.400 42.493 42.059 0.057 0.000 1.133 286 L HN 0.499 8.754 8.230 0.042 0.000 0.453 287 L N 3.164 124.424 121.223 0.062 0.000 2.350 287 L HA 0.065 4.613 4.340 0.077 -0.162 0.275 287 L C 0.062 176.974 176.870 0.071 0.000 1.099 287 L CA -0.025 54.859 54.840 0.073 0.000 0.808 287 L CB 0.612 42.719 42.059 0.080 0.000 1.149 287 L HN 0.005 8.272 8.230 0.063 0.000 0.442 288 D N 1.495 121.941 120.400 0.077 0.000 2.178 288 D HA -0.116 4.559 4.640 0.057 0.000 0.202 288 D C 0.092 176.433 176.300 0.067 0.000 0.974 288 D CA 2.640 56.680 54.000 0.068 0.000 0.841 288 D CB 0.509 41.352 40.800 0.072 0.000 0.953 288 D HN 0.191 8.613 8.370 0.087 0.000 0.478 289 T N -5.550 109.053 114.554 0.082 0.000 2.865 289 T HA 0.129 4.519 4.350 0.067 0.000 0.294 289 T C -1.260 173.492 174.700 0.087 0.000 1.119 289 T CA -2.146 60.001 62.100 0.079 0.000 1.007 289 T CB 2.914 71.832 68.868 0.084 0.000 1.225 289 T HN -0.890 7.392 8.240 0.095 0.015 0.515 290 A N 1.545 124.414 122.820 0.081 0.000 3.063 290 A HA -0.003 4.365 4.320 0.081 0.000 0.263 290 A C -0.975 176.662 177.584 0.088 0.000 1.736 290 A CA -0.449 51.637 52.037 0.082 0.000 1.408 290 A CB -0.963 18.087 19.000 0.083 0.000 1.108 290 A HN 0.311 8.506 8.150 0.075 0.000 0.621 291 D N 2.246 122.711 120.400 0.108 0.000 2.441 291 D HA 0.125 4.855 4.640 0.150 0.000 0.221 291 D C 0.563 176.940 176.300 0.129 0.000 1.156 291 D CA -1.464 52.626 54.000 0.149 0.000 0.896 291 D CB 0.269 41.198 40.800 0.215 0.000 1.028 291 D HN -0.599 7.805 8.370 0.107 0.030 0.509 292 S N 7.333 123.093 115.700 0.100 0.000 2.419 292 S HA -0.430 4.059 4.470 0.032 0.000 0.235 292 S C 1.598 176.249 174.600 0.085 0.000 1.019 292 S CA 2.811 61.047 58.200 0.060 0.000 0.982 292 S CB -0.065 63.148 63.200 0.022 0.000 0.789 292 S HN 0.084 8.452 8.310 0.098 0.000 0.490 293 N N 2.707 121.506 118.700 0.165 0.000 2.104 293 N HA -0.233 4.584 4.740 0.128 0.000 0.190 293 N C 2.371 177.991 175.510 0.184 0.000 1.024 293 N CA 2.971 56.140 53.050 0.197 0.000 0.853 293 N CB -0.343 38.366 38.487 0.370 0.000 1.008 293 N HN -0.378 8.328 8.380 0.209 -0.200 0.424 294 V N 0.205 120.232 119.914 0.189 0.000 2.535 294 V HA -0.450 3.827 4.120 0.261 0.000 0.246 294 V C 1.328 177.500 176.094 0.130 0.000 1.045 294 V CA 3.228 65.643 62.300 0.191 0.000 1.058 294 V CB 0.075 32.002 31.823 0.175 0.000 0.689 294 V HN -0.807 7.499 8.190 0.196 0.002 0.461 295 M N -0.304 119.343 119.600 0.078 0.000 2.080 295 M HA -0.476 4.009 4.480 0.008 0.000 0.260 295 M C 2.927 179.245 176.300 0.031 0.000 1.068 295 M CA 4.307 59.619 55.300 0.020 0.000 1.109 295 M CB -0.112 32.468 32.600 -0.033 0.000 1.342 295 M HN -0.666 7.673 8.290 0.080 0.000 0.405 296 C N -2.241 117.085 119.300 0.043 0.000 2.432 296 C HA -0.240 4.254 4.460 0.057 0.000 0.280 296 C C 1.788 176.856 174.990 0.131 0.000 1.353 296 C CA 2.975 62.026 59.018 0.055 0.000 1.766 296 C CB -2.299 25.419 27.740 -0.037 0.000 1.924 296 C HN 0.060 8.315 8.230 0.041 0.000 0.509 297 A N -1.414 121.504 122.820 0.163 0.000 2.216 297 A HA -0.242 4.219 4.320 0.236 0.000 0.214 297 A C 0.612 178.365 177.584 0.282 0.000 1.160 297 A CA 1.889 54.084 52.037 0.264 0.000 0.725 297 A CB -0.900 18.370 19.000 0.451 0.000 0.784 297 A HN -0.517 7.710 8.150 0.159 0.018 0.472 298 Q N -3.902 116.009 119.800 0.185 0.000 2.234 298 Q HA -0.291 4.208 4.340 0.265 0.000 0.206 298 Q C 0.115 176.222 176.000 0.178 0.000 0.980 298 Q CA 2.465 58.378 55.803 0.184 0.000 0.869 298 Q CB 0.423 29.188 28.738 0.045 0.000 0.912 298 Q HN -0.486 7.821 8.270 0.132 0.042 0.436 299 C N -7.384 111.938 119.300 0.035 0.000 3.484 299 C HA 0.306 4.667 4.460 -0.165 0.000 0.543 299 C C 0.556 175.367 174.990 -0.298 0.000 1.395 299 C CA -0.201 58.713 59.018 -0.174 0.000 2.412 299 C CB 2.900 30.459 27.740 -0.301 0.000 3.532 299 C HN -0.637 7.610 8.230 0.066 0.022 0.584 300 H N 4.150 123.143 119.070 -0.130 0.000 2.768 300 H HA 0.146 4.574 4.556 -0.212 0.000 0.219 300 H C -1.661 173.644 175.328 -0.038 0.000 1.898 300 H CA 0.499 56.472 56.048 -0.124 0.000 1.313 300 H CB -2.041 27.646 29.762 -0.125 0.000 1.701 300 H HN -0.086 8.267 8.280 0.122 0.000 0.534 301 V N -6.798 113.157 119.914 0.068 0.000 3.159 301 V HA 0.758 5.043 4.120 -0.070 -0.207 0.308 301 V C -1.388 174.695 176.094 -0.017 0.000 1.190 301 V CA -3.995 58.280 62.300 -0.041 0.000 1.037 301 V CB 3.975 35.682 31.823 -0.193 0.000 1.060 301 V HN -0.530 7.646 8.190 0.078 0.061 0.437 302 E N 1.557 121.667 120.200 -0.150 0.000 2.301 302 E HA 0.327 4.656 4.350 -0.254 -0.131 0.275 302 E C -1.367 175.322 176.600 0.148 0.000 1.030 302 E CA -1.349 54.952 56.400 -0.166 0.000 0.852 302 E CB 1.629 31.077 29.700 -0.420 0.000 1.060 302 E HN -0.152 8.532 8.360 -0.172 -0.427 0.401 303 Y N 1.716 122.068 120.300 0.086 0.000 2.670 303 Y HA 0.719 5.544 4.550 0.235 -0.133 0.334 303 Y C -1.989 174.124 175.900 0.354 0.000 1.185 303 Y CA -2.171 56.031 58.100 0.171 0.000 1.053 303 Y CB 2.556 40.969 38.460 -0.079 0.000 1.298 303 Y HN -0.416 7.701 8.280 -0.271 0.000 0.459 304 N N 0.690 119.542 118.700 0.253 0.000 2.400 304 N HA 0.380 5.240 4.740 0.016 -0.110 0.288 304 N C -1.195 174.545 175.510 0.383 0.000 1.024 304 N CA -1.250 51.869 53.050 0.115 0.000 0.894 304 N CB 2.880 41.266 38.487 -0.170 0.000 1.173 304 N HN 0.260 8.798 8.380 0.262 0.000 0.487 305 C N -0.210 119.337 119.300 0.412 0.000 3.236 305 C HA 0.685 5.561 4.460 0.358 -0.201 0.208 305 C C -1.986 173.197 174.990 0.322 0.000 1.879 305 C CA -3.049 56.245 59.018 0.462 0.000 1.262 305 C CB 0.031 28.174 27.740 0.672 0.000 2.186 305 C HN 0.523 8.916 8.230 0.272 0.000 0.552 306 N N -1.698 117.141 118.700 0.233 0.000 3.521 306 N HA 0.219 5.064 4.740 0.176 0.000 0.228 306 N C -3.621 172.002 175.510 0.190 0.000 1.328 306 N CA -0.709 52.462 53.050 0.202 0.000 0.907 306 N CB -0.497 38.124 38.487 0.222 0.000 1.487 306 N HN -0.691 7.810 8.380 0.201 0.000 0.503 307 P HA 0.276 4.850 4.420 0.090 -0.100 0.274 307 P C -0.909 176.408 177.300 0.028 0.000 1.256 307 P CA -0.576 62.556 63.100 0.053 0.000 0.795 307 P CB 0.879 32.543 31.700 -0.061 0.000 1.038 308 G N -3.435 105.236 108.800 -0.215 0.000 2.726 308 G HA2 0.561 4.117 3.960 -0.673 0.000 0.198 308 G HA3 0.561 4.117 3.960 -0.838 -0.099 0.198 308 G C -2.554 171.612 174.900 -1.224 0.000 1.195 308 G CA 0.732 45.404 45.100 -0.712 0.000 0.951 308 G HN 0.202 8.367 8.290 -0.209 0.000 0.532 309 Y N -3.419 116.270 120.300 -1.019 0.000 2.588 309 Y HA 0.586 5.025 4.550 -0.482 -0.178 0.343 309 Y C -1.273 174.182 175.900 -0.741 0.000 1.065 309 Y CA -1.297 56.294 58.100 -0.848 0.000 1.038 309 Y CB 4.724 42.493 38.460 -1.153 0.000 1.297 309 Y HN 0.216 7.636 8.280 -1.435 0.000 0.467 310 Q N -0.319 119.418 119.800 -0.105 0.000 2.288 310 Q HA 0.423 5.031 4.340 0.051 -0.237 0.254 310 Q C 1.158 177.324 176.000 0.277 0.000 0.932 310 Q CA -0.743 55.098 55.803 0.063 0.000 0.902 310 Q CB 1.224 30.013 28.738 0.086 0.000 1.203 310 Q HN 0.336 8.599 8.270 -0.012 0.000 0.415 311 L N 4.035 125.454 121.223 0.326 0.000 2.083 311 L HA -0.432 4.132 4.340 0.372 0.000 0.209 311 L C 1.077 178.030 176.870 0.139 0.000 1.083 311 L CA 2.767 57.776 54.840 0.282 0.000 0.752 311 L CB -0.062 42.093 42.059 0.160 0.000 0.899 311 L HN 0.468 8.828 8.230 0.269 0.032 0.433 312 S N -2.670 113.099 115.700 0.113 0.000 2.356 312 S HA -0.242 4.258 4.470 0.049 0.000 0.223 312 S C 0.630 175.272 174.600 0.069 0.000 1.032 312 S CA 2.235 60.477 58.200 0.070 0.000 1.005 312 S CB 0.496 63.733 63.200 0.063 0.000 0.867 312 S HN -0.201 8.484 8.310 0.123 -0.302 0.449 313 D N -3.190 117.264 120.400 0.090 0.000 2.525 313 D HA 0.034 4.710 4.640 0.061 0.000 0.231 313 D C 0.458 176.817 176.300 0.098 0.000 1.216 313 D CA -0.728 53.318 54.000 0.076 0.000 0.813 313 D CB 0.375 41.211 40.800 0.059 0.000 1.108 313 D HN -0.479 7.955 8.370 0.107 0.000 0.524 314 G N 1.062 109.958 108.800 0.160 0.000 2.168 314 G HA2 -0.378 3.841 3.960 0.292 0.000 0.263 314 G HA3 -0.378 3.667 3.960 0.141 0.000 0.263 314 G C 0.076 175.078 174.900 0.169 0.000 0.977 314 G CA 0.642 45.855 45.100 0.187 0.000 0.659 314 G HN 0.131 8.538 8.290 0.196 0.000 0.533 315 S N -0.772 115.006 115.700 0.131 0.000 2.592 315 S HA -0.089 4.456 4.470 0.126 0.000 0.271 315 S C -0.604 174.060 174.600 0.108 0.000 1.326 315 S CA -0.554 57.715 58.200 0.115 0.000 1.024 315 S CB 1.440 64.680 63.200 0.067 0.000 0.921 315 S HN -0.472 8.136 8.310 0.111 -0.232 0.527 316 R N 2.876 123.419 120.500 0.071 0.000 2.590 316 R HA -0.001 4.305 4.340 -0.287 -0.138 0.274 316 R C 0.045 176.269 176.300 -0.127 0.000 1.061 316 R CA 