NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 S 4.1475 8.3301 115.4129 58.1624 64.2388 171.9026 2 A 3.4045 8.2791 127.0275 52.4479 16.6920 177.0019 3 D 4.3839 9.1865 123.8203 57.9290 42.1232 176.2251 4 H 4.1707 7.9438 116.7326 58.9383 28.6881 177.2965 5 E 3.9916 7.9926 119.6514 59.3687 29.2549 179.6186 6 R 3.8286 7.9114 117.7287 59.1534 30.3218 178.6053 7 E 3.8841 8.1889 118.8676 59.1634 29.4628 178.7150 8 A 3.9580 8.0533 119.9866 55.2370 18.6360 179.0845 9 Q 3.9975 8.8369 119.0963 59.1030 29.2222 178.3139 10 K 3.8826 8.2314 120.5782 59.3936 32.0361 178.5573 11 A 3.9559 7.8584 120.7251 55.2611 18.0871 179.4891 12 E 3.7524 7.8291 117.1562 59.2389 28.9027 179.1129 13 E 3.8876 7.9052 119.2491 59.2769 29.8331 178.5590 14 E 3.9651 7.8329 117.9234 58.8813 29.7407 178.5071 15 L 3.9155 7.4903 120.8192 58.2042 42.2463 178.9906 16 Q 4.0113 7.9663 117.5196 58.7769 28.6924 178.4606 17 K 3.9619 7.7657 119.8691 59.4662 32.0728 179.0585 18 V 3.6211 7.7311 118.1627 65.9349 31.4452 177.9613 19 L 4.0050 7.8419 118.3284 57.8089 41.0217 179.3865 20 E 4.0271 8.1348 118.0753 59.6030 29.3404 179.3767 21 E 4.0271 8.3013 118.3629 59.3762 29.4970 179.2997 22 A 4.1201 9.1319 122.3604 54.9814 18.5516 179.7259 23 S 4.2758 8.7729 113.3095 61.8093 62.8648 176.8355 24 K 4.0665 7.9532 122.7800 58.9016 31.5171 178.9505 25 K 4.0215 7.9125 118.9169 58.9028 32.0225 179.0561 26 A 3.9794 8.7871 121.8371 55.1066 18.4429 180.0592 27 V 3.6114 7.5865 117.1766 65.0078 31.2314 178.1956 28 E 3.8617 7.6873 118.8724 58.7299 29.9267 178.2586 29 A 4.0897 9.0796 121.7265 55.1651 18.0555 179.2545 30 E 3.8100 8.5083 118.2647 58.0266 29.6544 177.1300 31 R 3.9935 7.1080 119.3126 57.3255 30.4995 176.4667 32 G 3.9126 9.1000 113.5967 44.9953 0.0000 173.0332 33 A 4.7921 7.3681 121.5262 49.1876 20.2290 175.2648 34 P 4.3287 0.0000 0.0000 63.6415 32.1085 176.4823 35 G 3.8420 8.8500 108.7085 46.1784 0.0000 173.4047 36 A 4.0092 8.1115 121.1941 52.3766 18.7232 178.1807 37 A 4.4224 8.2260 122.9217 52.3097 21.3096 176.9912 38 L 4.2393 7.4913 118.6874 53.5266 40.3115 175.6460 39 I 4.2240 7.4350 111.9663 59.9605 38.9179 177.1849 40 S 4.3443 7.7057 116.1218 58.6333 63.7433 172.3682 41 Y 4.6964 8.2201 122.1744 58.8971 40.0521 175.9608 42 P 3.4749 0.0000 0.0000 65.2761 31.4334 176.6588 43 D 4.5117 7.8069 116.0607 54.3015 41.6135 177.8795 44 A 4.1502 8.2455 123.2886 55.2418 18.3268 179.6630 45 I 3.8821 7.9101 116.7333 63.9635 37.8897 177.8585 46 W 4.2779 8.5539 119.5376 59.7775 29.0432 178.1074 47 W 4.1528 8.4136 127.9835 60.5248 30.1709 177.9853 48 S 3.1950 8.5438 113.2810 60.7962 61.5614 176.2687 49 V 3.4514 7.9908 120.9526 65.9581 31.4481 177.6928 50 E 4.2949 7.4846 118.2495 58.9250 29.2542 179.2089 51 T 3.5300 7.1086 116.4571 66.3726 68.4697 176.4206 52 A 3.9883 7.8409 122.7813 54.9477 18.4348 178.7716 53 T 4.2211 7.5157 106.8810 60.7917 70.0337 174.4716 54 T 3.6476 7.7330 109.1939 62.9291 67.8911 171.2253 55 V 4.3282 7.2022 116.6557 62.3653 38.0389 177.6738 56 G 3.8872 8.6453 111.8661 44.9868 0.0000 172.5432 57 Y 3.4612 8.4887 122.3401 56.8698 38.8722 169.4212 58 G 3.8183 7.7236 115.5356 45.9391 0.0000 174.1570 59 D 4.6282 7.7176 120.6033 56.0872 41.2844 177.0973 60 R 4.9245 7.7754 114.1125 55.3970 34.4216 173.6806 61 Y 4.9936 7.4940 114.8248 55.4199 40.3879 172.9064 62 P 4.7406 0.0000 0.0000 62.1687 33.0931 177.0561 63 V 4.3233 7.7905 124.3844 63.8037 30.4968 177.1397 64 T 4.4716 8.4732 110.8634 64.2756 70.6918 174.8379 65 E 4.1664 8.0352 121.0411 57.8557 30.3664 177.0287 66 E 4.5625 7.6833 115.6168 55.8316 30.0236 176.7342 67 G 4.2204 8.1879 105.8714 49.6206 0.0000 175.8714 68 R 4.2547 7.0212 120.0786 60.4832 31.4839 176.7843 69 K 3.8622 8.3587 118.3945 59.1762 31.8836 179.0698 70 V 3.6119 9.7897 118.1784 66.0701 31.4592 177.9774 71 A 4.4622 8.0962 120.0653 55.1918 18.5265 178.9823 72 E 3.9530 