NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9800 8.3393 109.7410 45.0350 0.0000 173.4328 2 P 4.2798 0.0000 0.0000 63.6332 32.0843 176.1887 3 L 4.2630 7.8521 120.1604 51.5528 41.0304 175.5904 4 G 4.6848 7.9704 112.3848 43.6748 0.0000 171.2996 5 S 4.1094 8.2770 121.6694 61.6061 62.9723 176.5856 6 K 4.0529 7.8676 122.6209 58.8681 31.7649 178.3546 7 N 4.5126 8.0989 117.1635 56.1449 38.3423 176.9655 8 M 4.0602 7.9063 119.7233 58.8845 32.3422 178.4418 9 L 4.2985 7.9995 118.4667 57.3162 41.7635 178.9759 10 L 4.2690 8.3081 120.7575 58.4991 42.1605 178.7512 11 E 4.0051 8.3607 118.9710 58.7669 29.3190 178.5215 12 W 4.3261 7.9988 127.5147 60.9630 31.2644 177.5465 13 C 4.0576 8.7302 116.8937 62.6043 27.7194 176.0731 14 R 4.3698 8.7385 121.8450 58.7026 29.5766 178.3899 15 A 3.9965 8.1475 120.8625 55.2445 18.3733 179.1795 16 M 4.0050 7.7128 116.0066 57.8356 32.0993 178.8834 17 T 3.9989 7.5882 115.7286 66.1201 68.3376 176.2000 18 R 4.2132 7.4042 117.7772 57.4353 30.1875 176.7297 19 N 4.7381 7.6044 115.2812 52.8046 38.8315 173.6670 20 Y 4.8746 7.5733 114.8683 56.4255 42.2776 174.1001 21 E 4.7012 8.3336 119.1272 55.9920 33.1716 176.4394 22 H 4.2038 9.0537 118.2069 56.4689 28.6376 174.4328 23 V 4.2194 7.3713 115.4276 61.3541 33.8480 174.4549 24 D 4.2926 8.2702 125.8889 53.0136 42.8412 174.9802 25 I 3.9087 7.9416 128.9985 60.2741 36.1529 175.5350 26 Q 4.1821 8.7868 125.4895 57.8386 28.5208 176.2135 27 N 5.0001 7.5037 113.5238 52.3292 42.8658 173.7855 28 F 4.9216 8.6683 121.6788 55.4392 37.8662 174.6025 29 S 5.0284 7.5775 119.9714 59.1557 70.0800 178.0419 30 S 4.2390 8.7181 116.1372 61.1526 63.5250 176.7316 31 S 4.2655 7.6642 114.7152 60.0073 62.7335 174.7518 32 W 4.5794 8.2895 119.8532 56.3913 29.3834 177.6674 33 S 4.7178 8.3227 113.7643 60.0281 62.0063 175.3383 34 S 4.2142 8.1015 113.8747 59.3058 63.6018 174.4592 35 G 4.0655 8.4652 112.7883 46.4218 0.0000 175.5088 36 M 3.9732 7.7967 118.6910 58.1058 31.8755 178.3989 37 A 3.6053 7.8604 120.4326 55.0021 18.3350 179.5555 38 F 4.3336 8.3625 116.0406 61.1622 39.1164 177.7762 39 C 4.5486 8.2815 115.6549 62.7613 27.9988 175.8371 40 A 3.2001 8.4501 122.8404 54.7093 17.3008 179.4920 41 L 3.9177 7.7169 118.2866 58.4707 42.2896 179.2390 42 I 4.1248 8.2082 119.8331 64.8788 36.8911 177.9861 43 H 4.3863 8.7748 118.4297 58.9278 29.6939 176.9436 44 K 3.9353 7.7606 120.6081 59.0051 32.0294 178.2171 45 F 4.3629 7.7146 115.8179 57.7379 40.2284 175.6116 46 F 4.8263 8.4617 118.5063 54.7365 39.1117 173.9369 47 P 4.1328 0.0000 0.0000 64.9025 31.4828 177.5012 48 E 4.3883 8.1136 115.1208 56.3645 29.7065 177.2165 49 A 4.0519 7.7649 123.2463 54.1258 18.4779 177.9099 50 F 4.6915 6.9392 106.4226 56.4421 40.5391 172.6994 51 D 4.7911 8.5691 120.4789 52.7896 41.1282 176.0720 52 Y 4.1585 8.6094 129.0268 60.4561 39.1087 177.6558 53 A 4.0207 7.9529 121.6577 54.1275 18.5554 177.5172 54 E 4.2537 7.7732 114.4732 56.3229 30.1053 175.9085 55 L 4.2360 7.2321 118.6747 54.6186 42.7286 175.7786 56 D 4.9086 8.0654 122.4096 51.5087 43.3046 175.7318 57 P 4.1145 0.0000 0.0000 65.2044 31.4567 177.1698 58 A 4.2252 7.7920 120.0780 53.2879 19.0502 177.3666 59 K 4.5223 7.8567 115.7897 56.1688 32.5362 179.0807 60 R 3.7904 8.0236 121.4189 59.3072 30.2306 179.1096 61 R 3.9779 8.0734 116.9277 59.2049 30.4443 176.7838 62 H 4.4956 8.0057 113.6666 57.1456 29.9855 176.6641 63 N 3.9368 8.4286 118.5464 56.6925 38.5334 176.7417 64 F 3.5353 7.3712 118.6797 60.6961 38.8742 177.8473 65 T 3.8844 7.7679 114.7816 66.4233 68.3051 176.2878 66 L 3.8770 8.2781 122.3663 57.9827 42.1205 