NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 S 4.4179 8.3349 116.7936 58.3127 64.9305 173.9728 2 S 4.4055 7.9571 115.3086 57.4944 62.9561 172.6117 3 L 3.9003 8.5770 121.9016 55.2861 42.6639 176.7400 4 I 3.9529 8.1736 123.5186 60.8817 36.3912 175.2287 5 L 4.0823 7.7620 128.0558 55.8823 42.0293 176.5178 6 L 4.1920 7.7646 130.6396 55.5829 42.3639 177.2145 7 S 4.0664 8.8400 120.0760 58.7641 61.0871 175.7191 8 A 4.0972 5.8000 117.8739 52.8564 19.7341 178.1130 9 S 4.6016 8.5968 114.1556 60.0788 67.0419 176.0219 10 D 4.7075 8.2266 118.9541 55.9938 40.6711 177.5062 11 L 4.2611 7.8693 118.0063 56.7320 42.1097 177.2657 12 A 4.3944 8.1757 121.4740 52.3550 18.3384 178.4047 13 G 3.8167 7.7410 105.2354 45.1143 0.0000 171.7528 14 Q 5.0104 8.0502 118.7194 54.1986 32.3860 174.8840 15 W 5.4612 8.7804 120.9671 55.8125 34.7707 173.5191 16 T 5.1628 8.6443 109.2590 60.4311 72.4210 172.4660 17 L 5.2614 8.6081 123.5176 52.5310 45.7404 174.9767 18 Q 4.2459 8.3431 124.2973 54.4581 32.2292 173.3207 19 Q 4.4312 7.8770 128.7249 54.3931 30.0113 174.8487 20 D 4.5009 8.5859 127.2158 53.8959 42.9422 175.7637 21 E 3.7593 8.9677 117.3305 56.8389 28.5393 174.8976 22 A 4.5066 7.9400 118.7836 50.6563 20.3322 171.5251 23 P 4.1032 0.0000 0.0000 63.5980 31.4279 175.9541 24 A 4.3825 7.9798 120.1015 51.3225 22.1419 174.8048 25 I 5.0137 8.7636 122.8994 59.8182 41.3798 175.4572 26 C 5.0329 8.4811 121.0848 55.8025 43.2257 173.3007 27 H 4.8070 9.1044 121.4591 55.7424 29.7706 174.3777 28 L 5.0500 9.0114 122.6000 52.8916 45.9726 175.4971 29 E 4.6510 8.4091 119.4827 54.6431 32.8604 175.3800 30 L 4.0579 7.9309 123.3137 53.4933 41.5153 177.4206 31 R 4.4298 8.4860 122.3886 55.8067 31.0131 176.6557 32 D 5.0188 8.6359 118.9456 53.3721 40.1821 176.5712 33 S 4.6561 7.9917 116.2582 58.6846 64.2923 173.0469 34 E 4.0472 8.5192 120.3607 55.6060 31.2377 176.1765 35 V 4.1875 8.2867 121.2838 61.4017 33.9426 175.7938 36 A 3.9772 8.6412 132.0038 54.3982 19.0317 178.6705 37 E 3.8338 8.3346 115.8078 58.6235 29.6030 177.1497 38 A 4.5109 7.6244 117.1896 50.7402 20.3888 175.1418 39 S 3.7069 7.6941 109.5284 58.3016 61.8900 171.2416 40 G 3.6937 7.8941 109.2951 46.0296 0.0000 172.4156 41 Y 5.4282 8.3856 119.7213 54.7452 41.7261 175.3645 42 D 4.9640 8.8302 121.1881 54.8619 43.0218 174.8233 43 L 4.8586 8.7077 124.0464 53.2665 42.2532 176.2046 44 G 3.8492 8.4378 112.5417 44.9657 0.0000 169.7420 45 G 3.9716 8.6905 105.8946 44.2594 0.0000 172.9157 46 D 4.5350 7.6509 117.8663 53.7811 39.8294 176.3051 47 T 4.2490 8.1410 115.9419 61.9448 70.2237 177.2768 48 A 3.8991 7.9695 125.9223 55.5214 18.4291 179.7372 49 C 4.0254 8.0284 112.9199 58.3424 41.1157 173.8631 50 L 3.5391 7.5056 118.4766 56.1980 41.7039 178.2224 51 T 3.9317 8.0991 108.1974 62.6838 68.2903 174.7005 52 R 4.4071 7.1121 117.1549 55.8519 30.9816 176.2290 53 W 5.0045 8.0095 116.6126 56.3318 30.7771 175.1068 54 L 4.9683 7.5195 117.0724 52.1870 45.0079 174.7007 55 P 4.4710 0.0000 0.0000 64.5220 31.9115 175.9726 56 S 4.4995 7.3977 111.7510 56.5770 65.2267 172.7243 57 E 4.0339 8.5844 126.0711 54.8921 29.4214 174.6723 58 P 4.9068 0.0000 0.0000 62.7729 31.5748 176.1962 59 R 4.6029 8.5757 121.2236 56.2827 31.2202 175.4964 60 A 5.1805 7.7007 120.1195 50.9047 23.1643 174.8048 61 W 5.5260 9.3640 115.5328 55.1834 32.0650 174.4456 62 R 4.6059 9.1980 121.4118 53.7196 32.3033 172.5378 63 P 4.6916 0.0000 0.0000 63.1293 31.8722 176.4741 64 T 4.5964 8.9672 115.6237 59.1968 70.7831 174.1660 65 P 4.6327 0.0000 0.0000 62.8958 30.5155 176.6579 66 A 4.3642 7.8522 118.0437 51.2955 21.1155 177.2767 67 G 4.4688 7.3622 107.5337 46.0073 0.0000 171.9735 68 I 4.8553 8.4787 120.7157 59.5617 39.6680 175.2343 69 A 5.2617 8.4674 125.7977 50.2044 22.4307 174.8547 70 L 5.0690 8.6752 120.8191 53.1365 44.4731 176.0607 71 L 5.2869 9.1704 123.3251 52.6466 45.5030 176.5258 72 E 4.5215 7.9419 112.3640 56.2205 29.5615 175.9706 73 R 