0.252 56.284 56.100 -0.113 0.000 1.081 316 R CB 0.280 30.529 30.300 -0.085 0.000 0.984 316 R HN 0.311 8.630 8.270 0.082 0.000 0.448 317 V N 6.204 125.989 119.914 -0.216 0.000 2.350 317 V HA 0.137 4.244 4.120 -0.022 0.000 0.285 317 V C -1.598 174.463 176.094 -0.055 0.000 1.014 317 V CA -0.800 61.464 62.300 -0.060 0.000 0.831 317 V CB 1.795 33.661 31.823 0.072 0.000 1.000 317 V HN 0.658 8.500 8.190 -0.390 0.114 0.433 318 G N 5.497 114.282 108.800 -0.026 0.000 2.535 318 G HA2 0.075 4.012 3.960 -0.038 0.000 0.303 318 G HA3 0.075 4.026 3.960 -0.015 0.000 0.303 318 G C 0.812 175.725 174.900 0.021 0.000 1.237 318 G CA -1.288 43.803 45.100 -0.016 0.000 0.986 318 G HN 0.240 8.521 8.290 -0.015 0.000 0.494 319 M N -0.559 119.060 119.600 0.031 0.000 2.279 319 M HA -0.312 4.209 4.480 0.069 0.000 0.264 319 M C 0.790 177.112 176.300 0.037 0.000 1.062 319 M CA 1.484 56.817 55.300 0.054 0.000 1.099 319 M CB -1.144 31.498 32.600 0.070 0.000 1.394 319 M HN 0.409 8.714 8.290 0.025 0.000 0.426 320 D N -6.227 114.185 120.400 0.021 0.000 2.263 320 D HA -0.239 4.402 4.640 0.001 0.000 0.208 320 D C 0.352 176.652 176.300 0.000 0.000 0.971 320 D CA 1.727 55.730 54.000 0.006 0.000 0.867 320 D CB -0.832 39.970 40.800 0.004 0.000 0.929 320 D HN 0.150 8.512 8.370 0.019 0.019 0.492 321 D N 0.372 120.776 120.400 0.007 0.000 2.302 321 D HA 0.033 4.672 4.640 -0.003 0.000 0.248 321 D C 1.037 177.331 176.300 -0.010 0.000 1.094 321 D CA -0.219 53.782 54.000 0.001 0.000 0.897 321 D CB 2.003 42.812 40.800 0.014 0.000 1.200 321 D HN -0.540 7.693 8.370 0.015 0.146 0.429 322 R N 4.368 124.854 120.500 -0.023 0.000 2.159 322 R HA -0.321 4.000 4.340 -0.032 0.000 0.237 322 R C 2.544 178.814 176.300 -0.051 0.000 1.131 322 R CA 2.819 58.899 56.100 -0.033 0.000 0.982 322 R CB -0.172 30.109 30.300 -0.033 0.000 0.868 322 R HN 0.529 8.787 8.270 -0.021 0.000 0.453 323 R N -2.811 117.633 120.500 -0.093 0.000 2.293 323 R HA -0.241 3.915 4.340 -0.306 0.000 0.219 323 R C 0.811 176.983 176.300 -0.213 0.000 1.091 323 R CA 2.214 58.176 56.100 -0.229 0.000 1.004 323 R CB -0.355 29.798 30.300 -0.244 0.000 0.865 323 R HN -0.187 8.369 8.270 -0.071 -0.329 0.469 324 A N -4.006 118.780 122.820 -0.057 0.000 2.209 324 A HA -0.102 4.362 4.320 0.002 -0.142 0.212 324 A C -1.198 176.439 177.584 0.088 0.000 1.158 324 A CA 0.593 52.643 52.037 0.021 0.000 0.742 324 A CB 0.837 19.881 19.000 0.073 0.000 0.790 324 A HN -0.424 7.671 8.150 -0.025 0.040 0.472 325 N N -2.105 116.642 118.700 0.078 0.000 2.664 325 N HA 0.237 5.244 4.740 0.210 -0.141 0.257 325 N C -1.933 173.656 175.510 0.132 0.000 1.108 325 N CA -0.356 52.781 53.050 0.143 0.000 0.822 325 N CB 0.901 39.473 38.487 0.141 0.000 1.199 325 N HN -0.735 7.518 8.380 0.035 0.147 0.529 326 H N 6.113 125.214 119.070 0.051 0.000 2.947 326 H HA 0.272 4.793 4.556 -0.058 0.000 0.354 326 H C -2.422 173.024 175.328 0.196 0.000 1.085 326 H CA -0.391 55.625 56.048 -0.054 0.000 1.253 326 H CB 3.589 33.112 29.762 -0.398 0.000 1.757 326 H HN 0.294 8.742 8.280 0.279 0.000 0.523 327 F N 6.497 126.112 119.950 -0.558 0.000 2.371 327 F HA 0.217 4.748 4.527 0.006 0.000 0.363 327 F C -0.017 175.524 175.800 -0.430 0.000 1.122 327 F CA -2.605 55.239 58.000 -0.260 0.000 1.129 327 F CB -0.455 38.475 39.000 -0.117 0.000 1.173 327 F HN 0.595 8.750 8.300 -0.240 0.000 0.489 328 F N 3.336 123.372 119.950 0.143 0.000 2.234 328 F HA -0.182 4.490 4.527 0.242 0.000 0.299 328 F C 0.933 177.026 175.800 0.489 0.000 1.087 328 F CA 2.516 60.691 58.000 0.292 0.000 1.340 328 F CB 0.740 39.979 39.000 0.399 0.000 1.031 328 F HN -0.085 8.491 8.300 0.459 0.000 0.500 329 W N -2.714 118.863 121.300 0.461 0.000 5.963 329 W HA -0.400 4.618 4.660 0.597 0.000 0.400 329 W C -2.406 174.516 176.519 0.672 0.000 1.530 329 W CA -0.160 57.514 57.345 0.548 0.000 1.004 329 W CB -1.497 28.214 29.460 0.418 0.000 2.706 329 W HN -0.169 8.503 8.180 0.821 0.000 1.495 330 A N -0.752 122.471 122.820 0.673 0.000 2.455 330 A HA 0.217 4.900 4.320 0.605 0.000 0.300 330 A C -1.849 176.065 177.584 0.550 0.000 1.040 330 A CA -1.226 51.174 52.037 0.604 0.000 0.697 330 A CB 2.901 22.215 19.000 0.522 0.000 1.265 330 A HN -0.581 7.959 8.150 0.649 0.000 0.407 331 N N 2.402 121.393 118.700 0.486 0.000 2.294 331 N HA -0.086 4.792 4.740 0.229 0.000 0.248 331 N C 1.045 176.388 175.510 -0.278 0.000 1.300 331 N CA -0.756 52.417 53.050 0.206 0.000 0.925 331 N CB 0.384 39.068 38.487 0.328 0.000 1.188 331 N HN 0.047 8.780 8.380 0.587 0.000 0.512 332 V N -1.192 118.093 119.914 -1.048 0.000 2.407 332 V HA -0.289 2.497 4.120 -2.222 0.000 0.248 332 V C 1.116 176.880 176.094 -0.549 0.000 1.055 332 V CA 3.057 64.378 62.300 -1.632 0.000 1.049 332 V CB 0.150 30.765 31.823 -2.014 0.000 0.662 332 V HN 0.356 7.976 8.190 -0.950 0.000 0.455 333 F N -3.689 116.240 119.950 -0.034 0.000 2.710 333 F HA -0.040 4.636 4.527 0.248 0.000 0.298 333 F C 0.854 176.742 175.800 0.147 0.000 1.137 333 F CA 0.537 58.615 58.000 0.129 0.000 1.444 333 F CB -0.445 38.602 39.000 0.079 0.000 1.111 333 F HN -0.633 7.630 8.300 -0.258 -0.118 0.580 334 D N -2.830 117.731 120.400 0.269 0.000 2.398 334 D HA 0.136 4.919 4.640 0.239 0.000 0.210 334 D C 0.265 176.719 176.300 0.256 0.000 1.094 334 D CA 0.162 54.315 54.000 0.255 0.000 0.839 334 D CB 0.852 41.809 40.800 0.263 0.000 0.963 334 D HN -0.458 8.051 8.370 0.207 -0.016 0.506 335 Y N 2.158 122.519 120.300 0.101 0.000 2.220 335 Y HA -0.449 4.202 4.550 0.168 0.000 0.291 335 Y C 0.566 176.547 175.900 0.134 0.000 1.129 335 Y CA 4.044 62.205 58.100 0.102 0.000 1.161 335 Y CB 0.225 38.693 38.460 0.013 0.000 0.997 335 Y HN -0.570 7.860 8.280 0.250 0.000 0.522 336 K N -1.010 119.538 120.400 0.246 0.000 2.063 336 K HA -0.467 4.009 4.320 0.260 0.000 0.208 336 K C 1.779 178.425 176.600 0.077 0.000 1.048 336 K CA 3.833 60.241 56.287 0.202 0.000 0.928 336 K CB -0.449 32.204 32.500 0.255 0.000 0.713 336 K HN 0.287 8.723 8.250 0.309 0.000 0.442 337 E N -1.247 119.018 120.200 0.109 0.000 2.106 337 E HA -0.259 4.301 4.350 0.083 -0.160 0.192 337 E C 1.973 178.637 176.600 0.108 0.000 0.984 337 E CA 2.895 59.356 56.400 0.101 0.000 0.806 337 E CB -0.378 29.397 29.700 0.124 0.000 0.750 337 E HN -0.008 8.440 8.360 0.148 0.000 0.458 338 A N -1.167 121.722 122.820 0.115 0.000 1.933 338 A HA -0.256 4.211 4.320 0.245 0.000 0.218 338 A C 1.904 179.625 177.584 0.227 0.000 1.175 338 A CA 2.870 55.034 52.037 0.211 0.000 0.628 338 A CB -0.659 18.542 19.000 0.335 0.000 0.814 338 A HN -0.416 7.717 8.150 0.103 0.079 0.444 339 A N -2.251 120.578 122.820 0.016 0.000 1.930 339 A HA -0.360 4.211 4.320 0.417 0.000 0.215 339 A C 1.999 179.694 177.584 0.185 0.000 1.176 339 A CA 2.441 54.570 52.037 0.153 0.000 0.632 339 A CB -0.326 18.673 19.000 -0.001 0.000 0.819 339 A HN -0.135 7.832 8.150 -0.156 0.089 0.445 340 Q N -1.578 118.282 119.800 0.101 0.000 2.124 340 Q HA -0.393 3.997 4.340 0.083 0.000 0.202 340 Q C 2.911 178.969 176.000 0.098 0.000 0.977 340 Q CA 3.066 58.918 55.803 0.082 0.000 0.850 340 Q CB -0.108 28.654 28.738 0.040 0.000 0.901 340 Q HN -0.029 8.281 8.270 0.067 0.000 0.429 341 E N 1.034 121.300 120.200 0.110 0.000 2.118 341 E HA -0.243 4.159 4.350 0.088 0.000 0.195 341 E C 1.012 177.657 176.600 0.075 0.000 0.992 341 E CA 2.822 59.283 56.400 0.102 0.000 0.804 341 E CB 0.069 29.849 29.700 0.133 0.000 0.741 341 E HN -0.122 8.219 8.360 0.121 0.092 0.458 342 I N -10.804 109.808 120.570 0.069 0.000 3.976 342 I HA 0.347 4.511 4.170 -0.010 0.000 0.337 342 I C -1.364 174.817 176.117 0.107 0.000 1.359 342 I CA -1.523 59.780 61.300 0.005 0.000 1.098 342 I CB 0.647 38.508 38.000 -0.231 0.000 1.027 342 I HN -0.897 7.379 8.210 0.110 0.000 0.394 343 D N 0.601 121.092 120.400 0.152 0.000 2.828 343 D HA -0.386 4.348 4.640 0.157 0.000 0.241 343 D C -2.428 174.029 176.300 0.263 0.000 1.142 343 D CA 1.462 55.565 54.000 0.171 0.000 0.755 343 D CB -1.309 39.561 40.800 0.116 0.000 1.014 343 D HN -0.352 7.922 8.370 0.141 0.181 0.420 344 F N 0.047 120.090 119.950 0.155 0.000 2.596 344 F HA 0.721 5.504 4.527 0.104 -0.194 0.311 344 F C -2.399 173.603 175.800 0.336 0.000 1.116 344 F CA -1.007 57.094 58.000 0.170 0.000 0.957 344 F CB 3.628 42.709 39.000 0.135 0.000 1.250 344 F HN -0.747 7.785 8.300 0.386 0.000 0.444 345 F N 1.327 121.045 119.950 -0.386 0.000 2.650 345 F HA 0.444 5.055 4.527 0.140 0.000 0.320 345 F C -2.274 173.278 175.800 -0.414 0.000 1.091 345 F CA -1.830 56.074 58.000 -0.159 0.000 0.962 345 F CB 2.186 41.206 39.000 0.035 0.000 1.363 345 F HN 0.684 8.500 8.300 -0.807 0.000 0.482 346 