178.8288 67 A 4.1575 7.8688 120.7136 55.2888 18.3279 179.5103 68 F 4.6445 8.0344 116.2935 61.1142 39.0340 178.0906 69 S 4.2297 8.5277 114.8494 62.1486 62.5990 177.0920 70 T 3.9152 8.2262 118.1099 66.5844 68.1550 176.7413 71 A 4.0266 8.4140 122.8264 55.0649 18.5742 179.1841 72 E 4.0916 8.6379 117.8339 58.7052 29.4845 178.7451 73 K 4.0050 8.0636 119.4565 58.5312 32.4383 177.8466 74 L 4.4606 7.9585 116.8770 54.6142 42.5917 176.9766 75 A 4.6681 7.7262 118.9359 50.4217 20.4447 175.3074 76 D 4.9392 8.5172 114.6472 53.6054 38.4344 174.0642 77 C 4.1133 7.9233 112.2779 58.7633 30.5999 173.1349 78 A 3.9630 8.1212 125.9492 52.2900 18.1488 178.5597 79 Q 4.3031 8.2728 123.6750 55.7155 26.8954 175.7814 80 L 4.2291 7.9381 120.7576 55.4694 42.6875 176.9220 81 L 4.7288 7.6522 116.9104 52.6555 44.7210 175.6904 82 E 4.7776 7.9399 118.4043 53.8306 34.3270 177.5658 83 V 3.4850 8.2773 120.6827 66.3947 31.7729 178.1591 84 D 4.3224 8.0253 118.0940 57.3356 40.6888 178.1210 85 D 4.2566 7.9674 117.8325 57.7408 41.2277 178.0979 86 M 3.8837 7.8402 119.0340 58.2729 31.6091 179.0385 87 V 3.5895 7.3852 117.3252 65.9283 31.8054 177.7637 88 R 4.0192 7.9515 117.6115 59.3875 30.0152 178.0717 89 L 4.0892 7.9952 117.4049 55.0898 41.7561 177.5836 90 A 4.1136 8.5174 126.7890 52.1810 17.8295 177.5012 91 V 4.4294 7.4909 116.7632 60.4138 32.2337 173.5076 92 P 4.6149 0.0000 0.0000 61.8993 32.6594 175.9051 93 D 4.5717 8.3446 118.2782 54.0893 43.0698 177.4399 94 S 4.7719 8.6328 123.3183 61.0697 62.8767 176.9492 95 K 3.9831 9.1325 122.9320 59.5013 31.9057 178.7956 96 C 4.1730 7.9800 116.6588 62.7727 28.0847 176.0829 97 V 3.5348 7.7959 119.8652 65.9612 31.1005 177.2703 98 Y 3.6998 8.1963 119.6664 61.1365 38.6079 178.3919 99 T 3.8840 8.1646 116.5339 66.5962 68.6227 176.0593 100 Y 3.7916 8.0308 121.4497 60.9191 38.8896 178.3139 101 I 4.0214 8.1964 120.9770 64.2466 37.1600 177.8053 102 Q 3.6937 8.2057 120.9904 59.5240 28.7361 178.5087 103 E 3.9431 8.1891 119.2720 59.0089 29.4449 179.2852 104 L 3.9007 7.7655 120.1255 58.2320 42.1428 178.2340 105 Y 3.9888 8.4915 119.7174 60.8890 38.6038 178.2886 106 R 3.6619 8.0109 118.7114 59.5011 29.8170 179.2997 107 S 4.0539 8.2003 114.8916 61.4892 62.7783 176.8218 108 L 3.9781 7.8668 121.9288 57.5466 41.2905 179.6913 109 V 3.4622 7.6899 118.8293 65.7954 31.2553 178.0733 110 Q 4.0297 8.0660 116.0979 58.1643 28.4566 177.4745 111 K 4.4349 7.2604 117.6397 55.0384 32.7765 176.0739 112 G 3.8768 7.9964 107.0135 47.0759 0.0000 175.1657 113 L 4.5060 8.4271 119.7374 56.2049 43.1816 179.1423 114 V 4.0623 7.7132 116.2267 65.5684 32.2255 176.2750 115 K 4.3635 7.8262 122.1409 55.8280 30.7936 176.5648 116 T 4.2510 7.6111 107.4962 61.7110 70.0374 175.0066 117 K 4.2524 7.8296 122.7878 54.6709 33.5414 175.0944 118 K 4.2344 8.5236 128.6208 54.9202 32.5388 175.8412 119 K 4.1895 8.6297 126.5916 56.9091 33.0053 175.1511 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 8.34 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 0.00 0.00 0.00 2 P 0.00 4.28 0.00 2.29 2.20 0.00 3.78 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 1.99 2.06 0.00 3 L 7.85 4.26 0.00 1.66 1.67 0.92 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 4 G 7.97 4.68 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 0.00 0.00 0.00 5 S 8.28 4.11 0.00 4.16 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 0.00 6 K 7.87 4.05 0.00 1.63 1.84 0.00 1.82 0.00 0.00 1.86 0.00 0.00 2.83 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.36 1.18 7.81 7 N 8.10 4.51 0.00 3.16 2.96 0.00 0.00 6.54 7.70 