NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 V 4.0406 8.0544 120.3894 63.2116 32.8294 175.0570 2 H 4.5724 8.4423 123.8174 53.0823 29.2077 169.8793 3 L 4.6000 7.4299 122.2721 52.9022 44.1356 176.3380 4 T 4.0567 8.9777 118.1214 60.6221 70.7534 173.2870 5 P 4.1872 0.0000 0.0000 66.3292 30.5798 178.3964 6 E 4.0271 7.7579 116.5932 58.3846 29.3334 178.8208 7 E 3.9915 7.8385 119.6928 58.9729 29.8188 178.5228 8 K 3.8336 8.0811 120.0188 59.2685 32.1847 179.0100 9 S 4.1667 8.2295 114.5468 61.1715 62.8083 176.3750 10 A 4.1279 7.7083 123.4891 54.5581 18.0572 179.8597 11 V 3.3545 7.9274 117.1878 66.5329 31.3908 178.4997 12 T 3.9828 7.5094 113.4503 66.3785 68.5434 176.2882 13 A 4.1748 8.4998 123.1629 55.1706 18.3984 179.3352 14 L 3.7255 7.6802 118.1653 58.1613 42.1601 179.0224 15 W 4.1669 8.7391 128.1094 60.2964 30.3037 178.0375 16 G 3.7382 7.9965 105.0696 47.2378 0.0000 175.0177 17 K 4.3271 8.5116 118.9146 56.1175 32.9010 177.2245 18 V 3.7133 6.7366 119.6621 62.2951 32.1266 176.0935 19 N 4.5875 8.1697 124.9892 52.1169 38.4520 175.5741 20 V 3.5211 8.0185 121.4702 64.0751 31.5737 177.5870 21 D 4.3294 8.1556 118.2254 57.4439 40.7564 178.3698 22 E 3.8995 8.1092 119.2094 59.4107 29.8072 178.8142 23 V 3.5543 7.9035 118.5741 65.8408 31.4413 178.0637 24 G 3.7237 8.1358 105.4827 47.9173 0.0000 175.8491 25 G 3.6328 7.7501 108.8077 47.3315 0.0000 175.6428 26 E 3.9340 8.2984 120.7639 59.0477 29.5014 179.3588 27 A 3.9381 8.4034 121.2185 55.0148 18.5960 179.5044 28 L 3.9862 8.0061 119.0920 58.0747 42.2432 179.3268 29 G 3.5748 8.1280 105.6742 48.0381 0.0000 175.7538 30 R 3.8877 7.9317 121.0170 58.6851 30.0249 178.9417 31 L 3.9880 7.9279 120.0576 58.3011 42.1343 179.1652 32 L 4.0445 7.8292 118.2944 57.0701 41.2132 179.5828 33 V 3.5863 7.1959 117.1668 65.6246 31.8324 177.9709 34 V 3.4784 7.9732 116.9207 64.3113 32.7933 175.5588 35 Y 3.8346 7.0644 115.9908 53.9094 37.8980 173.9483 36 P 4.9694 0.0000 0.0000 64.2580 31.8904 177.7381 37 W 4.3882 7.8730 115.3241 59.3361 28.0932 177.6432 38 T 4.3927 7.9664 109.9851 63.4455 68.1561 176.0698 39 Q 4.4213 8.1794 121.9880 58.4004 28.4862 177.9218 40 R 3.6635 7.4117 116.6324 59.4473 29.0839 178.2214 41 F 4.1439 6.9564 114.6602 57.9809 39.8315 175.7908 42 F 4.5472 7.8153 118.8722 56.5415 39.2180 176.9989 43 E 4.1503 8.1961 119.1690 58.4451 29.8820 177.5444 44 S 4.6200 7.9367 112.5875 58.7365 63.7067 174.7749 45 F 4.6109 8.2291 119.6991 58.8622 39.8927 176.6665 46 G 3.9625 8.1374 106.1157 44.1464 0.0000 174.0853 47 D 4.4236 8.6155 125.4484 54.7119 41.0451 175.6760 48 L 4.8822 8.3412 125.5456 54.2898 43.1999 177.8005 49 S 4.2493 8.0701 117.1250 61.1814 63.0711 174.6054 50 T 4.7324 7.3976 109.3747 58.3254 73.1667 172.7476 51 P 4.2310 0.0000 0.0000 65.8236 31.3260 178.7977 52 D 4.3266 8.0553 117.1100 57.1440 40.5934 178.3417 53 A 3.9984 7.5626 120.6148 55.0015 18.4733 179.6942 54 V 3.7029 7.7135 116.3638 66.5132 31.5915 178.2600 55 M 4.1483 8.0509 117.0430 57.6376 31.8590 178.0248 56 G 4.0565 7.6557 102.9245 43.5162 0.0000 173.7431 57 N 4.3407 7.4798 121.0650 53.0800 39.8147 173.4429 58 P 4.2262 0.0000 0.0000 65.9174 31.2652 178.6665 59 K 3.6381 8.1129 118.3960 59.0206 31.7572 179.4736 60 V 3.6361 7.6685 118.0528 65.8990 31.3897 178.0473 61 K 3.9035 8.1304 118.0331 59.3375 31.7644 179.2151 62 A 3.9836 7.8783 120.9912 55.3662 18.3185 179.2013 63 H 4.2447 8.4188 116.9514 59.4906 30.0432 177.5813 64 G 3.8208 8.3448 107.6929 47.8700 0.0000 175.4464 65 K 4.0502 7.7964 121.7046 58.8567 