D N 0.385 120.885 120.400 0.167 0.000 2.269 346 D HA 0.094 4.756 4.640 0.037 0.000 0.220 346 D C -0.498 176.069 176.300 0.444 0.000 0.962 346 D CA 4.046 58.192 54.000 0.243 0.000 0.884 346 D CB 2.290 43.374 40.800 0.475 0.000 1.023 346 D HN -0.106 8.501 8.370 0.396 0.000 0.484 347 F N -4.200 115.953 119.950 0.338 0.000 2.686 347 F HA 0.373 5.088 4.527 0.314 0.000 0.311 347 F C -2.594 173.378 175.800 0.287 0.000 1.128 347 F CA -1.820 56.359 58.000 0.298 0.000 0.946 347 F CB 1.433 40.573 39.000 0.234 0.000 1.336 347 F HN -0.595 7.982 8.300 0.461 0.000 0.457 348 R N 0.256 120.803 120.500 0.078 0.000 2.294 348 R HA 0.434 4.807 4.340 -0.307 -0.217 0.319 348 R C -0.190 176.042 176.300 -0.113 0.000 0.984 348 R CA -1.604 54.406 56.100 -0.150 0.000 0.861 348 R CB 1.324 31.570 30.300 -0.090 0.000 1.104 348 R HN 0.360 8.753 8.270 0.204 0.000 0.451 349 H N 5.993 124.839 119.070 -0.373 0.000 3.034 349 H HA -0.159 4.593 4.556 0.072 -0.152 0.324 349 H C 0.957 176.267 175.328 -0.031 0.000 1.015 349 H CA 1.683 57.648 56.048 -0.138 0.000 1.429 349 H CB 2.015 31.649 29.762 -0.214 0.000 1.429 349 H HN 0.039 8.114 8.280 -0.343 0.000 0.585 350 A N 9.057 131.672 122.820 -0.341 0.000 1.972 350 A HA -0.229 4.048 4.320 -0.071 0.000 0.219 350 A C 0.550 178.101 177.584 -0.055 0.000 1.169 350 A CA 2.669 54.611 52.037 -0.158 0.000 0.635 350 A CB 0.081 18.981 19.000 -0.167 0.000 0.810 350 A HN 0.582 8.270 8.150 -0.588 0.109 0.446 351 T N -1.851 112.739 114.554 0.061 0.000 3.004 351 T HA 0.137 4.532 4.350 0.075 0.000 0.243 351 T C 1.641 176.376 174.700 0.058 0.000 1.020 351 T CA 2.592 64.776 62.100 0.139 0.000 1.145 351 T CB 1.091 70.089 68.868 0.217 0.000 0.876 351 T HN -0.556 7.712 8.240 0.086 0.023 0.449 352 T N -2.334 112.214 114.554 -0.010 0.000 3.054 352 T HA -0.048 3.730 4.350 -0.954 0.000 0.259 352 T C 1.151 175.619 174.700 -0.387 0.000 1.092 352 T CA 1.387 63.050 62.100 -0.730 0.000 1.121 352 T CB 1.257 69.294 68.868 -1.385 0.000 0.912 352 T HN -0.509 7.976 8.240 0.410 0.000 0.489 353 G N 1.527 110.243 108.800 -0.140 0.000 2.168 353 G HA2 -0.517 3.469 3.960 -0.085 0.000 0.263 353 G HA3 -0.517 3.396 3.960 -0.078 0.000 0.263 353 G C -1.543 173.251 174.900 -0.176 0.000 0.977 353 G CA 0.451 45.484 45.100 -0.111 0.000 0.659 353 G HN -0.127 8.134 8.290 -0.049 0.000 0.533 354 A N 0.747 123.420 122.820 -0.246 0.000 2.462 354 A HA 0.055 4.227 4.320 -0.247 0.000 0.243 354 A C -0.933 176.373 177.584 -0.463 0.000 1.076 354 A CA -0.089 51.761 52.037 -0.312 0.000 0.773 354 A CB 0.827 19.621 19.000 -0.344 0.000 1.010 354 A HN -0.530 7.409 8.150 -0.259 0.056 0.493 355 A N 3.289 125.763 122.820 -0.576 0.000 2.492 355 A HA 0.102 3.960 4.320 -0.978 -0.125 0.254 355 A C -0.805 176.393 177.584 -0.643 0.000 1.091 355 A CA 0.336 51.772 52.037 -1.001 0.000 0.768 355 A CB 0.195 18.132 19.000 -1.770 0.000 1.028 355 A HN 0.318 8.163 8.150 -0.509 0.000 0.498 356 L N 2.566 123.413 121.223 -0.626 0.000 2.371 356 L HA 0.559 4.482 4.340 -0.695 0.000 0.262 356 L C -2.700 173.963 176.870 -0.346 0.000 1.006 356 L CA -3.252 51.146 54.840 -0.737 0.000 0.818 356 L CB 3.355 44.597 42.059 -1.361 0.000 1.354 356 L HN 0.374 8.282 8.230 -0.535 0.000 0.415 357 P HA 0.326 4.987 4.420 0.200 -0.120 0.282 357 P C -2.134 175.161 177.300 -0.009 0.000 1.259 357 P CA -1.695 61.392 63.100 -0.022 0.000 0.826 357 P CB 1.333 33.025 31.700 -0.013 0.000 1.064 358 K N 0.926 121.355 120.400 0.047 0.000 2.307 358 K HA 0.337 4.715 4.320 -0.137 -0.139 0.263 358 K C -0.448 175.947 176.600 -0.340 0.000 0.973 358 K CA -1.831 54.345 56.287 -0.186 0.000 0.846 358 K CB 1.563 33.812 32.500 -0.418 0.000 1.100 358 K HN -0.089 8.542 8.250 0.126 -0.305 0.438 359 L N 5.468 126.423 121.223 -0.447 0.000 2.343 359 L HA 0.319 4.431 4.340 -0.660 -0.168 0.275 359 L C 0.303 176.766 176.870 -0.679 0.000 1.056 359 L CA -1.374 53.088 54.840 -0.629 0.000 0.804 359 L CB 0.667 42.306 42.059 -0.700 0.000 1.203 359 L HN 0.068 8.382 8.230 -0.380 -0.312 0.440 360 Q N -0.819 118.526 119.800 -0.758 0.000 2.305 360 Q HA 0.247 4.178 4.340 -0.681 0.000 0.271 360 Q C -1.180 174.242 176.000 -0.964 0.000 1.046 360 Q CA -1.619 53.680 55.803 -0.839 0.000 0.798 360 Q CB 4.123 32.379 28.738 -0.803 0.000 1.286 360 Q HN 0.277 8.322 8.270 -0.777 -0.242 0.435 361 H N -1.270 117.641 119.070 -0.265 0.000 1.694 361 H HA -0.293 4.266 4.556 -0.264 -0.162 0.323 361 H C -1.437 173.698 175.328 -0.321 0.000 0.802 361 H CA -0.833 55.071 56.048 -0.239 0.000 1.074 361 H CB -1.886 27.829 29.762 -0.078 0.000 1.518 361 H HN 0.494 8.480 8.280 -0.490 0.000 0.270 362 P HA 0.280 4.625 4.420 -0.391 -0.159 0.214 362 P C -0.591 176.533 177.300 -0.294 0.000 1.807 362 P CA -0.922 61.842 63.100 -0.560 0.000 0.921 362 P CB -0.689 30.196 31.700 -1.358 0.000 1.835 363 E N 2.495 122.636 120.200 -0.099 0.000 2.085 363 E HA -0.319 4.299 4.350 0.090 -0.214 0.194 363 E C 1.749 178.261 176.600 -0.148 0.000 0.994 363 E CA 3.784 60.170 56.400 -0.022 0.000 0.801 363 E CB -0.681 29.023 29.700 0.006 0.000 0.743 363 E HN -0.407 7.877 8.360 -0.024 0.062 0.453 364 A N -1.293 121.399 122.820 -0.214 0.000 1.902 364 A HA -0.341 3.829 4.320 -0.250 0.000 0.217 364 A C 1.882 178.888 177.584 -0.964 0.000 1.181 364 A CA 3.694 55.508 52.037 -0.372 0.000 0.623 364 A CB -0.463 18.424 19.000 -0.189 0.000 0.818 364 A HN -0.237 7.823 8.150 -0.149 0.000 0.443 365 E N -4.721 114.896 120.200 -0.971 0.000 2.208 365 E HA -0.248 2.341 4.350 -2.934 0.000 0.193 365 E C 1.566 177.879 176.600 -0.478 0.000 0.988 365 E CA 2.662 58.256 56.400 -1.342 0.000 0.828 365 E CB -0.543 28.796 29.700 -0.601 0.000 0.763 365 E HN 0.287 8.275 8.360 -0.621 0.000 0.478 366 T N 0.008 114.500 114.554 -0.103 0.000 2.857 366 T HA -0.157 4.502 4.350 0.287 -0.137 0.266 366 T C 0.451 175.283 174.700 0.221 0.000 1.048 366 T CA 3.147 65.373 62.100 0.209 0.000 1.139 366 T CB 0.408 69.478 68.868 0.336 0.000 0.874 366 T HN -0.456 7.691 8.240 -0.127 0.017 0.455 367 F N 0.336 120.231 119.950 -0.090 0.000 2.293 367 F HA -0.113 4.465 4.527 0.086 0.000 0.300 367 F C -0.197 175.671 175.800 0.114 0.000 1.086 367 F CA 1.013 59.006 58.000 -0.012 0.000 1.375 367 F CB 0.727 39.644 39.000 -0.137 0.000 1.045 367 F HN -0.678 7.658 8.300 0.061 0.000 0.516 368 W N -1.880 119.382 121.300 -0.065 0.000 2.295 368 W HA -0.366 4.156 4.660 -0.231 0.000 0.335 368 W C 0.854 177.270 176.519 -0.171 0.000 1.351 368 W CA 1.145 58.352 57.345 -0.229 0.000 1.273 368 W CB -1.749 27.439 29.460 -0.452 0.000 1.214 368 W HN -0.785 7.277 8.180 -0.168 0.017 0.563 369 G N 2.534 111.377 108.800 0.072 0.000 2.179 369 G HA2 -0.427 3.575 3.960 0.070 0.000 0.260 369 G HA3 -0.427 3.635 3.960 0.170 0.000 0.260 369 G C -0.870 174.047 174.900 0.029 0.000 0.977 369 G CA -0.017 45.135 45.100 0.086 0.000 0.641 369 G HN 0.482 9.169 8.290 0.032 -0.378 0.533 370 S N -1.081 114.590 115.700 -0.048 0.000 2.600 370 S HA 0.041 4.522 4.470 0.018 0.000 0.265 370 S C 1.433 175.980 174.600 -0.089 0.000 1.325 370 S CA -1.211 56.964 58.200 -0.043 0.000 1.002 370 S CB 2.517 65.709 63.200 -0.014 0.000 0.921 370 S HN -0.742 7.429 8.310 -0.109 0.074 0.554 371 V N 2.527 122.396 119.914 -0.075 0.000 2.332 371 V HA -0.462 3.597 4.120 -0.102 0.000 0.248 371 V C 1.713 177.722 176.094 -0.142 0.000 1.055 371 V CA 4.367 66.588 62.300 -0.132 0.000 1.038 371 V CB -0.021 31.684 31.823 -0.197 0.000 0.651 371 V HN 0.553 8.710 8.190 -0.055 0.000 0.450 372 H N -2.782 116.304 119.070 0.027 0.000 2.357 372 H HA -0.335 4.293 4.556 0.121 0.000 0.301 372 H C 1.831 177.159 175.328 -0.001 0.000 1.082 372 H CA 4.127 60.246 56.048 0.118 0.000 1.342 372 H CB -0.221 29.755 29.762 0.358 0.000 1.389 372 H HN -0.318 7.981 8.280 0.031 0.000 0.511 373 E N 0.150 120.186 120.200 -0.273 0.000 2.077 373 E HA -0.270 4.098 4.350 -0.242 -0.162 0.193 373 E C 2.910 179.432 176.600 -0.129 0.000 0.989 373 E CA 2.728 58.863 56.400 -0.442 0.000 0.800 373 E CB -0.284 28.848 29.700 -0.946 0.000 0.746 373 E HN -0.642 7.447 8.360 -0.451 0.000 0.452 374 R N -3.756 116.676 120.500 -0.112 0.000 2.148 374 R HA -0.163 4.139 4.340 -0.064 0.000 0.227 374 R C 1.688 177.963 176.300 -0.042 0.000 1.103 374 R CA 1.937 57.999 56.100 -0.064 0.000 0.983 374 R CB -0.451 29.817 30.300 -0.053 0.000 0.874 374 R HN -0.038 8.152 8.270 -0.134 0.000 0.451 375 N N -2.754 115.935 118.700 -0.018 0.000 2.314 375 N HA 0.037 4.769 4.740 -0.013 0.000 0.200 375 N C -0.020 175.514 175.510 0.040 0.000 1.135 375 N CA 0.446 53.499 53.050 0.005 0.000 0.835 375 N CB 0.938 39.429 38.487 0.006 0.000 0.989 375 N HN -0.621 7.629 8.380 -0.014 0.122 0.478 376 G N -0.741 108.086 108.800 0.044 0.000 2.143 376 G HA2 -0.452 3.530 3.960 0.037 0.000 0.249 376 G HA3 -0.452 3.532 3.960 0.041 0.000 0.249 376 G C -0.560 174.424 174.900 0.140 0.000 0.981 376 G CA 0.388 45.525 45.100 0.062 0.000 0.665 376 G HN -0.348 7.793 8.290 0.027 0.165 0.528 377 V N 0.086 120.133 119.914 0.221 0.000 2.732 377 V HA -0.078 4.293 4.120 0.214 -0.123 0.297 377 V C -1.399 174.946 176.094 0.418 0.000 1.060 377 V CA 0.005 62.482 62.300 0.296 0.000 1.038 377 V CB 0.778 32.821 31.823 0.367 0.000 1.003 377 V HN -0.568 7.718 8.190 0.222 0.037 0.481 378 A N 2.409 125.397 122.820 0.281 0.000 2.485 378 A HA 0.657 5.383 4.320 0.403 -0.164 0.292 378 A C 0.857 178.446 177.584 0.008 0.000 1.147 378 A CA -2.110 50.070 52.037 0.237 0.000 0.750 378 A CB 3.085 22.206 19.000 0.201 0.000 1.331 378 A HN 0.160 8.729 8.150 0.193 -0.304 0.419 379 C N -0.595 118.640 119.300 -0.108 0.000 2.398 379 C HA -0.397 3.909 4.460 -0.257 0.000 0.276 379 C C 2.109 177.082 174.990 -0.027 0.000 1.222 379 C CA 3.882 62.807 59.018 -0.156 0.000 1.746 379 C CB -1.785 25.858 27.740 -0.160 0.000 2.039 379 C HN 0.333 8.732 8.230 -0.065 -0.208 0.470 380 A N -0.823 121.989 122.820 -0.014 0.000 2.024 380 A HA -0.375 3.941 4.320 -0.007 0.000 0.220 380 A C 2.008 179.578 177.584 -0.022 0.000 1.164 380 A CA 2.990 55.020 52.037 -0.013 0.000 0.643 380 A CB -0.844 18.145 19.000 -0.019 0.000 0.806 380 A HN -0.061 8.085 8.150 -0.007 0.000 0.451 381 D N -1.732 118.658 120.400 -0.017 0.000 2.178 381 D HA -0.157 4.476 4.640 -0.013 0.000 0.201 381 D C 1.202 177.460 176.300 -0.071 0.000 0.980 381 D CA 3.208 57.196 54.000 -0.019 0.000 0.842 381 D CB -0.121 40.693 40.800 0.022 0.000 0.948 381 D HN -0.195 8.148 8.370 -0.003 0.025 0.472 382 C N -4.259 114.950 119.300 -0.152 0.000 2.791 382 C HA 0.158 4.482 4.460 -0.227 0.000 0.288 382 C C -0.195 174.543 174.990 -0.420 0.000 1.271 382 C CA 0.942 59.773 59.018 -0.312 0.000 1.726 382 C CB 0.509 27.975 27.740 -0.457 0.000 2.145 382 C HN -0.656 7.470 8.230 -0.147 0.015 0.572 383 H N -4.534 114.480 119.070 -0.093 0.000 3.058 383 H HA 0.454 5.095 4.556 -0.105 -0.148 0.258 383 H C -0.669 174.603 175.328 -0.093 0.000 1.015 383 H CA 0.028 56.013 56.048 -0.106 0.000 1.210 383 H CB 2.697 32.379 29.762 -0.134 0.000 1.481 383 H HN -0.378 7.761 8.280 -0.071 0.099 0.492 384 M N -3.873 115.733 119.600 0.010 0.000 3.818 384 M HA 0.557 5.026 4.480 -0.019 0.000 0.444 384 M C -3.306 172.965 176.300 -0.048 0.000 1.948 384 M CA -2.365 52.919 55.300 -0.027 0.000 0.529 384 M CB 0.604 33.169 32.600 -0.057 0.000 1.861 384 M HN -0.333 7.839 8.290 -0.007 0.114 0.502 385 P HA 0.097 4.492 4.420 -0.042 0.000 0.277 385 P C -0.560 176.698 177.300 -0.071 0.000 1.271 385 P CA -1.407 61.662 63.100 -0.052 0.000 0.795 385 P CB 0.761 32.431 31.700 -0.051 0.000 1.101 386 K N -1.673 118.687 120.400 -0.068 0.000 2.414 386 K HA -0.200 4.171 4.320 -0.122 -0.123 0.272 386 K C -0.017 176.488 176.600 -0.157 0.000 0.993 386 K CA 1.117 57.342 56.287 -0.105 0.000 0.964 386 K CB 0.471 32.934 32.500 -0.062 0.000 0.925 386 K HN 0.026 8.247 8.250 -0.048 0.000 0.487 387 V N 2.343 122.083 119.914 -0.290 0.000 2.649 387 V HA -0.051 3.941 4.120 -0.212 0.000 0.292 387 V C -0.883 175.112 176.094 -0.164 0.000 1.055 387 V CA 0.238 62.363 62.300 -0.293 0.000 1.023 387 V CB 0.786 32.252 31.823 -0.595 0.000 0.992 387 V HN -0.039 7.918 8.190 -0.388 0.000 0.480 388 Q N 5.386 125.129 119.800 -0.096 0.000 2.307 388 Q HA 0.166 4.479 4.340 -0.044 0.000 0.262 388 Q C -1.316 174.667 176.000 -0.028 0.000 0.961 388 Q CA -0.365 55.409 55.803 -0.048 0.000 0.882 388 Q CB 1.181 29.901 28.738 -0.030 0.000 1.264 388 Q HN 0.077 8.294 8.270 -0.089 0.000 0.446 389 L N 5.800 127.017 121.223 -0.009 0.000 2.408 389 L HA 0.233 4.581 4.340 0.013 0.000 0.268 389 L C 0.310 177.190 176.870 0.015 0.000 0.986 389 L CA -0.752 54.096 54.840 0.012 0.000 0.820 389 L CB 2.288 44.367 42.059 0.033 0.000 1.303 389 L HN 0.266 8.491 8.230 -0.008 0.000 0.411 390 E N 0.920 121.130 120.200 0.017 0.000 2.077 390 E HA -0.199 4.159 4.350 0.013 0.000 0.193 390 E C -0.109 176.502 176.600 0.019 0.000 0.989 390 E CA 1.648 58.057 56.400 0.016 0.000 0.800 390 E CB 0.434 30.144 29.700 0.016 0.000 0.746 390 E HN 0.267 8.638 8.360 0.018 0.000 0.452 391 N N -1.574 117.141 118.700 0.025 0.000 2.533 391 N HA 0.117 4.873 4.740 0.025 0.000 0.289 391 N C -1.410 174.123 175.510 0.038 0.000 1.103 391 N CA 0.156 53.222 53.050 0.028 0.000 0.877 391 N CB 0.846 39.347 38.487 0.024 0.000 1.419 391 N HN -0.295 8.102 8.380 0.028 0.000 0.517 392 G N 0.749 109.574 108.800 0.042 0.000 2.320 392 G HA2 -0.141 3.851 3.960 0.053 0.000 0.297 392 G HA3 -0.141 3.862 3.960 0.071 0.000 0.297 392 G C -2.416 172.525 174.900 0.068 0.000 1.344 392 G CA -0.113 45.022 45.100 0.059 0.000 0.851 392 G HN -0.056 8.257 8.290 0.038 0.000 0.567 393 K N 0.531 120.985 120.400 0.089 0.000 2.276 393 K HA 0.183 4.549 4.320 0.077 0.000 0.285 393 K C -0.561 176.130 176.600 0.152 0.000 1.062 393 K CA -0.516 55.830 56.287 0.099 0.000 0.918 393 K CB 0.841 33.396 32.500 0.092 0.000 1.055 393 K HN 0.000 8.307 8.250 0.094 0.000 0.477 394 V N 4.574 124.553 119.914 0.108 0.000 2.740 394 V HA -0.072 4.079 4.120 0.052 0.000 0.303 394 V C -1.038 175.161 176.094 0.175 0.000 1.054 394 V CA 0.381 62.730 62.300 0.082 0.000 1.106 394 V CB 0.780 32.618 31.823 0.025 0.000 0.957 394 V HN 0.231 8.469 8.190 0.080 0.000 0.486 395 Y N 3.471 123.801 120.300 0.049 0.000 2.644 395 Y HA 0.337 4.923 4.550 0.060 0.000 0.338 395 Y C -2.050 173.900 175.900 0.083 0.000 1.119 395 Y CA -3.220 54.919 58.100 0.065 0.000 1.060 395 Y CB 1.887 40.387 38.460 0.068 0.000 1.294 395 Y HN -0.365 7.817 8.280 -0.163 0.000 0.472 396 T N 3.078 117.749 114.554 0.196 0.000 2.771 396 T HA 0.027 4.358 4.350 -0.032 0.000 0.291 396 T C -0.319 174.531 174.700 0.250 0.000 0.954 396 T CA 0.324 62.490 62.100 0.110 0.000 1.045 396 T CB 0.280 69.233 68.868 0.141 0.000 0.917 396 T HN 0.117 8.572 8.240 0.358 0.000 0.484 397 S N 6.151 121.869 115.700 0.029 0.000 2.546 397 S HA -0.315 4.318 4.470 0.271 0.000 0.290 397 S C -0.025 174.694 174.600 0.198 0.000 1.290 397 S CA 0.853 59.138 58.200 0.143 0.000 1.069 397 S CB 0.286 63.495 63.200 0.015 0.000 0.846 397 S HN -0.070 8.187 8.310 -0.089 0.000 0.495 398 H N 6.483 125.657 119.070 0.173 0.000 2.487 398 H HA 0.180 4.839 4.556 0.173 0.000 0.290 398 H C -0.301 175.133 175.328 0.177 0.000 1.081 398 H CA -0.249 55.915 56.048 0.192 0.000 1.116 398 H CB 0.625 30.527 29.762 0.233 0.000 1.560 398 H HN 0.022 8.596 8.280 0.490 0.000 0.548 399 S N 1.583 117.371 115.700 0.147 0.000 2.464 399 S HA 0.200 4.659 4.470 -0.018 0.000 0.313 399 S C -1.065 173.523 174.600 -0.019 0.000 1.078 399 S CA -1.029 57.182 58.200 0.019 0.000 1.096 399 S CB -0.551 62.633 63.200 -0.026 0.000 1.032 399 S HN -0.756 7.580 8.310 0.131 0.053 0.498 400 Q N 7.371 127.150 119.800 -0.035 0.000 2.323 400 Q HA 0.224 4.792 4.340 -0.024 -0.243 0.257 400 Q C -0.639 175.246 176.000 -0.192 0.000 1.022 400 Q CA 0.233 55.987 55.803 -0.082 0.000 0.919 400 Q CB 0.158 28.864 28.738 -0.053 0.000 1.220 400 Q HN 0.026 8.289 8.270 -0.013 0.000 0.427 401 R N 0.370 120.821 120.500 -0.082 0.000 2.762 401 R HA 0.368 4.618 4.340 -0.151 0.000 0.271 401 R C -1.440 174.912 176.300 0.086 0.000 1.038 401 R CA -1.704 54.349 56.100 -0.080 0.000 0.906 401 R CB 2.004 32.244 30.300 -0.101 0.000 1.259 401 R HN -0.271 8.002 8.270 0.005 0.000 0.457 402 T N 0.293 114.858 114.554 0.018 0.000 2.946 402 T HA 0.068 4.500 4.350 0.137 0.000 0.311 402 T C 0.634 175.306 174.700 -0.047 0.000 1.063 402 T CA -1.156 60.961 62.100 0.027 0.000 1.139 402 T CB 0.841 69.675 68.868 -0.057 0.000 0.994 402 T HN 0.506 8.718 8.240 -0.047 0.000 0.547 403 P HA 0.016 4.344 4.420 -0.153 0.000 0.225 403 P C 1.647 178.869 177.300 -0.129 0.000 1.148 403 P CA 1.695 64.689 63.100 -0.176 0.000 0.779 403 P CB 0.165 31.703 31.700 -0.270 0.000 0.780 404 R N -1.403 119.022 120.500 -0.126 0.000 2.170 404 R HA -0.252 4.024 4.340 -0.107 0.000 0.242 404 R C 1.581 177.834 176.300 -0.078 0.000 1.145 404 R CA 2.967 59.005 56.100 -0.103 0.000 0.984 404 R CB -0.420 29.819 30.300 -0.101 0.000 0.869 404 R HN -0.628 7.525 8.270 -0.133 0.037 0.455 405 D N -3.079 117.278 120.400 -0.073 0.000 2.355 405 D HA 0.023 4.630 4.640 -0.054 0.000 0.218 405 D C 0.408 176.679 176.300 -0.050 0.000 1.004 405 D CA 1.716 55.681 54.000 -0.059 0.000 0.880 405 D CB 0.764 41.527 40.800 -0.060 0.000 0.911 405 D HN -0.647 