NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9634 8.3544 109.7369 45.5376 0.0000 172.9719 2 S 4.5040 8.2801 115.0093 54.7850 65.5778 171.1015 3 S 4.4486 9.2952 120.6775 61.2173 67.2474 174.0320 4 G 3.8924 7.8125 108.5953 45.6710 0.0000 174.0079 5 S 4.6454 7.8675 112.4358 56.4818 64.6378 172.7751 6 S 4.3738 8.8719 122.3626 60.6310 63.0302 173.1759 7 G 4.1899 8.6301 106.7216 45.2875 0.0000 173.2983 8 S 4.5885 7.5821 115.8470 56.3020 64.0378 174.1863 9 S 4.4924 8.3597 121.4346 58.8514 63.7312 174.2794 10 H 5.0448 8.3245 117.1650 53.5365 33.5079 174.2093 11 L 2.6051 8.8357 127.8314 57.7163 41.8354 179.1262 12 W 4.4493 8.4183 116.0351 60.0408 27.6378 177.9171 13 E 2.6490 6.6859 118.3714 58.4156 29.0734 178.6265 14 F 4.0030 7.7571 120.8543 61.3531 39.3324 177.5108 15 V 3.2851 7.8888 117.6297 64.6286 31.2707 178.0392 16 R 3.7357 7.5942 119.2444 59.1903 29.9301 177.7260 17 D 4.2249 8.1882 118.1881 57.5344 40.8203 178.3200 18 L 3.8279 7.1393 117.9674 57.7544 41.5887 179.2535 19 L 3.9740 7.5868 118.1112 56.8678 41.5756 178.4271 20 L 4.7806 7.6318 115.7622 54.1156 43.5511 177.0717 21 S 4.6459 7.6519 116.3862 55.6486 62.9560 172.6825 22 P 4.4425 0.0000 0.0000 64.1471 31.7632 178.1242 23 E 4.1274 8.0873 119.5548 58.2267 30.0466 176.7408 24 E 4.3444 8.0552 116.6818 57.6373 30.7753 176.0730 25 N 4.4437 8.0278 117.3317 53.3363 39.3699 174.4577 26 C 4.5395 8.4417 126.3027 58.2643 31.5264 173.1398 27 G 4.0612 8.1371 118.4199 46.3352 0.0000 171.3249 28 I 4.3020 8.1700 119.3426 61.7623 39.7485 176.8664 29 L 5.3380 7.6816 118.9901 53.1489 46.1967 175.6212 30 E 4.6816 8.9103 117.9319 54.7903 34.2935 175.5791 31 W 5.0116 8.8709 123.4460 56.1081 28.3962 175.8769 32 E 4.3226 9.1668 125.5513 59.0737 30.2472 177.2404 33 D 4.4301 8.8736 119.6637 53.7197 44.4417 176.8465 34 R 3.2743 8.7658 125.4266 59.0828 30.6125 177.7090 35 E 4.2084 8.2333 116.1625 59.7306 29.6874 178.3285 36 Q 4.2393 8.1440 116.0442 57.2984 28.9925 177.3198 37 G 3.2918 8.8754 105.9880 45.0936 0.0000 172.3147 38 I 4.5947 7.8962 120.4900 60.5013 38.6446 175.0093 39 F 5.3919 9.5002 120.9083 55.1796 41.8302 173.3943 40 R 4.7073 8.9664 120.1353 54.7115 33.1419 175.1020 41 V 4.5994 8.4622 125.8830 60.9789 29.3208 175.0521 42 V 3.6487 8.1821 124.4327 64.9912 32.3596 176.0763 43 K 4.4080 8.0159 123.0822 54.0890 31.6509 176.7409 44 S 3.6359 7.9879 119.6522 60.4182 62.9474 176.2880 45 E 3.8745 7.8897 122.0096 59.3200 29.5609 178.6627 46 A 4.0725 7.8752 120.2366 54.6758 18.4347 179.1241 47 L 4.0159 8.0568 118.9284 58.4276 42.1338 179.2002 48 A 4.1192 7.6927 120.0125 55.2586 18.2701 179.3532 49 K 3.8281 8.0614 117.1373 60.3509 31.9681 179.3321 50 M 4.2438 8.1271 117.1987 57.9423 32.1300 178.2061 51 W 3.7014 8.1551 128.7084 60.2649 30.7885 177.8120 52 G 3.5230 8.2184 105.8601 48.2531 0.0000 175.1143 53 Q 3.9675 7.4933 119.2739 58.9968 28.4589 179.9857 54 R 3.8868 7.6986 118.2935 58.0999 29.3060 177.5817 55 K 4.0110 7.4437 116.2967 55.0638 32.3078 176.7051 56 K 3.8928 7.0195 116.0142 57.4865 30.1483 176.0086 57 N 4.6214 6.8508 119.8553 51.2268 37.3293 174.4987 58 D 4.3309 8.2598 122.4792 55.4992 39.5679 178.2144 59 R 4.4996 7.8109 117.8082 56.1493 30.4576 175.6452 60 M 4.3374 7.9748 118.6056 55.1705 33.1668 175.2154 61 T 4.7010 8.2717 118.3065 59.6697 70.9238 173.1600 62 Y 4.3947 9.0100 127.0747 61.4091 38.4613 178.4961 63 E 3.8791 8.3551 117.4088 59.6020 29.7903 179.5677 64 K 4.0891 8.4676 118.3868 59.2175 32.3956 178.7639 65 L 3.9542 8.0646 120.4177 58.5821 41.8605 178.7626 66 S 3.9374 8.2589 114.3390 61.7102 62.0989 176.5618 67 R 3.8622 8.0073 119.3289 59.3330 28.7479 178.2049 68 A 3.9460 8.3812 120.9801 54.0766 18.5042 179.5188 69 L 4.0768 8.1062 117.4193 57.5875 41.4885 179.1067 70 R 3.9189 7.7461 116.7319 57.6760 30.1078 177.3610 71 Y 3.8463 7.2888 117.4612 59.4180 38.9024 176.5579 72 Y 4.4329 7.4596 117.1944 60.9952 37.7593 177.2210 73 Y 4.7167 6.8904 116.8034 60.7494 37.9058 178.3379 74 K 4.1176 7.4512 118.2529 59.2229 32.2518 178.8333 75 T 4.2051 7.6981 