NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 6 L 4.2767 8.1844 120.6270 54.2193 43.0235 176.2154 7 S 4.1732 8.6504 118.4060 55.6007 62.9305 171.6824 8 P 4.4087 0.0000 0.0000 63.4491 33.2736 174.3419 9 L 5.0025 7.0788 123.1623 53.4123 44.0159 175.3418 10 S 4.8841 9.1318 120.3022 57.2324 67.2607 172.0179 11 T 4.8370 8.1255 113.3295 61.8044 70.8478 172.0459 12 H 4.9041 8.4817 120.7592 55.3961 33.3663 171.9818 13 V 4.5764 8.8628 126.9574 61.0219 33.6843 173.8953 14 L 4.7280 8.3442 129.8183 53.1121 44.9903 174.7220 15 N 5.0720 9.2726 126.0687 52.8189 38.7107 175.1852 16 A 4.1656 9.3519 129.7438 54.4323 18.5212 178.5423 17 A 4.2235 8.6221 117.7114 54.3400 18.7928 178.0108 18 Q 4.5408 8.1356 111.6994 54.8322 30.4043 176.1082 19 G 3.9971 8.4758 105.7781 46.4813 0.0000 173.7270 20 V 4.6452 7.3527 110.7180 58.0348 36.1363 173.4238 21 P 4.4785 0.0000 0.0000 63.2639 31.8703 177.7848 22 G 3.7584 8.9816 112.0044 45.0844 0.0000 172.8280 23 A 4.4410 8.2434 126.7111 52.2080 19.9971 176.3680 24 N 4.1958 8.3054 116.3689 54.7733 38.2827 173.4759 25 M 4.5810 8.3102 116.5898 54.0897 34.0856 175.2713 26 T 4.6182 8.5135 122.7012 63.7003 70.2881 173.4294 27 I 4.8561 8.9105 126.2311 59.4226 41.2968 174.3111 28 V 4.6305 8.7014 127.1318 60.8986 34.0791 173.7137 29 L 5.0770 8.6955 130.3440 54.0151 43.8123 174.8974 30 H 5.4930 9.5836 122.7414 54.0304 33.1930 172.5251 31 R 4.8859 8.9601 119.5536 54.3111 33.4927 173.9944 32 L 3.6835 8.2144 128.4657 54.4551 42.3491 175.7120 33 D 4.3624 8.6038 127.0738 53.1711 41.3724 175.3672 34 P 4.1476 0.0000 0.0000 65.2003 31.0056 177.2957 35 V 3.6191 6.4111 115.7457 64.9906 32.0207 179.8961 36 S 4.4450 8.1519 119.3454 58.0156 64.3232 173.9478 37 S 4.6475 8.1505 111.7937 58.0736 63.2264 173.6812 38 A 4.3053 7.5888 122.2756 52.4423 19.9459 177.8261 39 W 4.5759 8.6699 121.3711 56.1811 30.4131 175.6086 40 N 5.1911 8.9892 121.1806 51.1562 41.6211 174.0196 41 I 3.9940 8.5074 124.0488 61.9285 37.2776 175.5292 42 L 4.5038 9.4642 128.1605 56.7059 42.9358 176.9647 43 T 4.7833 7.5330 111.3790 60.8916 70.8963 172.2230 44 T 4.9652 8.4993 116.7766 60.0485 71.7561 172.9176 45 G 4.2951 9.1480 110.7259 45.0424 0.0000 170.8181 46 I 5.2993 8.0350 119.2733 59.2336 40.7212 176.1993 47 T 4.2914 9.0189 117.7049 62.0270 70.2946 174.0706 48 N 5.0913 9.1381 121.8230 51.7206 39.8067 175.0945 49 D 4.4766 8.8707 117.6095 57.7257 40.8140 177.2267 50 D 4.5612 8.2943 115.5249 53.8773 41.4253 176.3184 51 G 3.8898 8.7853 106.1241 46.5306 0.0000 173.7014 52 R 5.0367 8.1486 118.3194 54.5889 32.5553 175.2958 53 C 4.8902 8.0340 118.6660 56.5626 31.4860 171.6026 54 P 4.3429 0.0000 0.0000 63.3096 31.7536 176.6382 55 G 3.8656 8.6082 104.9130 46.7450 0.0000 175.4138 56 L 4.0989 8.0767 121.7391 57.1657 41.7424 177.6294 57 I 4.5414 7.9730 117.0632 59.6131 41.1866 173.8576 58 T 4.1458 8.3055 116.0781 60.8310 70.1532 174.8884 59 K 4.0751 8.9350 124.3095 60.4183 31.8102 178.7621 60 E 4.1310 8.1554 116.5016 58.8033 29.6177 177.6581 61 N 4.8512 8.0992 114.7221 53.3065 40.1571 175.3200 62 F 4.9000 7.8293 122.6045 57.4871 38.0132 174.5759 63 I 4.2575 7.8140 118.0038 57.9424 39.8630 176.1459 64 A 4.0524 8.3716 123.0417 51.4665 19.1166 177.7868 65 G 3.7130 7.9673 106.3170 46.6416 0.0000 170.5562 66 V 4.6723 7.3993 119.9620 62.0509 32.8978 175.4642 67 Y 5.1274 8.7262 125.7032 56.2010 41.5009 174.6629 68 K 4.8536 8.9617 121.5336 55.1368 35.9490 174.5958 69 M 4.9881 9.3014 127.3512 53.6292 34.5659 174.6487 70 R 4.9752 8.8325 125.2706 54.7311 32.3887 174.5190 71 F 5.0125 9.4374 126.0444 55.5300 41.2808 176.4896 72 E 4.9727 8.6229 126.2221 55.3479 28.4230 177.0561 73 T 4.1157 8.0304 114.0190 64.7504 69.4383 176.7033 74 G 3.8138 8.3024 108.7598 47.7141 0.0000 175.8492 75 K 4.1205 8.1449 121.0353 58.8638 31.6145 178.6669 76 Y 3.9982 8.2991 120.0249 60.6756 38.7421 178.4519 77 W 4.0293 8.5808 120.0152 59.6958 29.1835 178.1010 78 D 4.5774 8.7059 119.2256 56.7599 40.4374 178.1476 79 A 4.0856 7.9011 120.2621 54.3469 18.3895 178.5343 80 L 4.2833 7.1172 115.7354 54.3722 41.7550 177.3330 81 G 3.9525 7.9788 106.8254 46.1214 0.0000 173.4135 82 E 4.7727 8.3119 117.7596 54.3213 33.3447 175.2315 83 T 4.3944 8.1668 114.8011 61.2395 