NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4771 8.3044 120.3370 55.6439 32.2702 173.3037 2 F 4.4331 8.4972 122.8795 55.0171 42.4223 172.5533 3 A 4.2198 8.8832 118.2761 51.9281 18.5188 175.5786 4 I 4.3652 8.9254 124.6680 59.0100 37.9926 175.7807 5 V 3.8482 8.0829 126.3440 61.3697 33.0182 174.9794 6 K 4.9893 7.9387 121.7244 55.4943 35.2387 175.1860 7 T 4.3499 8.8555 118.2600 62.2635 71.1311 173.9802 8 G 4.1905 8.9511 112.0388 45.8488 0.0000 173.9564 9 G 4.0839 8.5844 105.9645 45.6556 0.0000 173.1479 10 K 4.7630 8.0643 121.2422 54.7090 34.7596 174.4133 11 Q 4.8011 7.9815 117.7182 55.4029 32.1338 173.5690 12 Y 4.5972 8.9574 121.4380 55.8412 39.7541 175.7634 13 R 3.9712 8.6571 125.8852 56.4492 30.6407 175.8754 14 V 4.5769 8.1332 118.5555 59.7073 35.3152 174.0647 15 E 4.7544 8.1690 120.0456 54.3702 33.3013 174.6532 16 P 4.0838 0.0000 0.0000 65.2169 31.4756 177.5251 17 G 4.5906 7.6048 113.8524 44.6925 0.0000 171.2069 18 L 4.0718 7.9712 133.9423 53.5708 45.5999 176.2637 19 K 4.3248 8.9186 119.1738 55.7821 33.3818 175.3273 20 L 4.7850 7.7893 122.6491 55.0823 44.8059 176.4918 21 R 4.7074 8.4343 125.6523 55.7637 31.5424 177.4128 22 V 4.3441 7.6797 111.8571 60.5146 32.4202 171.1441 23 E 3.6415 7.8935 127.3193 55.7681 29.8662 174.4054 24 K 4.5675 8.2173 123.7647 56.6765 31.8072 174.8217 25 L 4.5351 8.3335 126.9034 52.9990 43.0592 176.6869 26 D 4.5645 8.5811 123.2843 53.6001 39.9124 174.4783 27 A 4.5905 8.1439 126.8432 50.1112 21.9768 175.8507 28 E 4.1742 9.2483 122.1020 56.3802 31.7045 178.8078 29 P 4.0928 0.0000 0.0000 63.2576 32.2127 177.1215 30 G 4.5666 9.0146 112.9920 45.7453 0.0000 175.7138 31 A 4.5159 6.8849 121.3880 51.2450 17.5218 178.9021 32 T 4.8686 8.0257 112.2103 64.4913 72.6785 173.1176 33 V 4.5262 8.5040 117.5433 59.5401 36.2155 173.9250 34 E 4.8344 8.7693 124.4372 54.3984 31.3720 176.7005 35 L 4.5544 8.5293 130.3077 52.2333 39.5021 175.1834 36 P 4.2206 0.0000 0.0000 65.8041 31.9944 178.2469 37 V 3.6261 7.7919 112.4516 62.2538 32.1848 175.3165 38 L 4.6541 8.0322 124.9939 54.8314 44.6571 172.8135 39 L 4.7977 7.6128 121.7171 53.9722 46.9290 176.2219 40 L 4.1703 9.1788 122.5254 54.5855 41.2870 173.7113 41 G 4.9869 7.5120 105.2480 45.3285 0.0000 174.6927 42 G 3.8557 8.9343 109.4383 47.6051 0.0000 173.9341 43 E 4.5603 7.8269 119.0648 56.0571 30.3199 175.7995 44 K 3.7834 7.5819 118.4366 57.6168 29.6096 175.1924 45 T 4.1057 8.0555 118.3264 64.0342 69.7182 176.6566 46 V 3.4332 7.7697 118.0102 62.5235 31.8484 173.8005 47 V 4.4126 7.9484 110.0734 59.9658 32.5903 176.5267 48 G 4.0764 7.4417 112.6826 47.7954 0.0000 171.7942 49 T 4.6000 6.9383 108.2811 59.0333 71.1372 173.2202 50 P 3.7683 0.0000 0.0000 64.4929 32.2774 178.3270 51 V 4.2537 7.2174 120.0272 61.7036 33.7892 175.2949 52 V 4.2985 7.9521 115.3931 60.5159 32.9697 175.8043 53 E 4.2136 8.6247 124.4272 57.1526 27.5560 175.8143 54 G 3.6656 7.8876 104.3270 47.3030 0.0000 173.3729 55 A 4.3584 7.9678 121.0287 51.5061 19.4942 176.9633 56 S 5.3397 6.8427 116.3024 58.3748 66.1218 177.2624 57 V 4.5384 7.4350 123.7973 59.6114 33.7227 175.5302 58 V 4.3344 8.6125 125.0318 62.9486 33.4645 175.1302 59 A 5.3853 8.2177 125.4843 52.0673 22.5598 175.3032 60 E 4.4056 8.7799 124.9064 56.5859 31.2882 176.2752 61 V 4.3424 7.9897 127.1653 60.3930 31.3056 176.2078 62 L 3.4862 8.5193 128.4363 57.0804 42.2773 178.5736 63 G 3.6351 7.1731 105.0248 46.5381 0.0000 171.1243 64 H 4.9665 7.9149 114.7882 55.4783 31.5995 174.3553 65 G 4.1409 8.1135 110.5155 47.0833 0.0000 174.1084 66 R 4.9067 8.9199 124.3792 53.9475 33.1723 174.6298 67 G 4.0061 7.2772 108.1018 44.4343 0.0000 172.9087 68 K 4.4092 7.8736 120.9425 51.9207 32.5833 175.2207 69 K 4.1326 8.5756 128.6548 56.8557 32.7697 175.7282 70 I 4.1252 8.7198 128.9658 60.4011 39.6474 174.5854 71 L 5.0105 8.4522 128.9985 53.3159 42.7905 175.9131 72 V 4.2217 8.2196 118.8078 60.3116 33.1270 