3.9446 9.2729 116.5729 57.5840 27.6936 176.8884 74 G 4.0836 8.1921 100.8743 44.9280 0.0000 174.5804 75 G 3.8487 8.4476 108.0760 44.9595 0.0000 173.8590 76 L 4.2501 7.6015 120.0881 53.5968 40.7720 176.0341 77 T 4.2748 8.3257 120.8139 64.0932 68.9557 174.4677 78 L 4.4395 9.4092 127.6888 57.0973 42.9795 177.0217 79 M 4.7019 7.7993 116.2885 54.2109 35.9312 173.5027 80 L 4.9048 8.4925 127.7052 53.4086 43.2806 175.3083 81 L 4.2924 9.5178 129.2479 54.3233 42.9653 176.5101 82 G 4.2561 8.4292 110.7621 44.6668 0.0000 173.0344 83 R 3.5566 8.6822 125.2853 56.1702 30.2928 175.6896 84 Q 4.1785 8.5792 127.4847 57.4054 30.0763 176.0627 85 G 3.7529 7.8263 103.2369 45.3160 0.0000 171.9054 86 E 3.9253 8.2102 124.5764 58.6674 27.8841 176.5603 87 G 4.2632 10.0644 113.3898 45.2529 0.0000 171.3595 88 D 4.6414 8.7369 120.6086 53.3375 43.4914 173.2097 89 Y 5.2268 8.8766 122.6237 56.2676 40.8010 175.3713 90 R 5.2325 9.0832 120.7652 53.7775 34.3249 174.4824 91 V 4.7212 8.1230 119.7761 60.1941 35.2263 173.7400 92 Q 4.6544 8.6870 121.3630 54.6548 29.8441 175.0739 93 K 4.6331 7.9926 117.5661 54.2781 35.9829 176.8451 94 G 3.9739 8.3248 108.7202 46.6321 0.0000 173.0684 95 D 4.8399 9.2102 119.5748 53.4047 41.2921 174.5981 96 G 3.8871 8.8571 106.0034 46.0405 0.0000 173.3549 97 G 4.0648 7.6880 105.8445 44.1261 0.0000 172.4787 98 Q 4.7736 8.7878 126.4830 54.3910 30.8038 174.4785 99 L 4.9373 7.7784 127.0040 53.2561 43.8630 176.3644 100 V 4.5873 7.9863 121.1320 61.5017 34.6087 173.4070 101 L 5.2917 8.5220 131.3395 53.0777 43.1269 175.1655 102 R 5.3524 8.5994 126.2549 54.1449 33.8506 173.9860 103 R 2.5100 8.2244 121.3427 56.0947 29.4636 174.9757 104 A 3.8447 7.8856 125.6975 52.6678 17.8678 177.3528 105 T 3.8300 8.4007 118.2970 66.5254 69.0364 173.5008 106 P 4.4135 0.0000 0.0000 62.8257 31.6535 175.5432 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 4.42 0.00 3.87 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 2 S 7.96 4.41 0.00 3.93 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 L 8.58 3.90 0.00 1.59 1.61 0.91 0.86 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 4 I 8.17 3.95 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.47 0.92 0.00 0.00 5 L 7.76 4.08 0.00 1.61 1.67 0.93 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 6 L 7.76 4.19 0.00 1.66 1.73 0.94 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 7 S 8.84 4.07 0.00 3.87 3.73 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 8 A 5.80 4.10 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 S 8.60 4.60 0.00 3.98 4.07 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.23 4.71 0.00 2.73 2.85 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 11 L 7.87 4.26 0.00 1.73 1.83 0.86 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 12 A 8.18 4.39 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 13 G 7.74 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 14 Q 8.05 5.01 0.00 1.89 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.96 6.67 0.00 0.00 0.00 0.00 0.00 2.35 2.36 0.00 15 W 8.78 5.46 0.00 3.09 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 16 T 8.64 5.16 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 1.12 0.00 0.00 17 L 8.61 5.26 0.00 1.93 1.64 0.93 0.78 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 18 Q 8.34 4.25 0.00 2.08 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.65 0.00 0.00 0.00 0.00 0.00 2.27 2.31 0.00 19 Q 7.88 4.43 0.00 1.21 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.59 6.63 0.00 0.00 0.00 0.00 0.00 1.20 1.88 0.00 20 D 8.59 4.50 0.00 2.72 2.49 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 0.00 0.00 0.00 0.00 21 E 8.97 3.76 0.00 2.08 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 2.19 2.35 0.00 22 A 7.94 4.51 1.29 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 0.00 0.00 0.00 0.00 0.00 0.00 23 P 0.00 4.10 0.00 2.08 2.11 0.00 