7.646 8.370 -0.077 0.031 0.528 406 M N -4.884 114.683 119.600 -0.055 0.000 4.568 406 M HA 0.392 4.850 4.480 -0.036 0.000 0.533 406 M C -0.917 175.357 176.300 -0.043 0.000 2.143 406 M CA -0.418 54.855 55.300 -0.045 0.000 0.483 406 M CB 0.090 32.662 32.600 -0.047 0.000 1.438 406 M HN -0.330 7.761 8.290 -0.065 0.159 0.591 407 M N 1.886 121.463 119.600 -0.038 0.000 2.213 407 M HA -0.175 4.281 4.480 -0.039 0.000 0.263 407 M C 1.949 178.253 176.300 0.007 0.000 1.062 407 M CA 3.413 58.697 55.300 -0.026 0.000 1.105 407 M CB -0.768 31.815 32.600 -0.028 0.000 1.385 407 M HN 0.298 8.566 8.290 -0.038 0.000 0.417 408 G N -2.026 106.778 108.800 0.007 0.000 2.446 408 G HA2 -0.390 3.593 3.960 0.039 0.000 0.217 408 G HA3 -0.390 3.578 3.960 0.014 0.000 0.217 408 G C 1.285 176.197 174.900 0.020 0.000 1.168 408 G CA 2.062 47.175 45.100 0.022 0.000 0.771 408 G HN 0.339 8.627 8.290 -0.003 0.000 0.551 409 Q N 0.631 120.430 119.800 -0.002 0.000 2.163 409 Q HA 0.003 4.506 4.340 -0.002 -0.164 0.198 409 Q C 1.844 177.840 176.000 -0.006 0.000 0.954 409 Q CA 1.715 57.513 55.803 -0.009 0.000 0.851 409 Q CB 0.041 28.760 28.738 -0.031 0.000 0.928 409 Q HN -0.661 7.603 8.270 -0.011 0.000 0.459 410 A N -3.118 119.690 122.820 -0.020 0.000 2.016 410 A HA 0.008 4.500 4.320 -0.047 -0.200 0.217 410 A C 0.635 178.226 177.584 0.013 0.000 1.162 410 A CA 1.975 53.989 52.037 -0.039 0.000 0.662 410 A CB 0.619 19.559 19.000 -0.100 0.000 0.812 410 A HN -0.014 8.121 8.150 -0.026 0.000 0.450 411 C N -5.153 114.189 119.300 0.071 0.000 3.123 411 C HA 0.132 4.738 4.460 0.244 0.000 0.536 411 C C 0.999 176.147 174.990 0.265 0.000 1.281 411 C CA 1.291 60.426 59.018 0.194 0.000 2.595 411 C CB 1.850 29.693 27.740 0.173 0.000 3.423 411 C HN -0.371 7.894 8.230 0.059 0.000 0.496 412 L N 0.552 121.885 121.223 0.182 0.000 2.313 412 L HA -0.187 4.324 4.340 0.286 0.000 0.214 412 L C 1.326 178.276 176.870 0.134 0.000 1.119 412 L CA 2.600 57.558 54.840 0.197 0.000 0.809 412 L CB -0.394 41.751 42.059 0.145 0.000 0.933 412 L HN -0.078 8.228 8.230 0.127 0.000 0.449 413 N N -1.068 117.685 118.700 0.089 0.000 2.166 413 N HA -0.285 4.482 4.740 0.045 0.000 0.186 413 N C 1.258 176.789 175.510 0.036 0.000 1.019 413 N CA 2.888 55.968 53.050 0.051 0.000 0.856 413 N CB -0.036 38.470 38.487 0.032 0.000 0.993 413 N HN -0.468 7.961 8.380 0.082 0.000 0.426 414 C N -1.804 117.522 119.300 0.044 0.000 2.505 414 C HA -0.040 4.385 4.460 -0.058 0.000 0.279 414 C C 0.749 175.659 174.990 -0.133 0.000 1.316 414 C CA 0.405 59.394 59.018 -0.048 0.000 1.720 414 C CB 0.052 27.758 27.740 -0.057 0.000 2.050 414 C HN -0.436 7.843 8.230 0.082 0.000 0.493 415 H N 0.965 120.062 119.070 0.044 0.000 2.652 415 H HA 0.189 4.788 4.556 -0.124 -0.118 0.233 415 H C -0.343 174.994 175.328 0.014 0.000 1.762 415 H CA -0.597 55.436 56.048 -0.024 0.000 1.285 415 H CB -2.211 27.582 29.762 0.051 0.000 1.668 415 H HN 0.053 8.478 8.280 0.242 0.000 0.550 416 A N 2.792 125.637 122.820 0.042 0.000 2.121 416 A HA -0.176 4.192 4.320 0.079 0.000 0.218 416 A C 0.683 178.296 177.584 0.049 0.000 1.154 416 A CA 2.288 54.353 52.037 0.048 0.000 0.679 416 A CB 0.043 19.047 19.000 0.007 0.000 0.795 416 A HN -0.443 7.656 8.150 -0.019 0.039 0.458 417 E N -4.079 116.117 120.200 -0.007 0.000 2.427 417 E HA -0.175 4.180 4.350 0.008 0.000 0.196 417 E C -0.124 176.557 176.600 0.135 0.000 1.028 417 E CA 0.377 56.764 56.400 -0.021 0.000 0.864 417 E CB -0.037 29.560 29.700 -0.172 0.000 0.813 417 E HN 0.119 8.401 8.360 -0.061 0.041 0.514 418 W N -0.668 120.676 121.300 0.073 0.000 2.706 418 W HA 0.338 5.220 4.660 0.032 -0.202 0.346 418 W C 0.219 176.757 176.519 0.032 0.000 1.071 418 W CA -2.351 55.023 57.345 0.047 0.000 1.206 418 W CB 2.165 31.654 29.460 0.049 0.000 1.413 418 W HN -0.694 7.619 8.180 0.312 0.054 0.542 419 T N -0.305 114.381 114.554 0.220 0.000 2.849 419 T HA 0.171 4.581 4.350 0.101 0.000 0.284 419 T C 0.825 175.547 174.700 0.036 0.000 1.004 419 T CA -1.630 60.526 62.100 0.093 0.000 1.021 419 T CB 1.927 70.811 68.868 0.028 0.000 1.013 419 T HN 0.185 8.828 8.240 0.195 -0.286 0.527 420 E N 1.266 121.474 120.200 0.013 0.000 2.070 420 E HA -0.412 3.929 4.350 -0.015 0.000 0.197 420 E C 1.770 178.317 176.600 -0.087 0.000 1.004 420 E CA 4.373 60.757 56.400 -0.026 0.000 0.805 420 E CB -0.103 29.585 29.700 -0.019 0.000 0.744 420 E HN 0.680 9.053 8.360 0.022 0.000 0.451 421 D N -2.700 117.648 120.400 -0.086 0.000 2.144 421 D HA -0.225 4.362 4.640 -0.088 0.000 0.199 421 D C 2.676 178.866 176.300 -0.182 0.000 0.984 421 D CA 3.179 57.113 54.000 -0.110 0.000 0.834 421 D CB -0.659 40.082 40.800 -0.099 0.000 0.955 421 D HN 0.164 8.495 8.370 -0.065 0.000 0.465 422 Q N -0.350 119.292 119.800 -0.264 0.000 2.046 422 Q HA -0.288 3.812 4.340 -0.401 0.000 0.200 422 Q C 2.305 177.809 176.000 -0.827 0.000 0.975 422 Q CA 2.973 58.480 55.803 -0.493 0.000 0.836 422 Q CB 0.001 28.431 28.738 -0.513 0.000 0.896 422 Q HN -0.632 7.516 8.270 -0.204 0.000 0.428 423 A N 0.342 122.700 122.820 -0.770 0.000 1.883 423 A HA -0.272 3.196 4.320 -1.420 0.000 0.217 423 A C 2.180 179.513 177.584 -0.419 0.000 1.186 423 A CA 3.118 54.699 52.037 -0.759 0.000 0.624 423 A CB -0.775 18.092 19.000 -0.222 0.000 0.822 423 A HN -0.350 7.501 8.150 -0.499 0.000 0.444 424 L N -2.399 118.679 121.223 -0.241 0.000 2.042 424 L HA -0.455 3.792 4.340 -0.156 0.000 0.210 424 L C 2.125 178.951 176.870 -0.073 0.000 1.076 424 L CA 3.168 57.923 54.840 -0.141 0.000 0.749 424 L CB -0.381 41.626 42.059 -0.088 0.000 0.893 424 L HN -0.314 7.785 8.230 -0.218 0.000 0.432 425 Y N -0.276 119.890 120.300 -0.223 0.000 2.181 425 Y HA -0.495 4.009 4.550 -0.076 0.000 0.288 425 Y C 1.322 177.166 175.900 -0.095 0.000 1.146 425 Y CA 3.518 61.534 58.100 -0.139 0.000 1.164 425 Y CB -0.155 38.210 38.460 -0.159 0.000 0.982 425 Y HN -0.257 8.015 8.280 -0.014 0.000 0.515 426 A N -0.690 122.064 122.820 -0.110 0.000 1.908 426 A HA -0.384 3.907 4.320 -0.048 0.000 0.218 426 A C 2.032 179.664 177.584 0.080 0.000 1.181 426 A CA 3.129 55.116 52.037 -0.084 0.000 0.627 426 A CB -1.039 17.804 19.000 -0.263 0.000 0.818 426 A HN -0.311 7.693 8.150 -0.243 0.000 0.445 427 I N -2.005 118.582 120.570 0.028 0.000 2.142 427 I HA -0.609 3.745 4.170 0.306 0.000 0.240 427 I C 1.690 177.863 176.117 0.093 0.000 1.078 427 I CA 4.314 65.659 61.300 0.076 0.000 1.343 427 I CB -0.304 37.576 38.000 -0.200 0.000 1.046 427 I HN -0.472 7.692 8.210 -0.078 0.000 0.405 428 D N -0.912 119.490 120.400 0.003 0.000 2.178 428 D HA -0.258 4.380 4.640 -0.003 0.000 0.202 428 D C 2.519 178.821 176.300 0.004 0.000 0.974 428 D CA 3.242 57.233 54.000 -0.015 0.000 0.841 428 D CB -0.390 40.374 40.800 -0.060 0.000 0.953 428 D HN -0.314 8.036 8.370 -0.033 0.000 0.478 429 Y N 1.453 121.660 120.300 -0.156 0.000 2.128 429 Y HA -0.439 4.013 4.550 -0.164 0.000 0.284 429 Y C 1.752 177.662 175.900 0.017 0.000 1.154 429 Y CA 4.142 62.161 58.100 -0.135 0.000 1.149 429 Y CB -0.006 38.338 38.460 -0.193 0.000 0.976 429 Y HN -0.301 8.006 8.280 0.045 0.000 0.505 430 I N -1.618 119.160 120.570 0.346 0.000 2.202 430 I HA -0.652 3.731 4.170 0.355 0.000 0.242 430 I C 1.987 178.246 176.117 0.237 0.000 1.091 430 I CA 4.278 65.766 61.300 0.314 0.000 1.368 430 I CB -0.187 37.996 38.000 0.304 0.000 1.058 430 I HN -0.726 7.683 8.210 0.331 0.000 0.410 431 K N 0.154 120.666 120.400 0.185 0.000 2.097 431 K HA -0.237 4.405 4.320 0.149 -0.232 0.206 431 K C 2.852 179.515 176.600 0.105 0.000 1.049 431 K CA 3.304 59.668 56.287 0.129 0.000 0.933 431 K CB -0.315 32.228 32.500 0.071 0.000 0.717 431 K HN -0.158 8.203 8.250 0.186 0.000 0.442 432 N N -0.261 118.476 118.700 0.062 0.000 2.106 432 N HA -0.250 4.523 4.740 0.054 0.000 0.188 432 N C 1.943 177.490 175.510 0.062 0.000 1.029 432 N CA 2.857 55.929 53.050 0.036 0.000 0.848 432 N CB -0.337 38.118 38.487 -0.053 0.000 1.007 432 N HN 0.106 8.513 8.380 0.045 0.000 0.423 433 Y N 1.381 121.635 120.300 -0.077 0.000 2.145 433 Y HA -0.323 4.168 4.550 -0.098 0.000 0.286 433 Y C 1.747 177.642 175.900 -0.008 0.000 1.145 433 Y CA 3.824 61.879 58.100 -0.074 0.000 1.148 433 Y CB 0.156 38.562 38.460 -0.089 0.000 0.981 433 Y HN -0.292 8.071 8.280 0.137 0.000 0.507 434 T N 1.138 115.689 114.554 -0.005 0.000 2.708 434 T HA -0.467 3.748 4.350 -0.225 0.000 0.266 434 T C 1.579 176.250 174.700 -0.048 0.000 1.037 434 T CA 5.236 67.287 62.100 -0.083 0.000 1.146 434 T CB -0.339 68.553 68.868 0.039 0.000 0.865 434 T HN 0.053 8.381 8.240 0.147 0.000 0.435 435 H N 2.793 121.839 119.070 -0.040 0.000 2.352 435 H HA -0.380 