8.6354 118.2269 59.4185 29.6657 178.8555 73 Q 3.9976 8.6157 120.1658 59.1265 29.1129 178.4452 74 V 3.6024 7.5343 117.8746 66.1888 31.6942 177.8333 75 M 4.0064 7.8442 118.0982 58.4205 31.8388 178.7280 76 K 3.9784 8.0335 119.0327 59.3403 32.2096 178.6085 77 A 4.1060 8.1813 121.3572 55.1870 18.2814 179.9129 78 G 3.7076 8.0791 105.5514 47.3966 0.0000 176.1071 79 I 3.8559 7.7799 121.9069 64.1067 37.0369 178.2849 80 E 4.0249 8.3131 119.3599 59.5400 29.2390 179.8201 81 V 3.5124 7.4305 112.1292 64.5760 31.4116 178.8029 82 F 4.2098 7.8664 115.7152 60.5236 39.0589 177.3611 83 A 4.1907 8.8776 121.1262 54.9574 18.1426 179.4071 84 L 3.8969 8.2516 119.2594 58.2947 42.3240 179.1599 85 V 3.8641 7.6050 117.9897 65.8741 31.2663 177.6729 86 T 3.9855 8.0219 114.8598 66.6388 68.1566 175.6025 87 A 4.1983 8.4918 123.4720 55.1659 18.2186 179.3398 88 A 3.9534 7.8900 117.9073 55.0963 18.8104 179.5009 89 L 4.7542 8.1274 118.0668 57.6185 41.5850 179.6191 90 A 4.3251 8.6392 120.1326 55.0772 18.4676 178.8968 91 T 3.8426 7.7642 112.6946 64.2798 69.0303 176.5351 92 D 4.2826 8.2516 123.1982 57.3726 40.9189 178.6027 93 F 4.1254 8.1176 114.6129 59.7733 37.8477 177.4431 94 V 3.1278 5.4611 117.0846 65.7386 31.2618 178.0746 95 R 4.3227 7.7960 119.0158 58.2050 29.7118 178.7452 96 R 3.9261 7.7653 116.2973 59.4864 29.1091 178.2627 97 E 3.8750 8.3419 119.7046 59.3038 29.7043 178.8222 98 E 3.9572 8.0407 117.9959 59.3045 29.3843 178.7736 99 E 3.9463 7.9909 118.6075 59.0681 29.7429 178.4768 100 R 4.0093 8.4031 118.6840 59.4166 30.2281 178.1837 101 R 3.9956 7.5272 117.0559 58.8840 30.2151 177.3039 102 G 4.1032 8.3281 104.1942 45.0882 0.0000 173.1655 103 H 4.2552 7.5120 119.8916 56.2973 27.8540 173.8818 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 S 8.33 4.15 0.00 3.99 4.03 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 0.00 0.00 0.00 2 A 8.28 3.40 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 0.00 0.00 3 D 9.19 4.38 0.00 2.72 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 H 7.94 4.17 0.00 3.25 3.36 0.00 5.87 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 E 7.99 3.99 0.00 2.19 2.00 0.00 0.00 0.00 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 2.37 0.00 6 R 7.91 3.83 0.00 2.15 1.96 0.00 3.12 0.00 0.00 3.25 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.68 0.00 7 E 8.19 3.88 0.00 2.03 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.30 0.00 8 A 8.05 3.96 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 9 Q 8.84 4.00 0.00 2.11 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.74 0.00 0.00 0.00 0.00 0.00 2.33 2.35 0.00 10 K 8.23 3.88 0.00 1.97 1.91 0.00 1.68 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.41 1.43 7.81 11 A 7.86 3.96 1.30 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 12 E 7.83 3.75 0.00 2.04 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 2.33 2.36 0.00 13 E 7.91 3.89 0.00 2.04 2.05 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 2.29 2.30 0.00 14 E 7.83 3.97 0.00 2.08 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.29 0.00 15 L 7.49 3.92 0.00 1.56 1.71 0.89 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 16 Q 7.97 4.01 0.00 2.28 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.68 0.00 0.00 0.00 0.00 0.00 2.44 2.53 0.00 17 K 7.77 3.96 0.00 1.85 1.94 0.00 1.64 0.00 0.00 1.58 0.00 0.00 2.89 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.45 1.46 7.81 18 V 7.73 3.62 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 0.99 0.00 0.00 1.00 0.00 0.00 19 L 7.84 4.01 0.00 1.96 1.74 0.89 0.66 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 20 E 8.13 4.03 0.00 2.27 2.05 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 2.40 2.59 0.00 21 E 8.30 4.03 0.00 2.03 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 2.50 2.49 0.00 22 A 9.13 4.12 