108.1365 62.4176 69.7247 175.6250 76 G 4.0936 9.2335 110.5845 45.0147 0.0000 175.2097 77 I 3.4169 7.4842 120.4090 63.7718 37.9252 175.7598 78 L 5.2956 7.9309 118.1963 52.8313 43.9148 175.8085 79 E 4.7753 9.3763 119.4093 54.3087 32.5787 176.1715 80 R 3.3550 8.2821 125.2640 56.0930 30.6417 175.6200 81 V 4.3903 7.7218 123.4229 61.3069 34.3954 174.1736 82 D 4.7679 8.3270 122.5225 54.7270 41.2516 176.1446 83 R 4.6065 7.5684 117.5321 54.2721 33.5923 174.5239 84 R 4.3759 8.3224 118.4828 56.0905 31.2463 175.5379 85 L 3.8682 8.5544 124.5644 55.8943 39.4784 173.7751 86 V 4.6290 7.5943 116.9957 61.4815 33.8079 173.8869 87 Y 4.5857 8.0821 124.8448 56.0869 42.1349 174.7073 88 K 4.9895 8.0302 119.1562 55.1029 36.0861 175.0330 89 F 4.5523 8.2017 127.1154 57.4990 39.0473 177.0294 90 G 4.5692 9.0279 114.8649 45.9082 0.0000 173.6739 91 K 4.5580 8.8676 118.7070 58.3808 33.8501 177.9279 92 N 4.3046 8.2315 116.2978 55.9004 38.6480 175.4385 93 A 3.3051 7.5242 119.4213 51.7360 19.0627 175.3530 94 H 4.7694 7.9215 114.2368 54.3223 32.1282 172.3013 95 G 4.4179 9.0325 110.0297 45.6561 0.0000 175.1093 96 W 4.3530 7.8372 115.5249 58.7480 28.6474 176.8902 97 Q 2.5998 6.1168 116.0827 55.3518 28.4766 175.1080 98 E 4.4503 7.4409 118.7938 54.7339 32.9968 174.7382 99 D 4.0979 8.3663 123.6139 54.1880 40.0627 174.0802 100 K 4.2581 8.2255 118.6470 54.8399 31.5945 175.5440 101 L 4.6015 8.1567 123.1858 53.0583 43.4396 175.3740 102 S 4.3787 9.2566 116.2758 60.3327 63.3125 173.4073 103 G 4.2073 7.9078 103.8944 42.2562 0.0000 172.5506 104 P 4.3234 0.0000 0.0000 64.2800 31.6122 176.6035 105 S 4.7440 7.0469 114.0037 56.8042 64.7687 173.9252 106 S 4.2074 8.7835 115.9530 58.6950 64.7124 174.5215 107 G 4.3484 8.8512 116.1048 46.1215 0.0000 172.6028 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 G 8.35 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 2 S 8.28 4.50 0.00 3.85 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 3 S 9.30 4.45 0.00 3.95 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 4 G 7.81 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 5 S 7.87 4.65 0.00 3.82 3.76 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 6 S 8.87 4.37 0.00 3.90 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 7 G 8.63 4.19 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 0.00 0.00 0.00 8 S 7.58 4.59 0.00 3.96 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 9 S 8.36 4.49 0.00 3.89 3.94 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 10 H 8.32 5.04 0.00 2.92 3.47 0.00 5.63 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 L 8.84 2.61 0.00 0.86 1.66 -0.18 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 12 W 8.42 4.45 0.00 3.51 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 13 E 6.69 2.65 0.00 1.48 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 1.47 1.47 0.00 14 F 7.76 4.00 0.00 3.29 2.90 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.89 3.29 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 0.87 0.00 0.00 0.85 0.00 0.00 16 R 7.59 3.74 0.00 1.43 1.80 0.00 3.11 0.00 0.00 3.01 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.82 0.00 17 D 8.19 4.22 0.00 2.68 2.55 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 18 L 7.14 3.83 0.00 1.56 1.49 0.10 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 19 L 7.59 3.97 0.00 1.66 1.43 -0.27 -0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 20 L 7.63 4.78 0.00 1.63 1.76 0.97 1.11 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 21 S 7.65 4.65 0.00 3.98 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 22 P 0.00 4.44 0.00 2.19 2.21 0.00 3.81 0.00 0.00 3.61 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 23 E 8.09 4.13 0.00 1.95 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 2.29 2.27 0.00 24 E 8.06 4.34 0.00 1.96 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 2.24 2.21 0.00 25 N 8.03 4.44 0.00 2.60 2.85 0.00 0.00 7.08 6.97 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 26 C 8.44 4.54 0.00 