NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 R 4.3367 8.2549 119.0722 55.9086 31.8116 175.6340 5 K 4.2076 7.8710 117.5049 54.7565 32.9388 174.6689 6 L 4.7568 9.1899 124.1718 52.8370 45.0429 175.4749 7 I 4.5328 8.2719 123.4741 59.5161 39.5172 175.1705 8 S 4.7805 8.3723 119.5791 56.8879 66.2770 173.2603 9 A 4.6460 8.0853 123.9043 51.3706 21.8075 175.9366 10 T 4.4315 8.2830 117.3690 61.7135 71.8006 173.6003 11 D 4.6691 8.4464 126.3161 52.5807 40.5071 176.5703 12 I 3.9899 8.1413 120.4070 62.8030 38.3956 177.2305 13 Q 4.2185 8.1736 119.6409 57.6680 29.3509 177.4847 14 Y 4.0665 8.0872 119.3677 60.8195 38.8458 178.0737 15 S 3.9678 8.1877 114.8274 61.0689 63.1362 176.4593 16 G 3.4622 7.9094 108.9673 47.6744 0.0000 175.4684 17 S 4.0245 7.7739 115.5274 60.7207 62.2816 175.9072 18 L 3.6809 7.7346 123.2893 58.0481 41.7260 178.5966 19 L 3.8404 7.6220 120.1942 58.2483 41.9324 178.4388 20 N 4.2846 8.0910 116.8608 56.8603 38.7943 177.0726 21 S 4.1640 8.2857 116.6871 61.5129 62.8526 176.6485 22 L 4.0730 8.3075 122.1541 57.8065 41.3511 179.0851 23 N 4.2722 8.6476 117.3091 56.5749 38.3968 176.7862 24 E 3.9303 8.3948 120.0934 59.4594 29.5512 179.1434 25 Q 4.0968 8.3479 118.2099 59.2041 28.8967 179.0493 26 R 3.8462 8.2359 119.6588 59.4850 29.7679 178.5311 27 G 3.6500 7.7336 104.2865 47.9096 0.0000 174.4397 28 H 4.6534 7.6817 115.0124 55.1436 29.4310 176.3695 29 G 3.8578 7.9277 109.2824 45.6192 0.0000 173.2921 30 L 3.9403 7.8899 120.1537 55.3982 41.8376 177.2617 31 F 3.9779 8.1655 119.7711 58.1187 36.9321 174.9195 32 C 4.3595 7.9470 119.7994 59.9396 28.0963 173.0021 33 D 5.1244 8.4722 122.8423 52.8012 40.1486 176.0150 34 V 4.7581 7.5198 117.7094 60.9036 35.2585 173.4587 35 T 5.1404 8.8697 118.9202 61.8846 71.7386 172.9955 36 V 4.7475 9.2380 126.8998 61.4256 33.7001 174.2845 37 I 4.8337 8.9158 129.9811 60.1148 39.1270 175.1060 38 V 4.4400 8.7938 126.9692 60.9611 34.4929 176.2849 39 E 3.6102 9.1024 129.6004 57.9443 28.8283 175.2024 40 D 4.9020 9.0430 124.0138 53.7840 39.6968 175.8032 41 R 4.5891 8.0944 117.9588 54.7021 33.6344 174.1615 42 K 5.0505 8.2174 119.5830 54.6200 34.9671 175.4223 43 F 4.8745 9.3890 123.5156 55.7386 41.8193 174.7749 44 R 4.8640 8.7717 122.6947 55.9097 31.3952 175.4182 45 A 4.5346 8.7330 123.2436 51.7124 23.9334 174.1724 46 H 5.1888 9.0864 116.0653 54.3572 30.3964 176.9769 47 K 3.6371 9.5820 124.3551 59.3155 31.9414 179.1465 48 N 4.3823 8.1113 116.8579 56.1309 37.2384 177.2798 49 I 3.6520 7.6569 121.5749 63.9693 37.4118 178.2312 50 L 4.1031 8.0470 119.8563 57.9241 41.3231 179.4974 51 S 4.4200 8.8586 113.3385 61.5098 62.1069 176.1317 52 A 4.1014 8.0312 122.6794 54.2239 18.2462 178.7152 53 S 4.7714 7.7858 109.4456 57.3812 64.2787 174.1421 54 S 4.8717 7.8859 117.7107 55.9418 65.1113 174.5326 55 T 3.9601 8.8544 119.4127 64.8955 68.3494 176.0878 56 Y 3.8670 8.0198 122.3475 60.7090 38.8011 178.1740 57 F 3.9338 8.1982 118.6377 60.4062 38.6679 177.1292 58 H 4.3465 8.3952 119.1261 58.7023 29.6354 176.7280 59 Q 4.0079 7.9923 121.1582 59.0997 29.0225 177.9639 60 L 3.7707 7.6493 121.4895 57.9612 41.8486 178.0614 61 F 5.0683 7.7893 114.8414 57.9202 38.9958 176.8314 62 S 4.2627 7.7382 114.9541 60.3735 63.2941 174.8065 63 V 4.0122 7.4099 120.1555 61.0499 32.1996 175.4239 64 A 4.1367 8.6116 129.3123 52.0445 18.7881 176.1640 65 G 4.2975 7.8093 112.2269 45.1492 0.0000 172.8016 66 Q 