175.7613 73 S 5.0301 8.5374 119.4870 56.6071 65.5206 173.4531 74 K 4.6033 9.0082 124.3006 54.9683 34.7782 175.7627 75 F 5.4061 8.2351 123.9582 58.4099 41.9133 173.0703 76 K 4.3828 8.0633 126.0298 54.0894 34.0943 176.5096 77 A 3.7308 8.4965 127.6949 52.6433 19.4204 177.3886 78 K 4.1161 8.3546 117.1656 56.7584 29.0420 175.6239 79 V 4.2552 7.4978 117.0240 61.4517 36.0238 173.3064 80 Q 3.5651 8.1054 118.4964 57.6631 25.5115 173.6124 81 Y 4.8344 7.2941 120.5213 56.0691 39.0558 172.7673 82 R 4.9090 8.4715 122.4012 54.0389 32.6309 175.4596 83 R 4.5403 8.5942 123.3878 54.1999 33.7638 174.2897 84 K 4.8226 8.7747 125.5489 54.4050 34.1037 175.0434 85 K 4.6368 9.3784 128.4413 54.4827 36.0649 174.8887 86 G 4.2410 8.7441 112.8620 44.8942 0.0000 171.9082 87 H 4.9951 9.0431 126.9657 54.1031 32.4432 172.8219 88 R 4.6928 8.2995 124.5708 54.1895 32.4274 175.4980 89 Q 4.0666 8.3995 124.1986 55.1612 29.9209 173.9179 90 P 4.7651 0.0000 0.0000 62.2526 32.3067 175.5101 91 Y 5.0334 8.6681 124.0508 57.0432 42.0481 176.3116 92 T 4.2196 8.1226 102.5204 60.9544 70.7509 171.7095 93 E 3.6733 8.5344 128.5856 57.3423 29.5747 176.1914 94 L 4.8536 8.1367 124.4335 53.1562 44.1377 176.3666 95 L 4.7812 8.3841 122.4052 53.2020 45.0841 175.6337 96 I 4.2370 8.3842 128.6073 60.8539 38.1698 175.1437 97 K 4.9678 9.0868 126.3923 56.4432 32.6174 180.3024 98 E 4.3396 9.1497 127.3379 56.3968 31.4750 175.4672 99 I 4.7770 7.8918 120.1902 60.5673 37.9834 176.4509 100 R 4.0349 8.3470 120.7214 56.5151 29.0607 177.1524 101 G 3.7286 8.2715 114.2344 46.0450 0.0000 170.7132 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 M 8.30 4.48 0.00 2.23 1.99 0.00 0.00 0.00 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.51 0.00 2 F 8.50 4.43 0.00 2.92 2.87 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 3 A 8.88 4.22 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 4 I 8.93 4.37 1.86 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 1.10 1.05 0.89 0.00 0.00 5 V 8.08 3.85 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 0.74 0.00 0.00 1.04 0.00 0.00 6 K 7.94 4.99 0.00 1.90 1.71 0.00 1.89 0.00 0.00 1.66 0.00 0.00 2.89 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.70 1.49 7.81 7 T 8.86 4.35 4.17 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 0.89 0.00 0.00 8 G 8.95 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 9 G 8.58 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 10 K 8.06 4.76 0.00 1.74 1.35 0.00 1.59 0.00 0.00 1.66 0.00 0.00 3.08 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.22 1.36 7.81 11 Q 7.98 4.80 0.00 1.91 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.92 6.74 0.00 0.00 0.00 0.00 0.00 2.28 2.34 0.00 12 Y 8.96 4.60 0.00 2.74 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 13 R 8.66 3.97 0.00 1.59 1.70 0.00 2.57 0.00 0.00 3.01 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.21 0.00 14 V 8.13 4.58 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 0.78 0.00 0.00 1.01 0.00 0.00 15 E 8.17 4.75 0.00 1.89 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 2.25 2.27 0.00 16 P 0.00 4.08 0.00 2.05 2.08 0.00 3.68 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.16 0.00 17 G 7.60 4.59 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 0.00 0.00 0.00 18 L 7.97 4.07 0.00 1.83 1.00 0.93 0.13 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 19 K 8.92 4.32 0.00 1.84 1.80 0.00 1.55 0.00 0.00 1.41 0.00 0.00 2.88 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.16 1.38 7.81 20 L 7.79 4.79 0.00 1.68 1.37 0.94 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 21 R 8.43 4.71 0.00 1.76 1.56 0.00 3.50 0.00 0.00 3.96 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.37 0.00 22 V 7.68 4.34 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 -0.24 0.00 0.00 0.72 0.00 0.00 23 E 7.89 3.64 0.00 2.15 