3.75 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.13 0.00 24 A 7.98 4.38 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 25 I 8.76 5.01 1.92 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.26 0.97 0.00 0.00 26 C 8.48 5.03 0.00 3.18 3.01 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 0.00 0.00 0.00 27 H 9.10 4.81 0.00 3.12 3.27 0.00 5.57 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 L 9.01 5.05 0.00 1.52 1.45 0.85 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 29 E 8.41 4.65 0.00 1.93 1.84 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 2.25 2.29 0.00 30 L 7.93 4.06 0.00 1.13 1.27 0.13 -0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 31 R 8.49 4.43 0.00 2.14 2.06 0.00 3.19 0.00 0.00 3.60 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.67 0.00 32 D 8.64 5.02 0.00 2.85 2.82 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 33 S 7.99 4.66 0.00 3.87 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 34 E 8.52 4.05 0.00 1.75 1.74 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 2.19 2.22 0.00 35 V 8.29 4.19 1.97 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 1.00 0.00 0.00 0.89 0.00 0.00 36 A 8.64 3.98 1.24 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 0.00 0.00 37 E 8.33 3.83 0.00 1.89 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 0.00 2.28 2.46 0.00 38 A 7.62 4.51 1.22 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 39 S 7.69 3.71 0.00 3.89 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 40 G 7.89 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 0.00 0.00 0.00 0.00 41 Y 8.39 5.43 0.00 1.85 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.83 4.96 0.00 2.81 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 43 L 8.71 4.86 0.00 1.81 1.64 0.67 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 44 G 8.44 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 45 G 8.69 3.97 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 0.00 0.00 0.00 46 D 7.65 4.53 0.00 2.74 2.63 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 47 T 8.14 4.25 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 1.34 0.00 0.00 48 A 7.97 3.90 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 49 C 8.03 4.03 0.00 2.76 3.01 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 0.00 0.00 0.00 50 L 7.51 3.54 0.00 1.79 1.71 0.97 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 51 T 8.10 3.93 4.15 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 1.17 0.00 0.00 52 R 7.11 4.41 0.00 1.72 1.83 0.00 2.42 0.00 0.00 3.02 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.50 0.00 53 W 8.01 5.00 0.00 3.44 3.07 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.52 4.97 0.00 1.71 1.54 0.99 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 55 P 0.00 4.47 0.00 2.19 2.18 0.00 3.80 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.97 0.00 56 S 7.40 4.50 0.00 3.80 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 57 E 8.58 4.03 0.00 1.94 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 0.00 2.28 2.36 0.00 58 P 0.00 4.91 0.00 2.27 2.15 0.00 3.41 0.00 0.00 4.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.98 0.00 59 R 8.58 4.60 0.00 1.74 2.04 0.00 3.41 0.00 0.00 3.27 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.58 0.00 60 A 7.70 5.18 1.28 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 0.00 0.00 0.00 61 W 9.36 5.53 0.00 3.59 3.06 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 62 R 9.20 4.61 0.00 1.76 1.79 0.00 3.22 0.00 0.00 3.13 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.53 0.00 63 P 0.00 4.69 0.00 1.90 1.97 0.00 3.54 0.00 0.00 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.50 0.00 64 T 8.97 4.60 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 1.23 0.00 0.00 65 P 0.00 4.63 0.00 2.21 2.19 0.00 3.81 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.97 