4.5283 8.2449 121.4752 55.5933 30.8665 175.1635 67 V 4.9924 7.7804 118.6200 61.0823 34.4469 174.8978 68 V 4.7167 9.0224 120.2235 59.4949 35.7343 173.9894 69 E 5.1063 8.8673 123.8345 54.4294 31.9181 174.7182 70 L 4.7559 8.5988 127.0619 52.9530 43.4673 176.3725 71 S 4.2918 8.2132 117.2750 57.6873 65.1004 174.7812 72 F 4.2683 8.3914 117.9084 57.7716 36.0890 174.9259 73 I 4.6378 7.1032 120.8622 58.7899 40.1991 176.2875 74 R 4.5070 8.5150 123.8045 55.6817 32.0442 177.5053 75 A 4.2842 9.3726 124.8322 55.5991 18.3464 180.3356 76 E 4.0816 8.2723 115.4133 59.2701 29.8139 179.4372 77 I 3.7495 7.7472 120.6415 64.3198 37.3231 177.6723 78 F 4.0285 8.4363 121.3510 61.2451 39.0854 176.7390 79 A 3.8167 8.3303 120.5733 55.4591 18.1530 179.5598 80 E 3.9621 7.9001 116.9247 59.4226 29.4395 179.5406 81 I 3.7312 7.7220 119.9139 64.4776 37.1882 178.5075 82 L 3.9474 7.7321 120.0790 57.6682 41.2547 179.2352 83 N 4.3841 8.2869 116.5875 56.4144 38.4673 176.7143 84 Y 4.5570 8.1142 122.1243 60.4818 38.7526 178.2692 85 I 3.5654 7.9434 119.2672 63.7358 37.1524 177.0132 86 Y 4.4297 7.6990 115.1363 57.5409 38.1254 176.1828 87 S 4.4673 7.2865 112.4641 57.2148 66.6720 175.4198 88 S 3.6103 8.1909 114.5321 57.5892 62.4791 169.1973 89 K 4.8068 7.9153 120.0035 55.1573 35.1355 174.8924 90 I 4.7246 8.4424 120.8570 59.5359 39.2044 175.3356 91 V 4.2804 8.0853 123.8692 61.9824 33.6489 175.3845 92 R 3.7870 8.6642 127.4341 57.1413 27.5173 176.8088 93 V 3.8825 7.6813 116.2424 61.9358 32.6876 175.5627 94 R 4.0062 8.5944 126.1434 56.5744 30.7621 177.6797 95 S 4.1150 8.7748 116.3130 61.3017 62.2154 175.7444 96 D 4.5480 8.0561 119.7820 55.0671 39.5866 177.1524 97 L 4.4289 7.9098 120.0344 55.2563 42.1075 178.1298 98 L 3.9189 7.7049 121.4292 58.1284 41.9643 178.4033 99 D 4.3288 8.0403 118.3193 57.5362 40.8565 178.4604 100 E 3.9420 8.1462 118.4716 59.2927 29.4468 179.0614 101 L 3.9594 8.0877 120.4625 58.1116 42.1181 178.9957 102 I 3.7870 8.0206 120.0982 64.5128 37.0070 178.5774 103 K 4.2927 8.1283 120.6343 59.0827 31.8109 179.6187 104 S 4.2124 8.3023 115.6315 61.4546 62.6480 176.9739 105 G 3.5785 8.2859 108.5734 47.7461 0.0000 175.7910 106 Q 3.9736 8.2194 120.5135 58.7777 28.5535 178.9368 107 L 3.9162 7.8072 118.6670 57.6350 42.0112 179.0363 108 L 4.0833 8.1956 117.3287 54.1183 42.5818 176.6141 109 G 4.1126 7.6593 106.6937 46.3711 0.0000 175.1019 110 V 4.5480 8.0739 122.4520 61.2572 31.8531 176.4868 111 K 3.9913 8.6803 132.7491 59.7527 31.4185 176.3097 112 F 4.3351 8.1539 120.4662 61.1069 39.6923 176.8881 113 I 3.6052 7.5357 118.8199 64.1617 36.8057 178.0900 114 A 4.1770 8.0099 120.1197 54.1893 18.2142 178.4110 115 A 4.3365 7.0413 117.0672 51.9530 19.2595 177.1684 116 L 3.8628 7.4199 123.5861 55.0802 41.6461 176.9508 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 4 R 8.25 4.34 0.00 1.85 1.91 0.00 3.22 0.00 0.00 3.22 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.23 0.00 5 K 7.87 4.21 0.00 1.81 1.76 0.00 1.66 0.00 0.00 1.70 0.00 0.00 2.94 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.42 1.52 7.81 6 L 9.19 4.76 0.00 1.58 1.54 0.91 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 7 I 8.27 4.53 1.86 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.58 0.90 0.00 0.00 8 S 8.37 4.78 0.00 3.79 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 A 8.09 4.65 1.17 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 0.00 0.00 10 T 8.28 4.43 4.24 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 1.21 0.00 0.00 11 D 8.45 4.67 0.00 2.72 2.57 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 12 I 8.14 3.99 1.88 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.72 0.92 0.00 0.00 13 Q 8.17 4.22 0.00 2.29 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.87 6.85 0.00 0.00 0.00 0.00 0.00 2.38 2.45 0.00 14 Y 8.09 4.07 0.00 3.27 3.