32.1951 178.8928 66 K 3.8992 7.8018 119.9522 59.4145 32.2205 178.6447 67 V 3.6557 8.1377 118.8348 66.3183 31.4081 177.9082 68 L 4.3775 8.2984 119.4496 57.4841 41.9769 179.2087 69 G 3.6578 8.1492 106.0254 47.9784 0.0000 175.6593 70 A 4.1488 8.2364 123.9207 54.6192 18.4217 179.5873 71 F 4.2627 8.4937 119.3673 61.7253 39.3207 177.6715 72 S 4.1559 8.6260 113.9905 61.5606 62.9069 176.0702 73 D 4.5927 8.2067 121.5723 57.3833 40.5825 178.9028 74 G 3.5504 7.6758 105.6865 47.8562 0.0000 175.3963 75 L 3.8467 7.3188 119.0172 56.1421 41.6092 178.1491 76 A 4.4760 7.5542 119.0743 51.9343 20.1764 176.2234 77 H 4.8378 7.8423 115.3524 54.7986 29.8558 174.9864 78 L 4.0728 8.0219 121.2101 57.0450 42.2763 176.5968 79 D 4.5232 7.8329 116.2100 56.1834 42.3857 175.7949 80 N 5.0028 8.4521 117.1828 51.2589 39.2391 174.4873 81 L 4.0450 7.8335 123.1758 57.7817 42.2011 179.2063 82 K 3.9859 8.0593 116.9774 59.2833 32.1183 179.1927 83 G 3.6784 8.0716 105.4106 48.1272 0.0000 175.4442 84 T 3.6696 7.8678 118.3158 65.8795 68.8322 175.8232 85 F 4.6737 8.5798 117.1214 57.2986 39.1194 177.4138 86 A 4.1351 7.8273 123.1585 55.6878 18.2139 180.3065 87 T 3.8628 7.8772 107.7017 64.8125 68.7900 176.3432 88 L 4.0225 7.9323 122.7511 57.8176 42.2902 178.4850 89 S 4.2649 8.6378 113.5362 61.6912 62.2543 176.0213 90 E 3.8640 8.2009 121.0504 59.2032 29.0886 179.1294 91 L 3.8818 7.9501 120.2265 58.5916 42.1364 178.6424 92 H 4.0906 8.5175 116.3578 59.6969 28.4891 176.6854 93 C 3.6358 7.7465 120.7306 62.0432 30.9500 175.2142 94 D 4.4054 8.4236 122.7821 56.3580 40.7216 177.5270 95 K 4.2875 7.8968 117.2520 57.9187 33.5663 177.7794 96 L 4.0245 7.7358 116.7133 55.7963 42.1096 176.5773 97 H 4.2042 7.8678 113.4472 56.0088 26.3420 175.2322 98 V 3.6894 7.6774 118.2677 60.8854 32.5411 174.6009 99 D 4.3127 8.7077 127.4762 53.7027 41.6445 175.1412 100 P 3.3697 0.0000 0.0000 64.7978 31.6783 177.9591 101 E 3.8940 8.2197 120.0537 59.0848 29.2524 178.1672 102 N 4.2675 7.8501 116.8401 56.3955 38.5235 177.2222 103 F 4.4342 7.3072 118.8633 60.5291 38.9390 177.9058 104 R 4.0760 7.9755 117.8980 58.7702 29.9009 178.9251 105 L 3.7926 7.7630 118.4765 57.7252 41.5974 178.9384 106 L 4.0925 8.2465 120.5633 58.1331 41.9661 179.1104 107 G 3.7481 8.0129 105.5068 48.1310 0.0000 175.4001 108 N 4.4352 8.1858 119.1791 55.7793 38.4763 177.6750 109 V 3.6136 7.9717 119.6885 65.9665 31.6569 177.6899 110 L 3.8640 8.1539 120.2929 58.3421 41.9718 179.1777 111 V 3.6627 7.8126 117.9403 66.0929 31.3398 177.8501 112 C 4.1302 8.1318 116.6509 62.6564 27.9120 176.1305 113 V 3.4754 7.9657 120.2391 66.0848 31.1281 178.1667 114 L 3.8425 8.1447 118.7775 57.3622 41.3859 179.4295 115 A 3.6924 7.2557 120.7768 55.0520 18.0991 178.8784 116 H 4.0756 8.5075 116.4572 59.9982 29.9551 176.8899 117 H 4.0228 8.1686 116.3617 58.3051 28.8723 177.0414 118 F 4.5773 8.4011 117.3779 56.4821 39.7056 177.5040 119 G 3.8525 8.5467 109.2992 45.8342 0.0000 177.1710 120 K 3.9725 8.9243 122.0408 59.3899 32.2805 177.8486 121 E 4.0870 8.3955 120.0502 58.6752 29.9762 177.1076 122 F 4.5299 8.1572 123.0628 57.0107 37.9200 175.3828 123 T 4.1784 7.4364 115.4157 60.1029 71.4714 173.4771 124 P 4.1657 0.0000 0.0000 65.6006 30.8913 177.1134 125 P 4.3129 0.0000 0.0000 65.3335 31.3451 178.3327 126 V 3.6408 7.9397 118.9603 65.4845 31.3776 177.7408 127 Q 3.6204 7.5042 118.8961 58.8244 28.8987 177.6461 128 A 4.0498 7.8817 121.2956 55.0792 18.3584 179.5539 129 A 3.8586 7.6750 118.1855 55.5984 18.4706 179.5445 130 Y 3.8981 8.0190 