4.199 4.556 0.037 0.000 0.299 435 H C 2.002 177.312 175.328 -0.030 0.000 1.097 435 H CA 3.913 59.959 56.048 -0.003 0.000 1.311 435 H CB -0.186 29.582 29.762 0.010 0.000 1.377 435 H HN 0.004 8.392 8.280 0.181 0.000 0.504 436 G N -1.740 106.984 108.800 -0.128 0.000 2.440 436 G HA2 -0.423 3.429 3.960 -0.180 0.000 0.218 436 G HA3 -0.423 3.438 3.960 -0.165 0.000 0.218 436 G C 1.352 176.127 174.900 -0.209 0.000 1.154 436 G CA 2.160 47.148 45.100 -0.187 0.000 0.767 436 G HN -0.064 8.197 8.290 -0.048 0.000 0.552 437 K N 1.225 121.464 120.400 -0.267 0.000 2.155 437 K HA -0.126 4.111 4.320 -0.139 0.000 0.203 437 K C 2.386 178.968 176.600 -0.029 0.000 1.052 437 K CA 1.416 57.593 56.287 -0.183 0.000 0.948 437 K CB -0.744 31.581 32.500 -0.291 0.000 0.728 437 K HN -0.685 7.355 8.250 -0.349 0.000 0.448 438 I N 0.896 121.458 120.570 -0.013 0.000 2.142 438 I HA -0.486 3.882 4.170 0.330 0.000 0.240 438 I C 1.636 177.813 176.117 0.101 0.000 1.078 438 I CA 4.365 65.762 61.300 0.161 0.000 1.343 438 I CB -0.028 38.072 38.000 0.168 0.000 1.046 438 I HN -0.222 7.865 8.210 -0.072 0.081 0.405 439 V N -0.103 119.747 119.914 -0.107 0.000 2.343 439 V HA -0.648 3.443 4.120 -0.047 0.000 0.247 439 V C 1.863 177.964 176.094 0.012 0.000 1.051 439 V CA 4.925 67.170 62.300 -0.091 0.000 1.036 439 V CB -0.469 31.227 31.823 -0.211 0.000 0.654 439 V HN -0.024 8.015 8.190 -0.251 0.000 0.451 440 K N -0.762 119.658 120.400 0.033 0.000 2.097 440 K HA -0.364 4.051 4.320 0.158 0.000 0.205 440 K C 2.499 179.279 176.600 0.299 0.000 1.050 440 K CA 3.592 59.978 56.287 0.165 0.000 0.938 440 K CB -0.335 32.253 32.500 0.147 0.000 0.718 440 K HN -0.256 7.986 8.250 -0.013 0.000 0.442 441 S N 0.596 116.417 115.700 0.202 0.000 2.370 441 S HA -0.393 4.231 4.470 0.257 0.000 0.226 441 S C 1.848 176.450 174.600 0.003 0.000 1.033 441 S CA 4.005 62.320 58.200 0.191 0.000 1.011 441 S CB -0.182 63.181 63.200 0.272 0.000 0.852 441 S HN -0.104 8.301 8.310 0.159 0.000 0.457 442 E N 1.619 121.741 120.200 -0.130 0.000 2.072 442 E HA -0.383 3.608 4.350 -0.597 0.000 0.191 442 E C 1.909 178.402 176.600 -0.178 0.000 0.985 442 E CA 2.974 59.182 56.400 -0.319 0.000 0.801 442 E CB -0.073 29.496 29.700 -0.217 0.000 0.750 442 E HN -0.279 8.056 8.360 -0.041 0.000 0.452 443 Y N 2.170 122.370 120.300 -0.168 0.000 2.114 443 Y HA -0.356 4.047 4.550 -0.246 0.000 0.282 443 Y C 1.778 177.471 175.900 -0.344 0.000 1.165 443 Y CA 3.348 61.290 58.100 -0.263 0.000 1.148 443 Y CB -0.022 38.250 38.460 -0.312 0.000 0.972 443 Y HN -0.225 8.117 8.280 0.102 0.000 0.504 444 W N -3.133 118.079 121.300 -0.147 0.000 2.409 444 W HA -0.352 4.133 4.660 -0.292 0.000 0.299 444 W C 2.234 178.614 176.519 -0.232 0.000 1.203 444 W CA 4.043 61.279 57.345 -0.182 0.000 1.298 444 W CB 0.115 29.574 29.460 -0.002 0.000 1.127 444 W HN -0.401 7.892 8.180 0.189 0.000 0.528 445 L N -0.907 120.290 121.223 -0.043 0.000 2.013 445 L HA -0.476 3.780 4.340 -0.139 0.000 0.212 445 L C 2.300 179.015 176.870 -0.259 0.000 1.073 445 L CA 3.259 57.989 54.840 -0.183 0.000 0.753 445 L CB -0.273 41.601 42.059 -0.308 0.000 0.890 445 L HN 0.136 8.352 8.230 -0.024 0.000 0.432 446 A N -1.995 120.644 122.820 -0.300 0.000 1.902 446 A HA -0.391 3.793 4.320 -0.227 0.000 0.217 446 A C 1.503 178.911 177.584 -0.293 0.000 1.181 446 A CA 3.335 55.203 52.037 -0.282 0.000 0.623 446 A CB -0.946 17.884 19.000 -0.283 0.000 0.818 446 A HN 0.235 8.193 8.150 -0.319 0.000 0.443 447 K N -0.977 119.170 120.400 -0.421 0.000 2.057 447 K HA -0.331 3.765 4.320 -0.372 0.000 0.207 447 K C 2.022 178.516 176.600 -0.176 0.000 1.049 447 K CA 3.093 59.146 56.287 -0.389 0.000 0.931 447 K CB -0.103 32.030 32.500 -0.612 0.000 0.714 447 K HN -0.560 7.371 8.250 -0.532 0.000 0.440 448 M N -0.300 119.232 119.600 -0.113 0.000 2.067 448 M HA -0.370 4.105 4.480 -0.009 0.000 0.260 448 M C 2.438 178.753 176.300 0.026 0.000 1.069 448 M CA 3.816 59.098 55.300 -0.031 0.000 1.117 448 M CB 0.057 32.640 32.600 -0.029 0.000 1.334 448 M HN -0.589 7.628 8.290 -0.122 0.000 0.407 449 I N -0.637 119.873 120.570 -0.099 0.000 2.208 449 I HA -0.586 3.541 4.170 -0.072 0.000 0.245 449 I C 1.924 178.075 176.117 0.057 0.000 1.097 449 I CA 3.923 65.175 61.300 -0.080 0.000 1.363 449 I CB -0.372 37.503 38.000 -0.208 0.000 1.051 449 I HN 0.180 8.277 8.210 -0.188 0.000 0.413 450 D N -0.705 119.685 120.400 -0.016 0.000 2.263 450 D HA -0.187 4.461 4.640 0.013 0.000 0.208 450 D C 2.147 178.456 176.300 0.014 0.000 0.971 450 D CA 3.043 57.038 54.000 -0.008 0.000 0.867 450 D CB -0.568 40.193 40.800 -0.064 0.000 0.929 450 D HN -0.055 8.271 8.370 -0.073 0.000 0.492 451 L N -1.591 119.637 121.223 0.009 0.000 2.291 451 L HA -0.268 4.046 4.340 -0.043 0.000 0.214 451 L C 1.295 178.139 176.870 -0.042 0.000 1.120 451 L CA 1.665 56.481 54.840 -0.040 0.000 0.799 451 L CB -0.234 41.765 42.059 -0.099 0.000 0.925 451 L HN -0.628 7.481 8.230 0.006 0.125 0.446 452 F N -0.127 119.793 119.950 -0.051 0.000 2.075 452 F HA -0.264 4.246 4.527 -0.029 0.000 0.297 452 F C -1.038 174.753 175.800 -0.014 0.000 1.113 452 F CA 6.616 64.598 58.000 -0.030 0.000 1.218 452 F CB -3.247 35.739 39.000 -0.022 0.000 0.984 452 F HN -0.503 7.859 8.300 0.330 0.136 0.472 453 P HA -0.266 4.214 4.420 0.100 0.000 0.216 453 P C 1.205 178.528 177.300 0.038 0.000 1.150 453 P CA 3.361 66.514 63.100 0.090 0.000 0.837 453 P CB -0.443 31.298 31.700 0.069 0.000 0.786 454 V N -1.760 118.163 119.914 0.015 0.000 2.295 454 V HA -0.555 3.562 4.120 -0.006 0.000 0.246 454 V C 1.618 177.695 176.094 -0.029 0.000 1.049 454 V CA 4.143 66.436 62.300 -0.011 0.000 1.024 454 V CB -0.427 31.381 31.823 -0.024 0.000 0.648 454 V HN -0.640 7.561 8.190 0.019 0.000 0.447 455 A N -1.327 121.456 122.820 -0.061 0.000 1.883 455 A HA -0.452 3.817 4.320 -0.084 0.000 0.217 455 A C 1.431 178.985 177.584 -0.051 0.000 1.186 455 A CA 3.589 55.571 52.037 -0.092 0.000 0.624 455 A CB -0.654 18.223 19.000 -0.205 0.000 0.822 455 A HN 0.223 8.328 8.150 -0.074 0.000 0.444 456 K N -1.915 118.476 120.400 -0.015 0.000 2.032 456 K HA -0.248 4.078 4.320 0.009 0.000 0.209 456 K C 2.951 179.556 176.600 0.008 0.000 1.048 456 K CA 2.369 58.665 56.287 0.016 0.000 0.927 456 K CB -0.566 31.971 32.500 0.061 0.000 0.712 456 K HN -0.043 8.206 8.250 -0.001 0.000 0.441 457 R N -1.035 119.470 120.500 0.008 0.000 2.148 457 R HA -0.177 4.168 4.340 0.008 0.000 0.227 457 R C 2.031 178.329 176.300 -0.004 0.000 1.103 457 R CA 2.152 58.255 56.100 0.005 0.000 0.983 457 R CB -0.095 30.210 30.300 0.007 0.000 0.874 457 R HN -0.072 8.205 8.270 0.011 0.000 0.451 458 A N -3.449 119.363 122.820 -0.012 0.000 2.206 458 A HA 0.067 4.380 4.320 -0.013 0.000 0.211 458 A C -0.084 177.490 177.584 -0.016 0.000 1.158 458 A CA 0.184 52.211 52.037 -0.016 0.000 0.761 458 A CB 0.048 19.033 19.000 -0.025 0.000 0.801 458 A HN -0.205 7.847 8.150 -0.016 0.088 0.473 459 G N -2.371 106.420 108.800 -0.014 0.000 2.131 459 G HA2 -0.378 3.578 3.960 -0.008 0.000 0.223 459 G HA3 -0.378 3.576 3.960 -0.011 0.000 0.223 459 G C -0.220 174.669 174.900 -0.019 0.000 0.990 459 G CA -0.272 44.821 45.100 -0.012 0.000 0.671 459 G HN -0.588 7.537 8.290 -0.012 0.157 0.521 460 V N 1.073 120.968 119.914 -0.031 0.000 2.788 460 V HA -0.176 3.921 4.120 -0.039 0.000 0.307 460 V C -0.078 175.998 176.094 -0.031 0.000 1.069 460 V CA 0.901 63.176 62.300 -0.042 0.000 1.173 460 V CB 1.008 32.787 31.823 -0.074 0.000 0.925 460 V HN -0.510 7.659 8.190 -0.034 0.000 0.492 461 S N 6.636 122.319 115.700 -0.028 0.000 2.579 461 S HA 0.000 4.464 4.470 -0.010 0.000 0.275 461 S C 1.043 175.637 174.600 -0.011 0.000 1.345 461 S CA -0.474 57.717 58.200 -0.016 0.000 1.031 461 S CB 1.305 64.497 63.200 -0.014 0.000 0.892 461 S HN -0.036 8.255 8.310 -0.031 0.000 0.529 462 E N 2.931 123.132 120.200 0.002 0.000 2.160 462 E HA -0.335 4.028 4.350 0.021 0.000 0.195 462 E C 1.823 178.429 176.600 0.010 0.000 0.991 462 E CA 3.405 59.813 56.400 0.013 0.000 0.810 462 E CB -0.565 29.143 29.700 0.015 0.000 0.742 462 E HN 0.826 9.187 8.360 0.002 0.000 0.466 463 D N -1.335 119.066 120.400 0.002 0.000 2.117 463 D HA -0.216 4.426 4.640 0.005 0.000 0.197 463 D C 2.458 178.756 176.300 -0.003 0.000 0.987 463 D CA 3.528 57.528 54.000 0.001 0.000 0.829 463 D CB -0.642 40.156 40.800 -0.003 0.000 0.961 463 D HN 0.195 8.557 8.370 -0.001 0.007 0.460 464 V N 0.265 120.169 119.914 -0.016 0.000 2.358 464 V HA -0.453 3.651 4.120 -0.027 0.000 0.246 464 V C 1.758 177.828 176.094 -0.041 0.000 1.047 464 V CA 3.930 66.209 62.300 -0.034 0.000 1.035 464 V CB 0.064 31.854 31.823 -0.056 0.000 0.658 464 V HN -0.640 7.539 8.190 -0.019 0.000 0.452 465 L N -0.874 120.330 121.223 -0.031 0.000 2.042 465 L HA -0.516 3.766 4.340 -0.097 0.000 0.210 465 L C 2.057 179.002 176.870 0.125 0.000 1.076 465 L CA 3.533 58.382 54.840 0.014 0.000 0.749 465 L CB -0.731 41.370 42.059 0.071 0.000 0.893 465 L HN -0.092 8.123 8.230 -0.026 0.000 0.432 466 N N -1.658 117.086 118.700 0.073 0.000 2.216 466 N HA -0.380 4.411 4.740 0.084 0.000 0.183 466 N C 2.183 177.730 175.510 0.061 0.000 1.017 466 N CA 3.392 56.482 53.050 0.065 0.000 0.861 466 N CB 0.132 38.635 38.487 0.027 0.000 0.986 466 N HN 0.101 8.509 8.380 0.045 0.000 0.428 467 Q N 0.466 120.291 119.800 0.042 0.000 2.096 467 Q HA -0.371 3.991 4.340 0.036 0.000 0.204 467 Q C 2.147 178.192 176.000 0.075 0.000 0.982 467 Q CA 3.190 59.017 55.803 0.040 0.000 0.850 467 Q CB -0.051 28.697 28.738 0.016 0.000 0.901 467 Q HN -0.340 7.946 8.270 0.028 0.000 0.422 468 A N -1.086 121.789 122.820 0.092 0.000 1.930 468 A HA -0.337 4.054 4.320 0.118 0.000 0.217 468 A C 1.827 179.607 177.584 0.326 0.000 1.175 468 A CA 2.968 55.103 52.037 0.164 0.000 0.627 468 A CB -0.615 18.393 19.000 0.014 0.000 0.815 468 A HN -0.147 8.040 8.150 0.062 0.000 0.443 469 R N -2.256 118.435 120.500 0.318 0.000 2.115 469 R HA -0.297 4.187 4.340 0.241 0.000 0.230 469 R C 2.480 178.856 176.300 0.126 0.000 1.111 469 R CA 3.547 59.772 56.100 0.208 0.000 0.976 469 R CB -0.125 30.233 30.300 0.096 0.000 0.870 469 R HN -0.179 8.173 8.270 0.278 0.086 0.445 470 E N -0.481 119.779 120.200 0.099 0.000 2.106 470 E HA -0.263 4.110 4.350 0.037 0.000 0.192 470 E C 2.235 178.924 176.600 0.148 0.000 0.984 470 E CA 2.634 59.079 56.400 0.074 0.000 0.806 470 E CB -0.286 29.436 29.700 0.038 0.000 0.750 470 E HN -0.512 7.905 8.360 0.095 0.000 0.458 471 L N -1.572 119.749 121.223 0.164 0.000 2.093 471 L HA -0.322 4.127 4.340 0.183 0.000 0.208 471 L C 1.624 178.647 176.870 0.256 0.000 1.085 471 L CA 2.882 57.834 54.840 0.187 0.000 0.755 471 L CB -0.327 41.820 42.059 0.147 0.000 0.904 471 L HN -0.597 7.723 8.230 0.151 0.000 0.435 472 H N 0.680 119.822 119.070 0.119 0.000 2.352 472 H HA -0.424 4.178 4.556 0.077 0.000 0.299 472 H C 2.120 177.499 175.328 0.084 0.000 1.097 472 H CA 3.007 59.093 56.048 0.064 0.000 1.311 472 H CB 0.520 30.248 29.762 -0.056 0.000 1.377 472 H HN -0.154 8.231 8.280 0.316 0.085 0.504 473 Y N -0.089 120.223 120.300 0.020 0.000 2.081 473 Y HA -0.507 3.943 4.550 -0.168 0.000 0.280 473 Y C 1.531 177.467 175.900 0.059 0.000 1.163 473 Y CA 4.204 62.270 58.100 -0.057 0.000 1.135 473 Y CB -0.250 38.157 38.460 -0.090 0.000 0.970 473 Y HN -0.362 8.066 8.280 0.246 0.000 0.498 474 D N -2.196 118.412 120.400 0.348 0.000 2.123 474 D HA -0.323 4.414 4.640 0.163 0.000 0.200 474 D C 2.144 178.615 176.300 0.286 0.000 0.976 474 D CA 3.311 57.486 54.000 0.291 0.000 0.831 474 D CB -0.819 40.229 40.800 0.413 0.000 0.974 474 D HN -0.557 8.034 8.370 0.368 0.000 0.469 475 A N -0.365 122.649 122.820 0.322 0.000 1.933 475 A HA -0.338 4.195 4.320 0.355 0.000 0.218 475 A C 1.642 179.443 177.584 0.361 0.000 1.175 475 A CA 3.000 55.236 52.037 0.331 0.000 0.628 475 A CB -0.525 18.632 19.000 0.261 0.000 0.814 475 A HN -0.050 8.287 8.150 0.311 0.000 0.444 476 H N -0.003 119.217 119.070 0.250 0.000 2.299 476 H HA -0.319 4.548 4.556 0.519 0.000 0.302 476 H C 2.049 177.476 175.328 0.164 0.000 1.078 476 H CA 4.103 60.322 56.048 0.285 0.000 1.323 476 H CB 0.527 30.318 29.762 0.049 0.000 1.381 476 H HN -0.168 8.349 8.280 0.399 0.002 0.498 477 L N -0.276 120.947 121.223 -0.000 0.000 2.013 477 L HA -0.385 3.845 4.340 -0.182 0.000 0.212 477 L C 1.418 178.166 176.870 -0.203 0.000 1.073 477 L CA 3.109 57.803 54.840 -0.243 0.000 0.753 477 L CB -0.427 41.326 42.059 -0.509 0.000 0.890 477 L HN -0.186 8.017 8.230 -0.045 0.000 0.432 478 Y N -5.552 114.845 120.300 0.160 0.000 2.561 478 Y HA -0.055 4.581 4.550 0.143 0.000 0.291 478 Y C 1.755 177.880 175.900 0.374 0.000 1.141 478 Y CA 1.504 59.733 58.100 0.214 0.000 1.303 478 Y CB -0.769 37.827 38.460 0.227 0.000 1.015 478 Y HN -0.270 7.985 8.280 -0.040 0.000 0.547 479 W N 0.516 121.962 121.300 0.244 0.000 2.633 479 W HA -0.123 4.741 4.660 0.340 0.000 0.295 479 W C 1.028 177.636 176.519 0.149 0.000 1.133 479 W CA 2.054 59.532 57.345 0.222 0.000 1.490 479 W CB 1.014 30.534 29.460 0.100 0.000 1.127 479 W HN -0.602 7.805 8.180 0.438 0.036 0.538 480 E N 2.452 122.144 120.200 -0.846 0.000 2.204 480 E HA -0.343 2.648 4.350 -2.265 0.000 0.194 480 E C 1.916 178.043 176.600 -0.788 0.000 0.989 480 E CA 2.698 58.243 56.400 -1.424 0.000 0.824 480 E CB -0.035 28.933 29.700 -1.219 0.000 0.756 480 E HN 0.099 8.190 8.360 -0.448 0.000 0.477 481 W N -0.279 120.546 121.300 -0.791 0.000 2.308 481 W HA -0.383 3.771 4.660 -0.844 0.000 0.301 481 W C 1.788 177.678 176.519 -1.048 0.000 1.220 481 W CA 3.579 60.341 57.345 -0.972 0.000 1.240 481 W CB -0.064 28.693 29.460 -1.172 0.000 1.142 481 W HN -0.591 7.401 8.180 -0.289 0.015 0.521 482 W N -5.335 115.903 121.300 -0.103 0.000 2.640 482 W HA -0.211 4.463 4.660 0.023 0.000 0.268 482 W C 1.927 178.357 176.519 -0.148 0.000 1.263 482 W CA 1.828 59.141 57.345 -0.054 0.000 1.344 482 W CB 0.348 29.830 29.460 0.038 0.000 1.093 482 W HN -0.133 7.717 8.180 -0.340 0.126 0.603 483 T N -0.656 113.773 114.554 -0.208 0.000 2.942 483 T HA -0.247 4.080 4.350 -0.039 0.000 0.265 483 T C 1.377 175.952 174.700 -0.208 0.000 1.062 483 T CA 3.062 65.051 62.100 -0.184 0.000 1.139 483 T CB -0.875 67.827 68.868 -0.276 0.000 0.883 483 T HN -0.590 7.390 8.240 -0.432 0.000 0.468 484 A N 2.826 125.439 122.820 -0.344 0.000 1.897 484 A HA -0.150 4.081 4.320 -0.148 0.000 0.215 484 A C 0.703 178.141 177.584 -0.243 0.000 1.181 484 A CA 1.678 53.533 52.037 -0.304 0.000 0.620 484 A CB -0.249 18.435 19.000 -0.526 0.000 0.821 484 A HN -0.117 7.750 8.150 -0.472 0.000 0.443 485 E N -1.471 118.536 120.200 -0.322 0.000 2.338 485 E HA -0.064 4.328 4.350 -0.182 -0.151 0.272 485 E C 0.261 176.852 176.600 -0.015 0.000 1.029 485 E CA -0.309 55.973 56.400 -0.196 0.000 0.872 485 E CB 0.716 30.249 29.700 -0.278 0.000 1.015 485 E HN -0.538 7.578 8.360 -0.407 0.000 0.417 486 N N 5.972 124.690 118.700 0.030 0.000 2.412 486 N HA -0.049 4.694 4.740 0.005 0.000 0.184 486 N C 0.233 175.729 175.510 -0.024 0.000 1.101 486 N CA 1.600 54.659 53.050 0.015 0.000 0.881 486 N CB 0.736 39.241 38.487 0.030 0.000 0.969 486 N HN 0.295 8.983 8.380 0.060 -0.272 0.459 487 S N -2.718 112.940 115.700 -0.070 0.000 2.593 487 S HA 0.034 4.394 4.470 -0.183 0.000 0.217 487 S C 0.659 175.276 174.600 0.028 0.000 0.966 487 S CA 0.260 58.351 58.200 -0.182 0.000 0.914 487 S CB 1.419 64.185 63.200 -0.723 0.000 0.776 487 S HN -0.455 8.169 8.310 -0.023 -0.328 0.523 488 V N -0.197 119.784 119.914 0.112 0.000 5.616 488 V HA -0.549 3.701 4.120 0.216 0.000 0.301 488 V C -0.434 175.778 176.094 0.197 0.000 0.564 488 V CA 1.051 63.453 62.300 0.169 0.000 0.653 488 V CB -2.327 29.563 31.823 0.111 0.000 0.372 488 V HN -0.497 7.713 8.190 0.116 0.049 1.029 489 G N -2.313 106.644 108.800 0.262 0.000 2.253 489 G HA2 -0.481 3.610 3.960 0.219 0.000 0.251 489 G HA3 -0.481 3.549 3.960 0.118 0.000 0.251 489 G C 0.753 175.783 174.900 0.217 0.000 0.998 489 G CA 0.680 45.902 45.100 0.203 0.000 0.621 489 G HN -0.141 8.348 8.290 0.341 0.005 0.524 490 F N 2.339 122.343 119.950 0.090 0.000 2.161 490 F HA -0.420 4.197 4.527 0.150 0.000 0.300 490 F C 0.638 176.594 175.800 0.261 0.000 1.089 490 F CA 3.482 61.553 58.000 0.118 0.000 1.282 490 F CB 0.266 39.286 39.000 0.033 0.000 1.010 490 F HN -0.704 7.614 8.300 0.299 0.161 0.485 491 H N -5.228 114.044 119.070 0.336 0.000 2.456 491 H HA -0.311 4.474 4.556 0.382 0.000 0.296 491 H C -1.058 174.436 175.328 0.277 0.000 1.079 491 H CA 2.169 58.429 56.048 0.354 0.000 1.322 491 H CB 0.875 30.880 29.762 0.405 0.000 1.388 491 H HN -0.516 7.919 8.280 0.259 0.000 0.538 492 N N -5.026 113.871 118.700 0.329 0.000 2.884 492 N HA 0.291 5.134 4.740 0.172 0.000 0.211 492 N C -2.773 172.811 175.510 0.124 0.000 1.442 492 N CA -1.555 51.638 53.050 0.239 0.000 0.757 492 N CB -0.291 38.402 38.487 0.343 0.000 1.461 492 N HN -0.673 7.867 8.380 0.313 0.028 0.557 493 P HA -0.080 4.442 4.420 0.016 -0.092 0.215 493 P C 0.740 178.044 177.300 0.006 0.000 1.153 493 P CA 2.226 65.339 63.100 0.022 0.000 0.853 493 P CB 0.509 32.225 31.700 0.026 0.000 0.788 494 D N -3.102 117.314 120.400 0.028 0.000 2.144 494 D HA -0.249 4.411 4.640 0.033 0.000 0.200 494 D C 2.056 178.386 176.300 0.050 0.000 0.978 494 D CA 