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 S 8.19 3.97 0.00 4.04 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 0.00 16 G 7.91 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.77 4.02 0.00 3.89 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 L 7.73 3.68 0.00 1.01 1.42 0.80 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 19 L 7.62 3.84 0.00 1.85 1.71 0.73 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 20 N 8.09 4.28 0.00 2.87 2.90 0.00 0.00 7.25 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 21 S 8.29 4.16 0.00 4.02 3.91 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.31 4.07 0.00 1.91 1.92 0.82 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 23 N 8.65 4.27 0.00 3.22 2.98 0.00 0.00 7.22 8.28 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 24 E 8.39 3.93 0.00 2.29 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 0.00 2.34 2.60 0.00 25 Q 8.35 4.10 0.00 2.47 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.77 0.00 0.00 0.00 0.00 0.00 2.57 2.69 0.00 26 R 8.24 3.85 0.00 1.51 1.79 0.00 2.64 0.00 0.00 2.25 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.48 0.00 27 G 7.73 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 H 7.68 4.65 0.00 3.23 3.28 0.00 5.94 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 G 7.93 3.86 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 L 7.89 3.94 0.00 1.55 1.01 0.77 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 31 F 8.17 3.98 0.00 3.38 3.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 C 7.95 4.36 0.00 3.07 2.89 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 0.00 0.00 0.00 33 D 8.47 5.12 0.00 2.57 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 V 7.52 4.76 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 0.67 0.00 0.00 1.03 0.00 0.00 35 T 8.87 5.14 4.28 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 0.00 0.00 1.25 0.00 0.00 36 V 9.24 4.75 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 0.85 0.00 0.00 1.11 0.00 0.00 37 I 8.92 4.83 2.00 0.00 0.00 0.88 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 0.51 1.05 0.00 0.00 38 V 8.79 4.44 2.35 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 1.02 0.00 0.00 0.45 0.00 0.00 39 E 9.10 3.61 0.00 2.16 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.30 0.00 40 D 9.04 4.90 0.00 2.76 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 R 8.09 4.59 0.00 2.01 1.33 0.00 3.08 0.00 0.00 3.26 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.54 0.00 42 K 8.22 5.05 0.00 1.51 1.67 0.00 1.66 0.00 0.00 1.70 0.00 0.00 2.80 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.32 1.38 7.81 43 F 9.39 4.87 0.00 3.13 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 R 8.77 4.86 0.00 1.67 1.82 0.00 3.20 0.00 0.00 3.19 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.62 0.00 45 A 8.73 4.53 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 