115.2344 61.1031 37.9046 178.6194 131 Q 4.1064 8.7431 119.5199 59.0291 28.8775 179.1350 132 K 3.9228 7.8581 118.9727 59.4430 32.1319 179.5325 133 V 3.4866 7.6439 118.2425 66.2746 31.5340 178.6268 134 V 3.8809 8.6759 112.0811 64.1684 31.2636 178.5418 135 A 4.1327 8.2125 121.1632 54.8246 18.1142 179.7862 136 G 3.5382 8.1748 104.3124 47.9709 0.0000 176.0511 137 V 3.3188 7.7884 120.9377 65.4666 31.6222 177.8483 138 A 3.9251 8.0363 120.4654 55.1757 18.2731 179.3791 139 N 4.2321 8.3621 114.7318 56.4473 38.4541 177.2803 140 A 4.0138 7.9181 121.0095 55.4595 18.5436 179.5189 141 L 3.8902 7.9600 115.8820 56.7887 41.8498 178.5181 142 A 4.6329 7.8134 119.7113 52.5625 19.1462 178.3790 143 H 4.1335 7.8876 112.9151 58.5531 28.3956 176.4910 144 K 4.3021 7.8828 116.3797 56.1901 32.0704 176.5627 145 Y 4.2695 8.0163 117.8265 58.4079 38.5055 175.5087 146 H 4.4261 8.3697 116.9938 56.3067 28.1025 173.4692 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 1 V 8.05 4.04 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 0.93 0.00 0.00 2 H 8.44 4.57 0.00 3.16 3.16 0.00 5.76 0.00 0.00 0.00 0.00 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 L 7.43 4.60 0.00 1.52 1.47 0.87 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 4 T 8.98 4.06 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 5 P 0.00 4.19 0.00 2.25 2.33 0.00 3.65 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.01 0.00 6 E 7.76 4.03 0.00 2.23 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.32 0.00 7 E 7.84 3.99 0.00 2.12 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.29 0.00 8 K 8.08 3.83 0.00 1.74 1.97 0.00 1.56 0.00 0.00 1.61 0.00 0.00 2.91 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.38 1.37 7.81 9 S 8.23 4.17 0.00 4.09 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 A 7.71 4.13 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 V 7.93 3.35 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.54 0.00 0.00 0.53 0.00 0.00 12 T 7.51 3.98 4.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 13 A 8.50 4.17 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 L 7.68 3.73 0.00 1.82 1.89 0.50 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.00 0.00 0.00 0.00 0.00 0.00 15 W 8.74 4.17 0.00 3.84 3.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 G 8.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 K 8.51 4.33 0.00 2.11 2.13 0.00 1.96 0.00 0.00 1.81 0.00 0.00 3.02 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.53 1.75 7.81 18 V 6.74 3.71 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.07 0.00 0.00 0.75 0.00 0.00 19 N 8.17 4.59 0.00 2.72 2.62 0.00 0.00 7.17 7.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 V 8.02 3.52 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.00 0.00 1.03 0.00 0.00 21 D 8.16 4.33 0.00 2.88 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 E 8.11 3.90 0.00 1.95 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.31 0.00 23 V 7.90 3.55 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.00 0.00 0.66 0.00 0.00 24 G 8.14 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 G 7.75 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 E 8.30 3.93 0.00 2.16 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.49 0.00 27 A 8.40 3.94 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 L 8.01 3.99 0.00 1.79 1.65 0.94 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 29 G 8.13 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 R 7.93 3.89 