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 8 M 7.91 4.06 0.00 2.15 2.05 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 2.53 2.40 0.00 9 L 8.00 4.30 0.00 1.88 2.01 0.41 -0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 10 L 8.31 4.27 0.00 2.36 2.07 0.94 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 11 E 8.36 4.01 0.00 2.18 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 2.37 2.52 0.00 12 W 8.00 4.33 0.00 3.42 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 13 C 8.73 4.06 0.00 3.08 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 14 R 8.74 4.37 0.00 1.97 2.07 0.00 3.11 0.00 0.00 3.27 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.46 0.00 15 A 8.15 4.00 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 16 M 7.71 4.00 0.00 2.02 2.06 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.30 0.00 17 T 7.59 4.00 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 1.16 0.00 0.00 18 R 7.40 4.21 0.00 1.96 1.94 0.00 3.10 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 1.63 1.84 0.00 19 N 7.60 4.74 0.00 2.50 2.44 0.00 0.00 6.55 6.62 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 20 Y 7.57 4.87 0.00 2.77 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 21 E 8.33 4.70 0.00 2.07 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 2.30 2.29 0.00 22 H 9.05 4.20 0.00 3.28 3.44 0.00 5.67 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 V 7.37 4.22 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 0.53 0.00 0.00 0.94 0.00 0.00 24 D 8.27 4.29 0.00 2.52 2.41 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 25 I 7.94 3.91 1.63 0.00 0.00 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.64 0.28 0.59 0.00 0.00 26 Q 8.79 4.18 0.00 2.01 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.67 6.61 0.00 0.00 0.00 0.00 0.00 2.35 2.38 0.00 27 N 7.50 5.00 0.00 2.73 2.68 0.00 0.00 7.34 7.82 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 28 F 8.67 4.92 0.00 3.23 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 29 S 7.58 5.03 0.00 4.05 3.93 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 30 S 8.72 4.24 0.00 3.96 4.01 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 31 S 7.66 4.27 0.00 3.99 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 32 W 8.29 4.58 0.00 3.63 3.41 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 33 S 8.32 4.72 0.00 4.07 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 34 S 8.10 4.21 0.00 3.98 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 35 G 8.47 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 0.00 0.00 0.00 36 M 7.80 3.97 0.00 2.09 2.12 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.65 0.00 37 A 7.86 3.61 0.33 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 38 F 8.36 4.33 0.00 3.30 3.24 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 39 C 8.28 4.55 0.00 3.20 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 40 A 8.45 3.20 0.27 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 41 L 7.72 3.92 0.00 1.95 2.05 0.88 1.20 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 42 I 8.21 4.12 2.35 0.00 0.00 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 2.09 1.07 1.26 0.00 0.00 43 H 8.77 4.39 0.00 3.23 3.62 0.00 5.76 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 K 7.76 3.94 0.00 2.01 1.69 0.00 1.37 0.00 0.00 1.01 0.00 0.00 2.75 0.00 0.00 2.63 0.00 0.00 0.00 0.00 1.24 1.45 7.81 45 F 7.71 4.36 0.00 2.88 2.39 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 46 F 8.46 4.83 0.00 3.03 