H 9.09 5.19 0.00 3.26 3.42 0.00 5.82 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 K 9.58 3.64 0.00 1.62 1.46 0.00 1.36 0.00 0.00 1.09 0.00 0.00 2.50 0.00 0.00 2.95 0.00 0.00 0.00 0.00 0.30 1.12 7.81 48 N 8.11 4.38 0.00 2.91 3.07 0.00 0.00 6.27 7.57 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 49 I 7.66 3.65 1.75 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.99 0.34 0.00 0.00 50 L 8.05 4.10 0.00 2.02 1.61 0.62 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 51 S 8.86 4.42 0.00 4.20 4.17 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 52 A 8.03 4.10 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.79 4.77 0.00 4.11 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 54 S 7.89 4.87 0.00 4.13 4.35 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 55 T 8.85 3.96 4.27 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 1.31 0.00 0.00 56 Y 8.02 3.87 0.00 2.96 2.68 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 57 F 8.20 3.93 0.00 3.29 2.70 0.00 0.00 0.00 0.00 0.00 0.00 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 H 8.40 4.35 0.00 3.46 3.57 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 59 Q 7.99 4.01 0.00 2.19 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.58 0.00 0.00 0.00 0.00 0.00 2.36 2.24 0.00 60 L 7.65 3.77 0.00 1.33 1.18 0.80 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 61 F 7.79 5.07 0.00 3.14 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 62 S 7.74 4.26 0.00 3.97 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 63 V 7.41 4.01 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 0.80 0.00 0.00 0.94 0.00 0.00 64 A 8.61 4.14 1.27 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 0.00 0.00 65 G 7.81 4.30 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 Q 8.24 4.53 0.00 2.01 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.81 0.00 0.00 0.00 0.00 0.00 2.33 2.31 0.00 67 V 7.78 4.99 2.12 0.00 0.00 0.00 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 0.95 0.00 0.00 68 V 9.02 4.72 2.27 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 0.90 0.00 0.00 1.23 0.00 0.00 69 E 8.87 5.11 0.00 1.92 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.29 0.00 70 L 8.60 4.76 0.00 1.32 1.35 0.47 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 71 S 8.21 4.29 0.00 2.75 3.45 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 72 F 8.39 4.27 0.00 3.21 3.13 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 0.00 0.00 0.00 0.00 73 I 7.10 4.64 1.86 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.62 1.02 0.00 0.00 74 R 8.52 4.51 0.00 1.91 1.90 0.00 3.17 0.00 0.00 3.37 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.73 0.00 75 A 9.37 4.28 1.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 E 8.27 4.08 0.00 2.28 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.45 0.00 77 I 7.75 3.75 2.07 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.15 0.98 0.00 0.00 78 F 8.44 4.03 0.00 3.05 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 A 8.33 3.82 1.62 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 0.00 0.00 80 E 7.90 3.96 0.00 2.11 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 0.00 2.56 2.52 0.00 81 I 7.72 3.73 1.72 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.72 0.95 0.00 0.00 82 L 7.73 3.95 0.00 1.55 1.63 0.89 