0.00 1.97 1.94 0.00 3.07 0.00 0.00 3.02 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.66 0.00 31 L 7.93 3.99 0.00 1.89 1.87 1.04 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 32 L 7.83 4.04 0.00 1.84 1.68 0.65 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 33 V 7.20 3.59 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.00 0.00 0.87 0.00 0.00 34 V 7.97 3.48 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 0.76 0.00 0.00 35 Y 7.06 3.83 0.00 2.61 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 P 0.00 4.97 0.00 2.14 2.11 0.00 3.97 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 1.89 0.00 37 W 7.87 4.39 0.00 3.55 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 T 7.97 4.39 4.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 39 Q 8.18 4.42 0.00 2.29 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.74 0.00 0.00 0.00 0.00 0.00 2.44 2.48 0.00 40 R 7.41 3.66 0.00 1.45 1.81 0.00 3.00 0.00 0.00 2.86 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.50 0.00 41 F 6.96 4.14 0.00 1.85 2.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 F 7.82 4.55 0.00 2.82 1.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 E 8.20 4.15 0.00 2.08 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.30 0.00 44 S 7.94 4.62 0.00 4.13 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 F 8.23 4.61 0.00 3.23 3.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 G 8.14 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 D 8.62 4.42 0.00 2.67 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 L 8.34 4.88 0.00 1.65 1.61 1.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 49 S 8.07 4.25 0.00 3.93 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 T 7.40 4.73 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 51 P 0.00 4.23 0.00 2.14 2.09 0.00 3.57 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.14 0.00 52 D 8.06 4.33 0.00 2.67 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 A 7.56 4.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 V 7.71 3.70 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 1.01 0.00 0.00 55 M 8.05 4.15 0.00 2.00 2.14 0.00 0.00 0.00 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.87 0.00 56 G 7.66 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 N 7.48 4.34 0.00 3.01 2.85 0.00 0.00 6.83 8.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 P 0.00 4.23 0.00 2.23 2.25 0.00 3.71 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.02 0.00 59 K 8.11 3.64 0.00 1.44 0.74 0.00 1.42 0.00 0.00 1.26 0.00 0.00 2.84 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.20 1.24 7.81 60 V 7.67 3.64 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 1.02 0.00 0.00 61 K 8.13 3.90 0.00 1.96 1.81 0.00 1.69 0.00 0.00 1.62 0.00 0.00 2.98 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.43 1.56 7.81 62 A 7.88 3.98 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 H 8.42 4.24 0.00 3.55 3.51 0.00 5.80 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 G 8.34 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 K 7.80 4.05 0.00 1.82 2.02 0.00 1.74 0.00 0.00 1.58 0.00 0.00 2.92 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.45 1.47 7.81 66 K 7.80 3.90 0.00 2.00 2.03 0.00 1.80 0.00 0.00 1.69 0.00 0.00 2.95 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.49 1.50 7.81 67 V 8.14 3.66 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.99 0.00 0.00 68 L 8.30 4.38 0.00 2.05 1.79 1.21 nan 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 69 G 8.15 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 A 8.24 4.15 1.