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 2.30 2.30 0.00 24 K 8.22 4.57 0.00 1.76 1.79 0.00 1.60 0.00 0.00 2.61 0.00 0.00 2.78 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.42 1.42 7.81 25 L 8.33 4.54 0.00 1.65 1.56 0.84 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 26 D 8.58 4.56 0.00 2.63 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 27 A 8.14 4.59 1.18 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 0.00 0.00 0.00 28 E 9.25 4.17 0.00 2.04 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 2.42 2.38 0.00 29 P 0.00 4.09 0.00 2.06 1.21 0.00 3.67 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 2.03 2.16 0.00 30 G 9.01 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 31 A 6.88 4.52 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 32 T 8.03 4.87 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 1.19 0.00 0.00 33 V 8.50 4.53 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 0.77 0.00 0.00 0.93 0.00 0.00 34 E 8.77 4.83 0.00 1.94 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 2.19 2.30 0.00 35 L 8.53 4.55 0.00 1.69 1.58 0.91 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 36 P 0.00 4.22 0.00 2.17 2.21 0.00 3.83 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 2.01 0.00 37 V 7.79 3.63 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 0.76 0.00 0.00 0.99 0.00 0.00 38 L 8.03 4.65 0.00 1.61 1.60 0.93 0.98 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 39 L 7.61 4.80 0.00 1.59 1.49 0.99 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 40 L 9.18 4.17 0.00 1.92 1.85 1.01 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 41 G 7.51 4.99 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 0.00 0.00 0.00 42 G 8.93 3.86 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 0.00 0.00 0.00 43 E 7.83 4.56 0.00 1.93 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 2.20 2.22 0.00 44 K 7.58 3.78 0.00 1.91 1.82 0.00 1.66 0.00 0.00 1.68 0.00 0.00 2.93 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.33 1.33 7.81 45 T 8.06 4.11 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 1.23 0.00 0.00 46 V 7.77 3.43 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 0.70 0.00 0.00 0.95 0.00 0.00 47 V 7.95 4.41 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 0.78 0.00 0.00 0.97 0.00 0.00 48 G 7.44 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 49 T 6.94 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 50 P 0.00 3.77 0.00 2.09 2.02 0.00 3.67 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.13 0.00 51 V 7.22 4.25 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 0.84 0.00 0.00 0.94 0.00 0.00 52 V 7.95 4.30 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 0.91 0.00 0.00 0.94 0.00 0.00 53 E 8.62 4.21 0.00 2.17 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 0.00 2.19 2.30 0.00 54 G 7.89 3.67 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 0.00 0.00 0.00 55 A 7.97 4.36 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 56 S 6.84 5.34 0.00 4.10 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 57 V 7.43 4.54 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 0.92 0.00 0.00 0.92 0.00 0.00 58 V 8.61 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 0.69 0.00 0.00 0.92 0.00 0.00 59 A 8.22 5.39 1.19 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 60 E 8.78 4.41 0.00 2.04 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 0.00 2.33 2.49 0.00 61 V 7.99 4.34 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 0.71 0.00 0.00 0.83 0.00 0.00 62 L 8.52 3.49 0.00 1.64 1.75 0.89 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 63 G 7.17 3.64 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 0.00 64 H 7.91 4.97 0.00 3.41 3.25 0.00 5.59 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 65 G 8.11 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 