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 47 P 0.00 4.13 0.00 2.02 2.03 0.00 3.69 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 1.99 0.00 48 E 8.11 4.39 0.00 2.01 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 2.31 2.27 0.00 49 A 7.76 4.05 1.02 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 0.00 0.00 50 F 6.94 4.69 0.00 3.09 3.08 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 51 D 8.57 4.79 0.00 2.78 2.67 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 0.00 0.00 0.00 0.00 52 Y 8.61 4.16 0.00 3.01 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 53 A 7.95 4.02 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 54 E 7.77 4.25 0.00 1.97 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 0.00 2.23 2.24 0.00 55 L 7.23 4.24 0.00 1.44 1.31 0.72 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 56 D 8.07 4.91 0.00 2.57 2.44 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 57 P 0.00 4.11 0.00 2.15 2.17 0.00 3.64 0.00 0.00 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.84 0.00 58 A 7.79 4.23 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 59 K 7.86 4.52 0.00 1.89 1.72 0.00 1.67 0.00 0.00 1.54 0.00 0.00 2.80 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.33 1.32 7.81 60 R 8.02 3.79 0.00 1.87 2.06 0.00 3.23 0.00 0.00 3.39 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.61 0.00 61 R 8.07 3.98 0.00 1.79 1.99 0.00 3.34 0.00 0.00 3.08 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.61 0.00 62 H 8.01 4.50 0.00 3.14 3.24 0.00 5.69 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 63 N 8.43 3.94 0.00 2.59 2.40 0.00 0.00 6.79 7.33 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 64 F 7.37 3.54 0.00 2.86 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 65 T 7.77 3.88 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 1.24 0.00 0.00 66 L 8.28 3.88 0.00 1.67 1.53 0.95 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 67 A 7.87 4.16 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 68 F 8.03 4.64 0.00 3.08 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 69 S 8.53 4.23 0.00 4.02 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 70 T 8.23 3.92 4.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 71 A 8.41 4.03 1.66 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 0.00 0.00 72 E 8.64 4.09 0.00 2.22 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 0.00 2.31 2.58 0.00 73 K 8.06 4.00 0.00 1.88 2.01 0.00 1.84 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.42 1.47 7.81 74 L 7.96 4.46 0.00 0.78 1.11 0.58 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 75 A 7.73 4.67 1.45 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 0.00 0.00 76 D 8.52 4.94 0.00 2.86 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 77 C 7.92 4.11 0.00 3.04 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 78 A 8.12 3.96 1.08 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 79 Q 8.27 4.30 0.00 2.01 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.59 7.03 0.00 0.00 0.00 0.00 0.00 2.38 2.38 0.00 80 L 7.94 4.23 0.00 1.84 1.76 0.83 0.94 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 81 L 7.65 4.73 0.00 0.77 1.26 0.68 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 82 E 7.94 4.78 0.00 1.90 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 2.24 2.27 0.00 83 V 8.28 3.48 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 1.18 0.00 0.00 1.10 0.00 0.00 84 D 8.03 4.32 0.00 2.71 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 85 D 7.97 4.26 0.00 2.74 