2.93 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 G 8.14 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 28 I 8.17 4.30 1.92 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 1.23 0.79 0.95 0.00 0.00 29 L 7.68 5.34 0.00 1.33 1.58 0.77 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 30 E 8.91 4.68 0.00 1.88 1.81 0.00 0.00 0.00 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 2.28 0.00 31 W 8.87 5.01 0.00 3.26 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 32 E 9.17 4.32 0.00 2.01 2.08 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 2.38 2.30 0.00 33 D 8.87 4.43 0.00 2.75 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 34 R 8.77 3.27 0.00 1.48 1.79 0.00 2.21 0.00 0.00 2.25 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.34 0.00 35 E 8.23 4.21 0.00 2.03 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 2.33 2.40 0.00 36 Q 8.14 4.24 0.00 2.13 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.32 0.00 0.00 0.00 0.00 0.00 2.44 2.43 0.00 37 G 8.88 3.29 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 0.00 38 I 7.90 4.59 2.16 0.00 0.00 0.90 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 0.62 0.92 0.00 0.00 39 F 9.50 5.39 0.00 2.71 2.47 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 40 R 8.97 4.71 0.00 1.92 1.76 0.00 3.05 0.00 0.00 3.08 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.61 0.00 41 V 8.46 4.60 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 0.59 0.00 0.00 0.87 0.00 0.00 42 V 8.18 3.65 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 0.90 0.00 0.00 0.92 0.00 0.00 43 K 8.02 4.41 0.00 1.81 1.67 0.00 1.79 0.00 0.00 1.69 0.00 0.00 2.95 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.32 1.38 7.81 44 S 7.99 3.64 0.00 2.72 3.50 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 45 E 7.89 3.87 0.00 1.97 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 2.34 2.29 0.00 46 A 7.88 4.07 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 47 L 8.06 4.02 0.00 1.87 1.88 1.16 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 48 A 7.69 4.12 1.50 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 0.00 0.00 49 K 8.06 3.83 0.00 2.07 1.95 0.00 1.76 0.00 0.00 1.67 0.00 0.00 2.95 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.49 1.54 7.81 50 M 8.13 4.24 0.00 2.44 2.57 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.76 2.79 0.00 51 W 8.16 3.70 0.00 2.95 3.11 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 52 G 8.22 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 7.49 3.97 0.00 2.28 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.75 0.00 0.00 0.00 0.00 0.00 2.34 2.57 0.00 54 R 7.70 3.89 0.00 1.05 1.82 0.00 3.29 0.00 0.00 3.46 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.85 0.00 55 K 7.44 4.01 0.00 1.08 1.43 0.00 1.71 0.00 0.00 1.43 0.00 0.00 2.79 0.00 0.00 2.86 0.00 0.00 0.00 0.00 0.38 0.21 7.81 56 K 7.02 3.89 0.00 1.80 1.78 0.00 1.60 0.00 0.00 1.57 0.00 0.00 2.92 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.30 1.26 7.81 57 N 6.85 4.62 0.00 2.72 2.49 0.00 0.00 6.90 8.33 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 58 D 8.26 4.33 0.00 2.79 2.77 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.81 4.50 0.00 1.89 1.96 0.00 3.14 0.00 0.00 3.14 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.53 0.00 60 M 7.97 4.34 0.00 1.91 1.89 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.78 2.63 0.00 61 T 8.27 4.70 4.29 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 1.25 0.00 0.00 62 Y 9.01 4.39 0.00 3.19 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 63 E 8.36 3.88 0.00 2.00 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 2.37 2.53 0.00 64 K 8.47 4.09 0.00 1.93 1.86 0.00 1.69 0.00 0.00 1.72 0.00 0.00 2.97 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.46 1.45 7.81 65 L 8.06 3.95 0.00 1.84 1.87 0.75 0.81 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 66 S 8.26 3.94 0.00 3.82 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 