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 S 8.77 4.28 0.00 4.20 4.43 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 24 K 7.95 4.07 0.00 1.89 2.02 0.00 1.65 0.00 0.00 1.65 0.00 0.00 2.90 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.41 1.61 7.81 25 K 7.91 4.02 0.00 2.00 1.86 0.00 1.76 0.00 0.00 1.68 0.00 0.00 3.18 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.47 1.63 7.81 26 A 8.79 3.98 1.13 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 0.00 0.00 27 V 7.59 3.61 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 0.74 0.00 0.00 0.98 0.00 0.00 28 E 7.69 3.86 0.00 1.99 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 0.00 2.29 2.29 0.00 29 A 9.08 4.09 1.31 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 0.00 0.00 0.00 0.00 0.00 30 E 8.51 3.81 0.00 1.96 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 2.20 2.21 0.00 31 R 7.11 3.99 0.00 1.90 1.92 0.00 3.29 0.00 0.00 3.19 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.59 0.00 32 G 9.10 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 0.00 0.00 0.00 33 A 7.37 4.79 1.23 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 0.00 0.00 34 P 0.00 4.33 0.00 2.20 2.06 0.00 3.87 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.96 0.00 35 G 8.85 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 A 8.11 4.01 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 37 A 8.23 4.42 0.78 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 0.00 0.00 38 L 7.49 4.24 0.00 1.14 1.21 -0.32 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 39 I 7.43 4.22 1.84 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 1.42 0.76 0.84 0.00 0.00 40 S 7.71 4.34 0.00 3.99 3.89 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 41 Y 8.22 4.70 0.00 2.96 2.96 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 42 P 0.00 3.47 0.00 1.91 1.76 0.00 3.77 0.00 0.00 3.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.83 0.00 43 D 7.81 4.51 0.00 2.71 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 44 A 8.25 4.15 1.53 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 0.00 0.00 45 I 7.91 3.88 2.03 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 2.02 1.08 1.12 0.00 0.00 46 W 8.55 4.28 0.00 3.53 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 47 W 8.41 4.15 0.00 3.47 3.43 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 48 S 8.54 3.19 0.00 4.44 4.03 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 0.00 0.00 0.00 49 V 7.99 3.45 1.95 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 0.69 0.00 0.00 0.81 0.00 0.00 50 E 7.48 4.29 0.00 2.12 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 2.25 1.90 0.00 51 T 7.11 3.53 3.69 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 0.93 0.00 0.00 52 A 7.84 3.99 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.52 4.22 4.14 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 0.00 0.00 0.00 1.16 0.00 0.00 54 T 7.73 3.65 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 55 V 7.20 4.33 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 0.81 0.00 0.00 0.97 0.00 0.00 56 G 8.65 3.89 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 0.00 0.00 0.00 57 Y 8.49 3.46 0.00 3.06 3.09 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 58 G 7.72 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 59 D 7.72 4.63 0.00 3.10 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 60 R 7.78 4.92 0.00 1.84 1.68 0.00 3.27 0.00 0.00 3.20 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.74 0.00 61 Y 7.49 4.99 0.00 3.17 2.99 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.74 0.00 2.31 2.16 0.00 3.62 0.00 0.00 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.12 0.00 63 V 7.79 4.32 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 0.98 0.00 0.00 0.92 0.00 0.00 64 T 8.47 4.47 