0.00 0.00 0.00 0.00 66 R 8.92 4.91 0.00 1.54 1.66 0.00 3.11 0.00 0.00 3.17 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.48 0.00 67 G 7.28 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 0.00 0.00 0.00 68 K 7.87 4.41 0.00 1.71 1.66 0.00 1.66 0.00 0.00 1.61 0.00 0.00 3.02 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.41 1.53 7.81 69 K 8.58 4.13 0.00 1.77 1.70 0.00 1.81 0.00 0.00 1.61 0.00 0.00 2.93 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.41 1.43 7.81 70 I 8.72 4.13 1.89 0.00 0.00 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 1.23 1.21 0.94 0.00 0.00 71 L 8.45 5.01 0.00 1.54 1.60 0.91 0.93 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 72 V 8.22 4.22 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 0.68 0.00 0.00 0.98 0.00 0.00 73 S 8.54 5.03 0.00 3.78 3.77 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 74 K 9.01 4.60 0.00 1.33 1.51 0.00 1.64 0.00 0.00 1.55 0.00 0.00 2.79 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.32 1.28 7.81 75 F 8.24 5.41 0.00 2.92 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 K 8.06 4.38 0.00 1.85 1.66 0.00 1.96 0.00 0.00 2.07 0.00 0.00 2.89 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.46 1.53 7.81 77 A 8.50 3.73 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 78 K 8.35 4.12 0.00 1.82 2.08 0.00 1.79 0.00 0.00 1.76 0.00 0.00 3.04 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.41 1.44 7.81 79 V 7.50 4.26 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 0.64 0.00 0.00 0.88 0.00 0.00 80 Q 8.11 3.57 0.00 2.26 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 7.15 0.00 0.00 0.00 0.00 0.00 2.27 2.29 0.00 81 Y 7.29 4.83 0.00 2.98 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 82 R 8.47 4.91 0.00 1.76 1.89 0.00 3.39 0.00 0.00 3.35 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.97 0.00 83 R 8.59 4.54 0.00 1.40 1.72 0.00 3.28 0.00 0.00 3.19 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.84 0.00 84 K 8.77 4.82 0.00 1.72 1.67 0.00 1.70 0.00 0.00 1.62 0.00 0.00 2.73 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.31 1.38 7.81 85 K 9.38 4.64 0.00 1.82 1.57 0.00 1.54 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.32 1.41 7.81 86 G 8.74 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 0.00 0.00 0.00 0.00 87 H 9.04 5.00 0.00 3.23 3.14 0.00 5.72 0.00 0.00 0.00 0.00 6.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 R 8.30 4.69 0.00 1.59 1.70 0.00 3.22 0.00 0.00 3.17 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.56 0.00 89 Q 8.40 4.07 0.00 1.92 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 7.11 0.00 0.00 0.00 0.00 0.00 2.49 2.38 0.00 90 P 0.00 4.77 0.00 1.94 1.95 0.00 3.59 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.01 0.00 91 Y 8.67 5.03 0.00 2.89 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 92 T 8.12 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 1.38 0.00 0.00 93 E 8.53 3.67 0.00 1.89 1.80 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 1.94 1.62 0.00 94 L 8.14 4.85 0.00 1.54 1.46 0.79 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 95 L 8.38 4.78 0.00 1.62 1.69 0.92 0.88 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 96 I 8.38 4.24 1.93 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.69 1.03 0.00 0.00 97 K 9.09 4.97 0.00 1.58 0.89 0.00 1.70 0.00 0.00 1.74 0.00 0.00 2.93 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.38 1.49 7.81 98 E 9.15 4.34 0.00 2.04 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 2.34 2.33 0.00 99 I 7.89 4.78 1.89 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 1.41 0.93 0.93 0.00 0.00 100 R 8.35 4.03 0.00 1.88 2.22 0.00 2.90 0.00 0.00 3.38 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.78 0.00 101 G 8.27 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 0.00 0.00 0.00