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 83 N 8.29 4.38 0.00 2.98 2.92 0.00 0.00 6.62 7.10 0.00 0.00 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 Y 8.11 4.56 0.00 3.15 3.20 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 0.00 0.00 0.00 0.00 85 I 7.94 3.57 2.05 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.01 0.68 0.00 0.00 86 Y 7.70 4.43 0.00 3.03 3.05 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.29 4.47 0.00 4.02 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 S 8.19 3.61 0.00 3.92 3.98 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 0.00 0.00 0.00 0.00 89 K 7.92 4.81 0.00 1.99 1.94 0.00 1.27 0.00 0.00 1.66 0.00 0.00 2.93 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.45 1.39 7.81 90 I 8.44 4.72 1.99 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.97 0.96 0.00 0.00 91 V 8.09 4.28 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 0.97 0.00 0.00 92 R 8.66 3.79 0.00 1.99 1.98 0.00 3.27 0.00 0.00 3.17 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.61 0.00 93 V 7.68 3.88 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 0.96 0.00 0.00 94 R 8.59 4.01 0.00 1.92 2.05 0.00 3.19 0.00 0.00 3.28 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.65 0.00 95 S 8.77 4.11 0.00 3.88 3.86 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 0.00 0.00 0.00 0.00 96 D 8.06 4.55 0.00 2.87 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 L 7.91 4.43 0.00 1.86 1.74 0.94 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 98 L 7.70 3.92 0.00 1.77 1.70 0.88 1.18 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 99 D 8.04 4.33 0.00 2.71 2.68 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 0.00 100 E 8.15 3.94 0.00 2.19 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 0.00 2.41 2.38 0.00 101 L 8.09 3.96 0.00 1.74 1.81 0.91 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 102 I 8.02 3.79 1.99 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.47 0.89 0.00 0.00 103 K 8.13 4.29 0.00 2.00 1.83 0.00 1.79 0.00 0.00 1.74 0.00 0.00 2.89 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.46 1.21 7.81 104 S 8.30 4.21 0.00 4.01 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 0.00 105 G 8.29 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 Q 8.22 3.97 0.00 2.25 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.75 0.00 0.00 0.00 0.00 0.00 2.34 2.53 0.00 107 L 7.81 3.92 0.00 1.65 1.55 0.91 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 108 L 8.20 4.08 0.00 1.79 1.67 1.15 0.18 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 0.00 109 G 7.66 4.11 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 V 8.07 4.55 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 1.08 0.00 0.00 1.09 0.00 0.00 111 K 8.68 3.99 0.00 1.80 1.81 0.00 1.85 0.00 0.00 1.74 0.00 0.00 2.84 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.45 1.07 7.81 112 F 8.15 4.34 0.00 2.99 2.89 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 0.00 0.00 0.00 113 I 7.54 3.61 1.87 0.00 0.00 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.71 0.84 0.00 0.00 114 A 8.01 4.18 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 0.00 115 A 7.04 4.34 1.21 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 0.00 0.00 116 L 7.42 3.86 0.00 1.52 1.45 0.82 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00