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 1.23 0.00 0.00 65 E 8.04 4.17 0.00 2.00 1.92 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 2.36 2.29 0.00 66 E 7.68 4.56 0.00 2.17 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 0.00 2.40 2.32 0.00 67 G 8.19 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 0.00 0.00 0.00 68 R 7.02 4.25 0.00 1.95 1.94 0.00 3.29 0.00 0.00 3.36 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.72 0.00 69 K 8.36 3.86 0.00 1.94 1.90 0.00 1.74 0.00 0.00 1.76 0.00 0.00 3.02 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.57 1.55 7.81 70 V 9.79 3.61 2.45 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 1.07 0.00 0.00 1.04 0.00 0.00 71 A 8.10 4.46 1.64 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 0.00 0.00 72 E 8.64 3.95 0.00 2.16 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 2.35 2.50 0.00 73 Q 8.62 4.00 0.00 2.25 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.61 0.00 0.00 0.00 0.00 0.00 2.39 2.39 0.00 74 V 7.53 3.60 2.18 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 0.98 0.00 0.00 1.08 0.00 0.00 75 M 7.84 4.01 0.00 2.09 2.27 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.81 2.67 0.00 76 K 8.03 3.98 0.00 1.88 1.82 0.00 1.66 0.00 0.00 1.67 0.00 0.00 2.97 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.45 1.47 7.81 77 A 8.18 4.11 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 78 G 8.08 3.71 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 0.00 0.00 0.00 79 I 7.78 3.86 2.06 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 1.55 1.07 0.94 0.00 0.00 80 E 8.31 4.02 0.00 2.16 1.99 0.00 0.00 0.00 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 2.56 0.00 81 V 7.43 3.51 1.76 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 0.84 0.00 0.00 0.68 0.00 0.00 82 F 7.87 4.21 0.00 3.26 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 A 8.88 4.19 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.25 3.90 0.00 1.81 1.83 0.91 1.13 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 85 V 7.60 3.86 2.33 0.00 0.00 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 1.04 0.00 0.00 86 T 8.02 3.99 4.34 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 1.25 0.00 0.00 87 A 8.49 4.20 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 88 A 7.89 3.95 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 89 L 8.13 4.75 0.00 1.91 1.76 0.96 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 90 A 8.64 4.33 1.46 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 91 T 7.76 3.84 4.16 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 1.04 0.00 0.00 92 D 8.25 4.28 0.00 2.79 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 93 F 8.12 4.13 0.00 3.31 3.36 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 94 V 5.46 3.13 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 0.79 0.00 0.00 -0.26 0.00 0.00 95 R 7.80 4.32 0.00 1.94 1.93 0.00 3.13 0.00 0.00 3.25 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.55 0.00 96 R 7.77 3.93 0.00 2.09 2.37 0.00 2.87 0.00 0.00 3.42 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.71 0.00 97 E 8.34 3.88 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 2.29 2.36 0.00 98 E 8.04 3.96 0.00 2.20 1.95 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 2.37 2.39 0.00 99 E 7.99 3.95 0.00 1.96 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 0.00 2.32 2.31 0.00 100 R 8.40 4.01 0.00 1.88 2.11 0.00 3.47 0.00 0.00 3.15 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.78 0.00 101 R 7.53 4.00 0.00 1.78 1.93 0.00 3.27 0.00 0.00 3.13 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 1.54 0.00 102 G 8.33 4.10 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 0.00 0.00 0.00 103 H 7.51 4.26 0.00 3.22 3.22 0.00 5.56 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