68.7049 173.3974 84 C 4.3628 8.0082 124.5883 56.9135 34.2199 173.9855 85 F 4.1185 8.0194 128.2465 60.3448 39.0530 174.5107 86 Y 4.4604 7.2283 118.1238 55.2605 38.6011 173.5993 87 P 4.6148 0.0000 0.0000 65.7920 32.5132 175.4374 88 Y 5.4355 6.9040 115.2227 57.0894 40.7481 173.7946 89 V 4.3144 8.7212 119.5520 61.0369 34.7468 173.8526 90 E 5.2439 8.9364 126.4642 54.7079 32.2471 175.1892 91 I 4.4706 9.2273 126.4158 59.8602 39.0988 174.7051 92 V 4.8719 8.5432 127.7945 61.1936 33.0620 174.8250 93 F 5.1728 8.9960 121.9431 55.8209 41.8023 173.1241 94 T 4.7980 8.7190 117.0937 62.3640 70.0554 174.0568 95 I 4.3537 9.0629 127.9688 59.9780 38.9862 176.2531 96 T 4.0548 8.7963 117.2584 61.7364 70.1418 173.8220 97 N 4.8042 8.0662 120.8879 52.2477 39.4808 174.3430 98 T 4.3685 8.4989 121.9899 63.7567 68.9748 175.7135 99 S 4.6090 8.7713 116.3530 58.6887 63.8610 174.5226 100 Q 4.2939 7.4531 120.2509 55.5059 29.6184 174.2397 101 H 4.8001 8.2184 118.9821 55.3987 31.9814 173.2656 102 Y 4.6831 8.5541 122.8654 56.5243 40.9388 173.9168 103 H 5.1564 9.0191 125.4470 54.6930 31.7453 173.6871 104 V 4.1928 8.4884 126.9836 60.3162 31.3819 173.0340 105 P 4.8299 0.0000 0.0000 61.5177 33.7786 175.4391 106 L 4.5170 8.6247 121.0731 53.3952 45.2723 174.3499 107 L 5.0207 8.8540 129.3913 53.6261 43.9557 174.8893 108 L 5.3677 8.8724 127.8619 53.7610 45.8151 175.5660 109 S 5.3536 8.7469 121.2932 56.7338 65.7709 173.7891 110 R 3.1048 7.9837 117.1736 58.7226 29.7682 177.9727 111 F 4.9264 7.8605 113.6057 56.3990 40.8673 174.3705 112 S 4.9120 8.0569 113.9944 57.6939 65.1576 172.7691 113 Y 5.5838 7.7617 119.3960 56.2162 41.1029 173.4871 114 S 4.7177 9.0702 113.7921 57.8693 67.0248 172.5959 115 T 4.9351 8.1658 113.5217 61.2918 70.3793 173.0401 116 T 4.6021 8.2004 122.4601 61.4838 72.4492 173.7962 117 R 4.0981 8.8638 127.0893 56.9250 30.7993 175.5928 118 G 4.2545 9.3703 113.0043 44.4418 0.0000 172.9047 119 S 4.9471 8.3197 113.0507 57.4223 62.2124 173.6957 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 6 L 8.18 4.28 0.00 1.64 1.68 0.90 0.54 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 7 S 8.65 4.17 0.00 3.89 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 8 P 0.00 4.41 0.00 1.68 2.18 0.00 3.65 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 1.77 0.00 9 L 7.08 5.00 0.00 1.25 1.35 0.89 0.60 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 10 S 9.13 4.88 0.00 3.92 3.99 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 11 T 8.13 4.84 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 12 H 8.48 4.90 0.00 3.30 3.12 0.00 5.71 0.00 0.00 0.00 0.00 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 V 8.86 4.58 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 0.60 0.00 0.00 0.97 0.00 0.00 14 L 8.34 4.73 0.00 1.58 1.36 0.97 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 15 N 9.27 5.07 0.00 2.77 2.94 0.00 0.00 6.70 7.46 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 16 A 9.35 4.17 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 17 A 8.62 4.22 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 18 Q 8.14 4.54 0.00 2.13 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.59 0.00 0.00 0.00 0.00 0.00 2.39 2.46 0.00 19 G 8.48 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.35 4.65 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 0.82 0.00 0.00 0.96 0.00 0.00 21 P 0.00 4.48 0.00 2.05 2.12 0.00 3.69 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.15 0.00 22 G 8.98 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 0.00 0.00 0.00 23 A 8.24 4.44 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 24 N 8.31 4.20 0.00 2.88 2.93 0.00 0.00 7.04 8.67 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 25 M 8.31 4.58 0.00 2.02 1.67 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.54 0.00 26 T 8.51 4.62 4.25 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 1.18 0.00 0.00 27 I 8.91 4.86 1.71 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.85 0.43 0.00 0.00 28 V 8.70 4.63 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 0.83 0.00 0.00 0.84 0.00 0.00 29 L 8.70 5.08 0.00 1.79 1.51 1.17 1.23 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 30 