3.462 57.484 54.000 0.037 0.000 0.833 494 D CB -0.658 40.166 40.800 0.041 0.000 0.961 494 D HN 0.306 8.697 8.370 0.034 0.000 0.470 495 Q N 1.023 120.872 119.800 0.082 0.000 2.083 495 Q HA -0.319 4.187 4.340 0.276 0.000 0.198 495 Q C 1.979 177.916 176.000 -0.105 0.000 0.969 495 Q CA 2.972 58.872 55.803 0.161 0.000 0.838 495 Q CB 0.043 28.954 28.738 0.288 0.000 0.900 495 Q HN -0.726 7.778 8.270 0.095 -0.178 0.436 496 A N -0.098 122.384 122.820 -0.564 0.000 1.892 496 A HA -0.452 2.296 4.320 -2.621 0.000 0.218 496 A C 1.525 178.713 177.584 -0.661 0.000 1.188 496 A CA 3.516 54.705 52.037 -1.413 0.000 0.631 496 A CB -0.890 17.386 19.000 -1.207 0.000 0.822 496 A HN -0.064 7.845 8.150 -0.402 0.000 0.447 497 R N -1.567 118.780 120.500 -0.254 0.000 2.070 497 R HA -0.380 3.914 4.340 -0.077 0.000 0.233 497 R C 1.800 178.085 176.300 -0.023 0.000 1.137 497 R CA 3.519 59.586 56.100 -0.054 0.000 0.945 497 R CB -0.149 30.225 30.300 0.123 0.000 0.845 497 R HN -0.329 7.832 8.270 -0.182 0.000 0.430 498 E N -1.374 118.846 120.200 0.034 0.000 2.077 498 E HA -0.338 4.040 4.350 0.045 0.000 0.193 498 E C 1.893 178.590 176.600 0.161 0.000 0.989 498 E CA 3.108 59.567 56.400 0.098 0.000 0.800 498 E CB -0.180 29.607 29.700 0.145 0.000 0.746 498 E HN -0.507 7.877 8.360 0.041 0.000 0.452 499 S N -0.061 115.761 115.700 0.203 0.000 2.356 499 S HA -0.297 4.310 4.470 0.229 0.000 0.223 499 S C 2.172 176.872 174.600 0.166 0.000 1.032 499 S CA 3.499 61.821 58.200 0.203 0.000 1.005 499 S CB -0.188 63.188 63.200 0.293 0.000 0.867 499 S HN -0.358 8.030 8.310 0.130 0.000 0.449 500 L N 1.076 122.316 121.223 0.028 0.000 2.093 500 L HA -0.250 4.220 4.340 0.217 0.000 0.208 500 L C 2.600 179.515 176.870 0.075 0.000 1.085 500 L CA 2.995 57.884 54.840 0.082 0.000 0.755 500 L CB -0.017 42.009 42.059 -0.056 0.000 0.904 500 L HN -0.031 8.123 8.230 -0.126 0.000 0.435 501 M N -1.775 117.839 119.600 0.023 0.000 2.159 501 M HA -0.503 3.976 4.480 -0.002 0.000 0.263 501 M C 2.308 178.613 176.300 0.009 0.000 1.063 501 M CA 4.630 59.934 55.300 0.007 0.000 1.110 501 M CB -0.284 32.315 32.600 -0.002 0.000 1.374 501 M HN -0.112 8.181 8.290 0.005 0.000 0.411 502 T N 1.706 116.271 114.554 0.019 0.000 2.746 502 T HA -0.387 3.946 4.350 -0.027 0.000 0.267 502 T C 1.949 176.716 174.700 0.111 0.000 1.039 502 T CA 4.755 66.851 62.100 -0.006 0.000 1.142 502 T CB -0.732 68.023 68.868 -0.188 0.000 0.866 502 T HN -0.356 7.817 8.240 0.027 0.084 0.444 503 S N 2.534 118.371 115.700 0.229 0.000 2.359 503 S HA -0.425 4.269 4.470 0.373 0.000 0.223 503 S C 2.138 176.841 174.600 0.171 0.000 1.039 503 S CA 3.565 61.945 58.200 0.300 0.000 1.042 503 S CB -0.335 63.093 63.200 0.379 0.000 0.915 503 S HN -0.195 8.261 8.310 0.244 0.000 0.439 504 I N 0.995 121.622 120.570 0.096 0.000 2.163 504 I HA -0.569 3.610 4.170 0.016 0.000 0.243 504 I C 1.664 177.689 176.117 -0.154 0.000 1.085 504 I CA 4.268 65.544 61.300 -0.041 0.000 1.347 504 I CB -0.163 37.777 38.000 -0.100 0.000 1.044 504 I HN -0.429 7.843 8.210 0.103 0.000 0.408 505 S N 0.575 116.217 115.700 -0.097 0.000 2.365 505 S HA -0.445 3.922 4.470 -0.172 0.000 0.225 505 S C 2.228 176.797 174.600 -0.051 0.000 1.039 505 S CA 3.593 61.731 58.200 -0.104 0.000 1.033 505 S CB -0.300 62.864 63.200 -0.060 0.000 0.887 505 S HN -0.214 8.063 8.310 -0.055 0.000 0.447 506 K N 0.995 121.417 120.400 0.036 0.000 2.025 506 K HA -0.173 4.192 4.320 0.074 0.000 0.207 506 K C 2.670 179.313 176.600 0.072 0.000 1.049 506 K CA 2.367 58.707 56.287 0.088 0.000 0.933 506 K CB -0.359 32.253 32.500 0.187 0.000 0.714 506 K HN -0.308 7.983 8.250 0.068 0.000 0.438 507 S N 0.499 116.245 115.700 0.077 0.000 2.368 507 S HA -0.334 4.194 4.470 0.095 0.000 0.225 507 S C 1.948 176.589 174.600 0.069 0.000 1.030 507 S CA 3.632 61.890 58.200 0.096 0.000 0.999 507 S CB -0.165 63.139 63.200 0.173 0.000 0.844 507 S HN -0.169 8.194 8.310 0.088 0.000 0.459 508 K N 0.898 121.241 120.400 -0.094 0.000 2.063 508 K HA -0.384 3.851 4.320 -0.140 0.000 0.208 508 K C 1.888 178.449 176.600 -0.065 0.000 1.048 508 K CA 3.581 59.744 56.287 -0.207 0.000 0.928 508 K CB -0.196 32.003 32.500 -0.502 0.000 0.713 508 K HN -0.109 8.036 8.250 -0.175 0.000 0.442 509 E N -0.709 119.463 120.200 -0.047 0.000 2.058 509 E HA -0.345 3.989 4.350 -0.026 0.000 0.194 509 E C 2.087 178.691 176.600 0.007 0.000 0.997 509 E CA 3.019 59.410 56.400 -0.015 0.000 0.801 509 E CB -0.082 29.618 29.700 -0.000 0.000 0.746 509 E HN -0.497 7.830 8.360 -0.054 0.000 0.450 510 A N -0.606 122.232 122.820 0.029 0.000 1.902 510 A HA -0.358 3.971 4.320 0.015 0.000 0.217 510 A C 1.983 179.568 177.584 0.002 0.000 1.181 510 A CA 3.227 55.280 52.037 0.027 0.000 0.623 510 A CB -0.492 18.549 19.000 0.069 0.000 0.818 510 A HN -0.394 7.780 8.150 0.040 0.000 0.443 511 V N -1.085 118.855 119.914 0.044 0.000 2.295 511 V HA -0.652 3.479 4.120 0.019 0.000 0.246 511 V C 1.877 177.987 176.094 0.026 0.000 1.049 511 V CA 4.668 67.002 62.300 0.057 0.000 1.024 511 V CB -0.230 31.709 31.823 0.194 0.000 0.648 511 V HN -0.009 8.224 8.190 0.071 0.000 0.447 512 S N 0.040 115.757 115.700 0.028 0.000 2.356 512 S HA -0.359 4.122 4.470 0.020 0.000 0.223 512 S C 1.980 176.571 174.600 -0.015 0.000 1.032 512 S CA 3.564 61.769 58.200 0.010 0.000 1.005 512 S CB -0.025 63.177 63.200 0.003 0.000 0.867 512 S HN -0.566 7.762 8.310 0.031 0.000 0.449 513 L N 2.314 123.523 121.223 -0.025 0.000 1.989 513 L HA -0.311 4.008 4.340 -0.034 0.000 0.211 513 L C 1.207 178.034 176.870 -0.071 0.000 1.071 513 L CA 3.378 58.192 54.840 -0.042 0.000 0.749 513 L CB -0.106 41.928 42.059 -0.042 0.000 0.890 513 L HN -0.508 7.711 8.230 -0.018 0.000 0.431 514 L N -2.295 118.866 121.223 -0.103 0.000 2.072 514 L HA -0.476 3.760 4.340 -0.174 0.000 0.205 514 L C 2.187 178.996 176.870 -0.103 0.000 1.079 514 L CA 3.361 58.108 54.840 -0.153 0.000 0.752 514 L CB -0.704 41.208 42.059 -0.245 0.000 0.906 514 L HN -0.026 8.147 8.230 -0.094 0.000 0.436 515 N N -0.544 118.117 118.700 -0.065 0.000 2.104 515 N HA -0.325 4.386 4.740 -0.048 0.000 0.190 515 N C 2.248 177.736 175.510 -0.036 0.000 1.024 515 N CA 3.372 56.397 53.050 -0.041 0.000 0.853 515 N CB -0.516 37.963 38.487 -0.014 0.000 1.008 515 N HN 0.080 8.427 8.380 -0.054 0.000 0.424 516 D N -0.268 120.113 120.400 -0.032 0.000 2.144 516 D HA -0.184 4.444 4.640 -0.020 0.000 0.200 516 D C 1.802 178.082 176.300 -0.034 0.000 0.978 516 D CA 3.280 57.264 54.000 -0.026 0.000 0.833 516 D CB -0.499 40.288 40.800 -0.022 0.000 0.961 516 D HN -0.186 8.165 8.370 -0.033 0.000 0.470 517 A N -0.213 122.578 122.820 -0.048 0.000 1.898 517 A HA -0.199 4.097 4.320 -0.041 0.000 0.216 517 A C 2.196 179.751 177.584 -0.049 0.000 1.181 517 A CA 2.983 54.990 52.037 -0.051 0.000 0.620 517 A CB -0.496 18.462 19.000 -0.069 0.000 0.819 517 A HN -0.502 7.615 8.150 -0.056 0.000 0.442 518 I N -1.271 119.265 120.570 -0.056 0.000 2.179 518 I HA -0.618 3.523 4.170 -0.048 0.000 0.242 518 I C 1.485 177.582 176.117 -0.033 0.000 1.088 518 I CA 4.602 65.874 61.300 -0.048 0.000 1.357 518 I CB -0.224 37.745 38.000 -0.052 0.000 1.051 518 I HN -0.085 8.087 8.210 -0.065 0.000 0.409 519 D N -0.020 120.363 120.400 -0.029 0.000 2.144 519 D HA -0.292 4.337 4.640 -0.019 0.000 0.199 519 D C 1.970 178.259 176.300 -0.018 0.000 0.984 519 D CA 3.052 57.039 54.000 -0.020 0.000 0.834 519 D CB -0.551 40.239 40.800 -0.016 0.000 0.955 519 D HN -0.328 8.023 8.370 -0.031 0.000 0.465 520 A N -0.776 122.032 122.820 -0.020 0.000 1.933 520 A HA -0.215 4.096 4.320 -0.015 0.000 0.218 520 A C 1.840 179.413 177.584 -0.017 0.000 1.175 520 A CA 2.300 54.326 52.037 -0.018 0.000 0.628 520 A CB -0.075 18.913 19.000 -0.019 0.000 0.814 520 A HN -0.347 7.790 8.150 -0.023 0.000 0.444 521 Q N -2.914 116.874 119.800 -0.020 0.000 2.123 521 Q HA -0.184 4.146 4.340 -0.016 0.000 0.199 521 Q C 2.043 178.034 176.000 -0.015 0.000 0.966 521 Q CA 1.807 57.599 55.803 -0.018 0.000 0.845 521 Q CB 0.143 28.868 28.738 -0.022 0.000 0.907 521 Q HN -0.436 7.728 8.270 -0.024 0.092 0.439 522 V N 0.031 119.936 119.914 -0.015 0.000 2.307 522 V HA -0.193 3.920 4.120 -0.011 0.000 0.245 522 V C 0.660 176.748 176.094 -0.010 0.000 1.045 522 V CA 1.687 63.980 62.300 -0.012 0.000 1.024 522 V CB -0.352 31.463 31.823 -0.013 0.000 0.651 522 V HN -0.371 7.808 8.190 -0.017 0.000 0.449 523 A N 0.000 122.814 122.820 -0.011 0.000 2.254 523 A HA 0.000 4.315 4.320 -0.008 0.000 0.244 523 A CA 0.000 52.032 52.037 -0.009 0.000 0.836 523 A CB 0.000 18.995 19.000 -0.009 0.000 0.831 523 A HN 0.000 nan 8.150 nan 0.000 0.486