0.00 66 A 7.85 4.36 1.24 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 0.00 0.00 67 G 7.36 4.47 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 0.00 0.00 0.00 68 I 8.48 4.86 1.73 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.50 1.01 0.00 0.00 69 A 8.47 5.26 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 70 L 8.68 5.07 0.00 1.67 1.63 0.95 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 71 L 9.17 5.29 0.00 1.56 1.57 0.94 0.67 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 72 E 7.94 4.52 0.00 2.12 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 2.39 2.21 0.00 73 R 9.27 3.94 0.00 2.00 2.13 0.00 3.24 0.00 0.00 3.23 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.62 0.00 74 G 8.19 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 0.00 0.00 0.00 75 G 8.45 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 76 L 7.60 4.25 0.00 1.85 1.70 0.92 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 77 T 8.33 4.27 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 1.28 0.00 0.00 78 L 9.41 4.44 0.00 1.46 1.75 0.99 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 79 M 7.80 4.70 0.00 2.14 1.89 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.63 0.00 80 L 8.49 4.90 0.00 1.69 1.60 1.03 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 81 L 9.52 4.29 0.00 1.72 1.64 0.93 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 82 G 8.43 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 0.00 0.00 0.00 0.00 83 R 8.68 3.56 0.00 1.64 1.74 0.00 3.23 0.00 0.00 3.06 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 1.01 0.00 84 Q 8.58 4.18 0.00 1.93 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.37 0.00 0.00 0.00 0.00 0.00 2.28 2.42 0.00 85 G 7.83 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 86 E 8.21 3.93 0.00 2.14 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 2.26 2.32 0.00 87 G 10.06 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 0.00 0.00 0.00 0.00 88 D 8.74 4.64 0.00 2.73 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 89 Y 8.88 5.23 0.00 2.97 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 90 R 9.08 5.23 0.00 1.72 1.74 0.00 3.08 0.00 0.00 3.30 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.40 0.00 91 V 8.12 4.72 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 0.82 0.00 0.00 0.99 0.00 0.00 92 Q 8.69 4.65 0.00 2.17 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.82 0.00 0.00 0.00 0.00 0.00 2.27 2.33 0.00 93 K 7.99 4.63 0.00 1.97 1.91 0.00 1.37 0.00 0.00 1.57 0.00 0.00 2.90 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.30 1.37 7.81 94 G 8.32 3.97 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 0.00 0.00 0.00 95 D 9.21 4.84 0.00 2.86 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 G 8.86 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 97 G 7.69 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 98 Q 8.79 4.77 0.00 2.08 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.80 0.00 0.00 0.00 0.00 0.00 2.22 2.27 0.00 99 L 7.78 4.94 0.00 1.73 1.33 0.91 0.02 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 0.00 100 V 7.99 4.59 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 1.00 0.00 0.00 0.94 0.00 0.00 101 L 8.52 5.29 0.00 1.64 1.47 0.64 -0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 102 R 8.60 5.35 0.00 1.97 1.73 0.00 3.29 0.00 0.00 3.39 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.88 0.00 103 R 8.22 2.51 0.00 1.17 0.66 0.00 2.76 0.00 0.00 3.09 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 1.28 0.00 104 A 7.89 3.84 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 0.00 0.00 0.00 0.00 0.00 105 T 8.40 3.83 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 1.13 0.00 0.00 106 P 0.00 4.41 0.00 2.16 2.00 0.00 3.67 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.93 0.00