H 9.58 5.49 0.00 3.13 3.52 0.00 5.80 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 R 8.96 4.89 0.00 1.50 1.53 0.00 2.88 0.00 0.00 2.81 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.50 0.00 32 L 8.21 3.68 0.00 0.27 0.90 -0.09 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 33 D 8.60 4.36 0.00 2.62 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 34 P 0.00 4.15 0.00 1.98 1.99 0.00 3.61 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.92 0.00 35 V 6.41 3.62 2.16 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 0.73 0.00 0.00 0.87 0.00 0.00 36 S 8.15 4.45 0.00 3.97 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 37 S 8.15 4.65 0.00 3.76 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 38 A 7.59 4.31 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 39 W 8.67 4.58 0.00 3.19 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 40 N 8.99 5.19 0.00 2.62 2.68 0.00 0.00 6.77 6.69 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 41 I 8.51 3.99 1.85 0.00 0.00 0.83 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 0.48 0.86 0.00 0.00 42 L 9.46 4.50 0.00 1.64 1.77 0.95 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 43 T 7.53 4.78 4.32 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 1.26 0.00 0.00 44 T 8.50 4.97 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 1.16 0.00 0.00 45 G 9.15 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 46 I 8.04 5.30 1.86 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 1.39 0.69 0.92 0.00 0.00 47 T 9.02 4.29 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 1.26 0.00 0.00 48 N 9.14 5.09 0.00 2.81 3.02 0.00 0.00 7.05 7.99 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 49 D 8.87 4.48 0.00 2.67 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 50 D 8.29 4.56 0.00 2.61 2.65 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 51 G 8.79 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 52 R 8.15 5.04 0.00 2.00 1.84 0.00 3.04 0.00 0.00 3.06 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.70 0.00 53 C 8.03 4.89 0.00 2.85 2.75 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 54 P 0.00 4.34 0.00 2.20 2.03 0.00 3.91 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 1.98 1.96 0.00 55 G 8.61 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 0.00 0.00 0.00 56 L 8.08 4.10 0.00 1.74 1.71 0.94 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 57 I 7.97 4.54 1.88 0.00 0.00 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 1.49 1.29 0.68 0.00 0.00 58 T 8.31 4.15 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 59 K 8.94 4.08 0.00 1.92 1.93 0.00 1.76 0.00 0.00 1.91 0.00 0.00 3.08 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.57 1.70 7.81 60 E 8.16 4.13 0.00 2.02 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 2.35 2.33 0.00 61 N 8.10 4.85 0.00 2.79 2.94 0.00 0.00 7.09 7.16 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 62 F 7.83 4.90 0.00 3.13 3.22 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 63 I 7.81 4.26 1.83 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.76 0.92 0.00 0.00 64 A 8.37 4.05 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 65 G 7.97 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 66 V 7.40 4.67 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 1.16 0.00 0.00 0.86 0.00 0.00 67 Y 8.73 5.13 0.00 1.52 2.48 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 68 K 8.96 4.85 0.00 0.79 0.83 0.00 1.21 0.00 0.00 0.61 0.00 0.00 2.13 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.84 1.05 7.81 69 M 9.30 4.99 0.00 1.63 2.12 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 3.04 2.60 0.00 70 R 8.83 4.98 0.00 1.73 1.71 0.00 2.97 0.00 0.00 3.02 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.52 0.00 71 F 9.44 5.01 0.00 2.79 2.86 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 72 E 8.62 4.97 0.00 2.06 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 0.00 2.39 2.38 0.00 73 T 8.03 4.12 4.50 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 1.18 0.00 0.00 74 G 8.30 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 0.00 0.00 0.00 75 K 8.14 4.12 0.00 2.04 