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 F 8.49 4.26 0.00 3.36 3.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 S 8.63 4.16 0.00 4.12 4.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 D 8.21 4.59 0.00 2.94 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 G 7.68 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 L 7.32 3.85 0.00 1.45 1.41 0.21 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.48 0.00 0.00 0.00 0.00 0.00 0.00 76 A 7.55 4.48 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 H 7.84 4.84 0.00 3.10 3.14 0.00 5.82 0.00 0.00 0.00 0.00 8.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 L 8.02 4.07 0.00 1.46 1.60 0.77 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 79 D 7.83 4.52 0.00 2.63 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 N 8.45 5.00 0.00 2.69 2.57 0.00 0.00 7.07 6.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 L 7.83 4.05 0.00 1.75 1.81 0.87 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 82 K 8.06 3.99 0.00 1.60 1.48 0.00 1.69 0.00 0.00 1.58 0.00 0.00 3.00 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.38 1.46 7.81 83 G 8.07 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 T 7.87 3.67 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.52 0.00 0.00 85 F 8.58 4.67 0.00 3.24 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 A 7.83 4.14 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 T 7.88 3.86 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 88 L 7.93 4.02 0.00 1.93 1.96 1.03 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 89 S 8.64 4.26 0.00 4.12 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 E 8.20 3.86 0.00 2.24 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.29 0.00 91 L 7.95 3.88 0.00 1.92 1.85 0.91 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 92 H 8.52 4.09 0.00 3.49 3.79 0.00 5.87 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 C 7.75 3.64 0.00 1.23 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 D 8.42 4.41 0.00 2.72 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 K 7.90 4.29 0.00 1.73 1.78 0.00 1.55 0.00 0.00 1.68 0.00 0.00 3.05 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.36 1.39 7.81 96 L 7.74 4.02 0.00 1.71 1.62 0.71 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 97 H 7.87 4.20 0.00 3.41 3.45 0.00 5.60 0.00 0.00 0.00 0.00 8.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 7.68 3.69 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.06 0.00 0.00 0.33 0.00 0.00 99 D 8.71 4.31 0.00 2.81 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 P 0.00 3.37 0.00 1.98 1.86 0.00 3.47 0.00 0.00 3.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.50 0.00 101 E 8.22 3.89 0.00 2.05 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.39 0.00 102 N 7.85 4.27 0.00 2.56 2.70 0.00 0.00 6.88 8.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 F 7.31 4.43 0.00 3.11 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 R 7.98 4.08 0.00 1.88 1.99 0.00 3.13 0.00 0.00 3.18 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.73 0.00 105 L 7.76 3.79 0.00 1.67 1.29 0.60 0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 106 L 8.25 4.09 0.00 1.81 1.76 0.94 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 107 G 8.01 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 N 8.19 4.44 0.00 2.93 2.95 0.00 0.00 6.71 7.