67 R 8.01 3.86 0.00 1.99 2.34 0.00 2.71 0.00 0.00 3.20 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.59 0.00 68 A 8.38 3.95 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 69 L 8.11 4.08 0.00 1.71 1.86 0.42 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 70 R 7.75 3.92 0.00 1.84 2.07 0.00 3.44 0.00 0.00 3.53 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.65 0.00 71 Y 7.29 3.85 0.00 3.03 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 72 Y 7.46 4.43 0.00 2.81 2.91 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 73 Y 6.89 4.72 0.00 2.79 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 74 K 7.45 4.12 0.00 1.38 1.68 0.00 1.43 0.00 0.00 1.63 0.00 0.00 3.05 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.36 1.17 7.81 75 T 7.70 4.21 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 1.19 0.00 0.00 76 G 9.23 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 0.00 0.00 0.00 77 I 7.48 3.42 1.60 0.00 0.00 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.91 -0.24 0.00 0.00 78 L 7.93 5.30 0.00 1.49 1.73 1.09 0.76 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 79 E 9.38 4.78 0.00 2.08 1.82 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 2.28 2.43 0.00 80 R 8.28 3.36 0.00 0.74 1.40 0.00 2.47 0.00 0.00 2.74 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.93 0.00 81 V 7.72 4.39 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 0.78 0.00 0.00 0.89 0.00 0.00 82 D 8.33 4.77 0.00 2.63 2.59 0.00 0.00 0.00 0.00 0.00 0.00 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 7.57 4.61 0.00 1.64 1.75 0.00 3.12 0.00 0.00 3.10 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.51 0.00 84 R 8.32 4.38 0.00 1.73 1.79 0.00 3.39 0.00 0.00 3.22 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.63 0.00 85 L 8.55 3.87 0.00 1.93 1.71 1.03 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 86 V 7.59 4.63 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 0.72 0.00 0.00 0.95 0.00 0.00 87 Y 8.08 4.59 0.00 1.80 2.61 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.03 4.99 0.00 1.75 1.57 0.00 1.64 0.00 0.00 1.67 0.00 0.00 2.99 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.30 1.47 7.81 89 F 8.20 4.55 0.00 1.93 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 90 G 9.03 4.57 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 91 K 8.87 4.56 0.00 1.90 2.02 0.00 1.62 0.00 0.00 1.75 0.00 0.00 2.98 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.39 1.46 7.81 92 N 8.23 4.30 0.00 2.60 2.76 0.00 0.00 6.88 7.34 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 93 A 7.52 3.31 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 H 7.92 4.77 0.00 3.15 3.22 0.00 5.71 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 G 9.03 4.42 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 0.00 96 W 7.84 4.35 0.00 3.61 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 97 Q 6.12 2.60 0.00 1.15 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.97 6.87 0.00 0.00 0.00 0.00 0.00 1.57 1.16 0.00 98 E 7.44 4.45 0.00 1.77 1.68 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 2.11 2.22 0.00 99 D 8.37 4.10 0.00 2.76 2.60 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.23 4.26 0.00 1.66 1.73 0.00 1.53 0.00 0.00 1.67 0.00 0.00 3.07 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.31 1.44 7.81 101 L 8.16 4.60 0.00 1.55 1.55 0.90 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 102 S 9.26 4.38 0.00 3.77 3.81 0.00 0.00 0.00 0.00 0.00 0.00 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 G 7.91 4.21 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 0.00 104 P 0.00 4.32 0.00 2.19 2.19 0.00 3.74 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.95 0.00 105 S 7.05 4.74 0.00 4.16 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 0.00 106 S 8.78 4.21 0.00 3.80 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 0.00 107 G 8.85 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 0.00 0.00 0.00