1.92 0.00 1.82 0.00 0.00 1.77 0.00 0.00 2.95 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.57 1.55 7.81 76 Y 8.30 4.00 0.00 3.05 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 77 W 8.58 4.03 0.00 3.49 3.34 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 78 D 8.71 4.58 0.00 2.86 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 79 A 7.90 4.09 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 80 L 7.12 4.28 0.00 1.66 1.66 0.06 0.67 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 81 G 7.98 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 0.00 0.00 0.00 0.00 82 E 8.31 4.77 0.00 2.26 1.77 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 2.27 2.33 0.00 83 T 8.17 4.39 4.25 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 1.19 0.00 0.00 84 C 8.01 4.36 0.00 3.01 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 85 F 8.02 4.12 0.00 2.43 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 0.00 0.00 0.00 86 Y 7.23 4.46 0.00 3.02 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 87 P 0.00 4.61 0.00 2.23 2.31 0.00 3.49 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 1.58 1.81 0.00 88 Y 6.90 5.44 0.00 3.06 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 89 V 8.72 4.31 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 0.33 0.00 0.00 -0.10 0.00 0.00 90 E 8.94 5.24 0.00 1.88 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 2.22 2.57 0.00 91 I 9.23 4.47 2.18 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 1.22 0.97 1.08 0.00 0.00 92 V 8.54 4.87 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 1.06 0.00 0.00 0.86 0.00 0.00 93 F 9.00 5.17 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 94 T 8.72 4.80 4.32 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 1.24 0.00 0.00 95 I 9.06 4.35 1.86 0.00 0.00 0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.80 0.53 0.00 0.00 96 T 8.80 4.05 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 1.22 0.00 0.00 97 N 8.07 4.80 0.00 2.80 2.90 0.00 0.00 7.19 7.22 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 98 T 8.50 4.37 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 1.24 0.00 0.00 99 S 8.77 4.61 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 0.00 100 Q 7.45 4.29 0.00 1.71 1.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.74 0.00 0.00 0.00 0.00 0.00 2.31 2.29 0.00 101 H 8.22 4.80 0.00 3.16 3.06 0.00 5.61 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 Y 8.55 4.68 0.00 2.76 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 0.00 103 H 9.02 5.16 0.00 3.23 3.10 0.00 5.52 0.00 0.00 0.00 0.00 6.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 V 8.49 4.19 1.90 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 0.75 0.00 0.00 0.21 0.00 0.00 105 P 0.00 4.83 0.00 2.07 2.02 0.00 3.79 0.00 0.00 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.97 0.00 106 L 8.62 4.52 0.00 0.62 0.85 0.49 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 107 L 8.85 5.02 0.00 1.77 1.51 0.99 0.49 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 0.00 108 L 8.87 5.37 0.00 1.73 1.44 1.13 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 109 S 8.75 5.35 0.00 4.06 3.99 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 0.00 110 R 7.98 3.10 0.00 1.32 0.79 0.00 2.73 0.00 0.00 2.60 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.69 0.00 111 F 7.86 4.93 0.00 2.98 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 0.00 112 S 8.06 4.91 0.00 4.02 4.02 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 0.00 0.00 0.00 113 Y 7.76 5.58 0.00 2.85 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 0.00 114 S 9.07 4.72 0.00 3.85 3.90 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 0.00 115 T 8.17 4.94 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 1.25 0.00 0.00 116 T 8.20 4.60 4.25 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 1.22 0.00 0.00 117 R 8.86 4.10 0.00 1.86 1.89 0.00 3.38 0.00 0.00 3.23 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.76 0.00 118 G 9.37 4.25 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 0.00 119 S 8.32 4.95 0.00 3.79 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