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 V 7.97 3.61 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 1.16 0.00 0.00 110 L 8.15 3.86 0.00 1.69 1.87 0.87 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 111 V 7.81 3.66 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 1.18 0.00 0.00 112 C 8.13 4.13 0.00 3.18 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 V 7.97 3.48 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 0.93 0.00 0.00 114 L 8.14 3.84 0.00 0.64 1.07 0.57 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 115 A 7.26 3.69 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 H 8.51 4.08 0.00 3.14 3.54 0.00 5.78 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 H 8.17 4.02 0.00 2.83 2.65 0.00 5.71 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 F 8.40 4.58 0.00 3.39 3.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 G 8.55 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 K 8.92 3.97 0.00 1.92 2.03 0.00 1.64 0.00 0.00 1.69 0.00 0.00 3.07 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.47 1.43 7.81 121 E 8.40 4.09 0.00 2.25 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.34 0.00 122 F 8.16 4.53 0.00 3.09 3.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 T 7.44 4.18 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 124 P 0.00 4.17 0.00 2.16 2.17 0.00 3.58 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.19 0.00 125 P 0.00 4.31 0.00 2.22 2.28 0.00 3.53 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.99 0.00 126 V 7.94 3.64 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 0.89 0.00 0.00 127 Q 7.50 3.62 0.00 1.78 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.66 0.00 0.00 0.00 0.00 0.00 2.52 2.70 0.00 128 A 7.88 4.05 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 A 7.68 3.86 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 Y 8.02 3.90 0.00 3.46 3.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 Q 8.74 4.11 0.00 2.23 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.79 0.00 0.00 0.00 0.00 0.00 2.79 2.63 0.00 132 K 7.86 3.92 0.00 1.92 1.83 0.00 1.64 0.00 0.00 1.63 0.00 0.00 2.95 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.62 7.81 133 V 7.64 3.49 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 0.75 0.00 0.00 134 V 8.68 3.88 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 1.12 0.00 0.00 135 A 8.21 4.13 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 136 G 8.17 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 137 V 7.79 3.32 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.62 0.00 0.00 0.68 0.00 0.00 138 A 8.04 3.93 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 N 8.36 4.23 0.00 2.92 2.88 0.00 0.00 6.88 7.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 A 7.92 4.01 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 L 7.96 3.89 0.00 1.15 0.45 0.04 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.54 0.00 0.00 0.00 0.00 0.00 0.00 142 A 7.81 4.63 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 H 7.89 4.13 0.00 3.33 3.67 0.00 5.75 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 K 7.88 4.30 0.00 1.76 1.82 0.00 1.63 0.00 0.00 1.47 0.00 0.00 3.00 0.00 0.00 2.99 0.00 0.00 0.00 0.00 0.89 1.64 7.81 145 Y 8.02 4.27 0.00 3.09 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 146 H 8.37 4.43 0.00 3.22 3.25 0.00 5.75 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00