2.74 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 86 M 7.84 3.88 0.00 1.33 1.32 0.00 0.00 0.00 0.00 0.00 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.40 0.00 87 V 7.39 3.59 2.07 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 0.84 0.00 0.00 1.09 0.00 0.00 88 R 7.95 4.02 0.00 1.88 2.12 0.00 3.30 0.00 0.00 3.22 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.67 0.00 89 L 8.00 4.09 0.00 1.70 1.71 0.98 0.69 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 90 A 8.52 4.11 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 91 V 7.49 4.43 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 0.96 0.00 0.00 0.99 0.00 0.00 92 P 0.00 4.61 0.00 2.28 2.10 0.00 4.15 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.19 0.00 93 D 8.34 4.57 0.00 2.75 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 94 S 8.63 4.77 0.00 3.92 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 95 K 9.13 3.98 0.00 1.74 1.88 0.00 1.60 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.45 1.46 7.81 96 C 7.98 4.17 0.00 3.14 2.98 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 97 V 7.80 3.53 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 0.28 0.00 0.00 0.88 0.00 0.00 98 Y 8.20 3.70 0.00 2.86 2.98 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 99 T 8.16 3.88 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 1.20 0.00 0.00 100 Y 8.03 3.79 0.00 3.24 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 0.00 101 I 8.20 4.02 1.84 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.04 1.26 0.00 0.00 102 Q 8.21 3.69 0.00 1.56 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.80 0.00 0.00 0.00 0.00 0.00 2.25 2.22 0.00 103 E 8.19 3.94 0.00 1.99 1.86 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 2.24 2.29 0.00 104 L 7.77 3.90 0.00 2.01 2.02 1.06 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 105 Y 8.49 3.99 0.00 2.82 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 0.00 106 R 8.01 3.66 0.00 1.98 1.90 0.00 3.16 0.00 0.00 3.33 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 2.04 0.00 107 S 8.20 4.05 0.00 3.97 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 0.00 108 L 7.87 3.98 0.00 1.56 1.43 0.22 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 109 V 7.69 3.46 1.70 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 0.88 0.00 0.00 -0.01 0.00 0.00 110 Q 8.07 4.03 0.00 2.19 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.71 0.00 0.00 0.00 0.00 0.00 2.50 2.38 0.00 111 K 7.26 4.43 0.00 1.85 1.88 0.00 1.95 0.00 0.00 1.75 0.00 0.00 3.04 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.40 1.49 7.81 112 G 8.00 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 0.00 0.00 0.00 113 L 8.43 4.51 0.00 1.65 1.81 0.89 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 114 V 7.71 4.06 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 1.07 0.00 0.00 1.01 0.00 0.00 115 K 7.83 4.36 0.00 1.75 1.75 0.00 1.81 0.00 0.00 1.76 0.00 0.00 3.00 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.43 1.44 7.81 116 T 7.61 4.25 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 1.21 0.00 0.00 117 K 7.83 4.25 0.00 1.71 1.77 0.00 1.77 0.00 0.00 1.67 0.00 0.00 2.98 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.33 1.40 7.81 118 K 8.52 4.23 0.00 1.74 1.72 0.00 1.96 0.00 0.00 1.64 0.00 0.00 2.84 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.33 1.40 7.81 119 K 8.63 4.19 0.00 1.93 1.77 0.00 1.87 0.00 0.00 1.75 0.00 0.00 3.05 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.32 1.42 7.81