NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 K 4.2635 8.3149 119.9936 56.5802 33.7533 175.0521 4 I 4.2437 7.2077 119.1353 60.3013 39.6753 175.7429 5 I 4.0367 9.1041 128.0811 60.8651 38.9078 174.5074 6 H 5.1139 8.6640 125.2737 54.4127 28.8883 175.1481 7 L 4.5765 8.6421 124.3969 54.4936 43.0098 176.3981 8 T 4.9322 8.4919 108.5877 59.1774 72.0398 174.7685 9 D 4.4130 8.8974 122.6365 57.9667 40.8497 178.8970 10 D 4.5398 8.1571 117.7555 56.7533 41.2065 177.9353 11 S 4.5196 8.1407 113.4252 58.9460 63.5138 175.8365 12 F 3.8181 8.0986 125.3788 61.6090 38.9501 176.0643 13 D 4.4372 8.4408 116.8349 57.9058 40.6764 178.3428 14 T 3.9194 7.6975 111.1504 65.3779 67.6657 175.8107 15 D 4.3797 8.3495 119.6471 56.4207 40.8379 176.2960 16 V 3.7850 7.4438 116.7603 64.2159 33.3798 177.1617 17 L 4.1849 7.1979 117.7297 56.2827 41.5249 177.9033 18 K 4.4855 7.5638 115.0810 55.3536 34.0984 176.2952 19 A 4.0957 7.6083 124.5569 52.5838 18.8803 177.1755 20 D 4.6136 8.4228 119.1179 53.1095 41.0413 178.1622 21 G 3.8393 8.7898 110.1255 43.0865 0.0000 171.9699 22 A 4.7076 8.2394 119.3669 51.5390 20.3482 176.9821 23 I 4.8085 8.7905 121.6252 59.4995 41.4756 174.2021 24 L 4.9140 9.1107 130.3852 53.8027 43.3088 175.0564 25 V 4.6256 9.1348 127.9624 61.5828 33.6443 173.9971 26 D 5.3006 9.1436 127.9693 52.6593 43.4393 174.7212 27 F 5.2405 9.3189 126.6909 56.4740 40.5328 175.3517 28 W 5.6975 8.8953 119.8024 55.0666 32.3775 173.4299 29 A 4.0626 8.1042 119.5101 49.6555 21.3501 177.0263 30 E 4.0465 8.2643 121.5238 58.9025 29.9019 177.7643 31 W 4.6281 7.1362 112.9960 56.5622 28.6645 175.4194 32 C 4.8115 7.6570 120.6868 57.8770 32.3928 174.0023 33 G 3.7030 8.7912 115.3657 47.7957 0.0000 173.2129 34 P 4.3362 0.0000 0.0000 65.2566 31.4196 178.5707 35 C 4.1761 7.9274 115.2053 62.7411 27.9727 175.8890 36 K 3.9842 7.8790 119.8782 59.3166 31.7506 178.6828 37 M 4.1690 7.5278 118.1839 58.4440 32.2151 178.2349 38 I 3.8334 7.6634 117.3983 62.9679 38.2166 177.2303 39 A 3.7815 7.6527 122.0459 55.0503 17.6140 177.8950 40 P 4.6131 0.0000 0.0000 65.2818 31.2959 178.6041 41 I 3.9372 7.5127 119.6202 64.2470 37.1182 178.0491 42 L 3.9728 8.0992 120.2432 57.7827 41.5197 179.2157 43 D 4.3501 7.9534 118.6567 57.3192 40.6799 178.7877 44 E 4.0688 7.8729 118.0949 59.4408 29.5776 179.3123 45 I 3.8082 7.8051 119.6798 64.2848 36.8771 178.2208 46 A 4.0267 7.8460 120.7532 55.3960 18.6062 179.1745 47 D 4.5833 7.7757 116.3283 57.5762 40.7518 178.8113 48 E 4.2131 8.2826 117.8946 58.4053 29.7572 177.8353 49 Y 4.4719 8.0694 115.5430 56.2295 38.2904 175.1777 50 Q 4.2081 7.1199 118.3723 57.9077 28.8090 176.7983 51 G 4.0628 9.2625 111.0504 44.8514 0.0000 173.8867 52 K 4.5100 8.0849 117.1461 56.5771 34.4582 175.8897 53 L 4.7503 7.6922 117.9771 53.8300 45.5930 175.0847 54 T 4.5431 8.4190 120.9334 61.8305 71.1595 173.2652 55 V 4.6252 8.3443 126.7580 61.5052 33.3233 174.3699 56 A 5.2288 9.2859 129.3360 50.0311 22.6902 174.6735 57 K 5.0224 9.0871 119.3917 54.4581 36.5298 175.3462 58 L 4.8778 9.0977 125.6327 53.1477 45.2446 174.9157 59 N 3.9694 8.7436 126.7015 52.7346 39.2032 175.5121 60 I 4.0027 8.0988 121.1328 63.3664 37.4966 177.1299 61 D 4.5692 8.0915 122.1121 56.5925 41.2684 177.5152 62 Q 4.2303 8.4281 117.4452 57.6063 29.2147 175.9900 63 N 5.0353 7.7495 114.6426 50.7673 38.8265 172.3406 64 P 4.5616 0.0000 0.0000 63.6462 32.2800 178.4567 65 G 3.7672 8.5377 108.2090 47.6264 0.0000 175.5592 66 T 3.9245 8.0139 116.8971 66.2987 69.2445 176.6310 67 A 3.7530 8.3519 122.7908 55.1422 18.1575 177.5033 68 P 4.1549 0.0000 0.0000 65.9496 31.1243 178.6709 69 K 3.9604 7.8527 115.6075 58.2034 31.7871 177.2452 70 Y 4.5580 7.6721 115.7178 57.2151 38.1199 175.8246 71 G 3.6127 7.3038 112.9261 41.3052 0.0000 172.4757 72 I 2.9347 7.6892 130.6073 61.7811 35.6084 174.6723 73 R 4.5696 8.3774 121.5402 55.8290 31.2108 172.4117 74 G 4.3322 7.4979 103.4686 45.6019 0.0000 172.4200 75 I 4.8433 7.8856 112.3000 57.8969 40.8161 173.1901 76 P 4.7925 0.0000 0.0000 63.2690 32.9637 174.8606 77 T 4.7971 8.6928 119.1769 61.9245 71.1231 173.1830 78 L 5.2247 8.9366 127.4346 53.2507 43.9084 175.3783 79 L 5.0352 9.0852 125.0138 52.7661 44.5412 175.3892 80 L 4.9624 8.9655 126.8545 53.9178 43.4481 175.2200 81 F 5.2136 9.5953 128.2305 56.9141 42.0420 176.4622 82 K 4.5115 9.2226 125.3601 54.7384 35.6463 176.2891 83 N 3.9933 9.5902 124.8355 53.7289 35.6512 175.2492 84 G 4.0432 8.9647 102.7639 45.9795 0.0000 173.7648 85 E 4.8433 7.8770 114.7122 53.9490 32.7022 174.7268 86 V 3.5257 8.3909 120.3934 62.7693 31.7528 175.2854 87 A 4.5174 8.8772 129.8622 53.6499 20.1325 176.8940 88 A 4.7792 7.5535 114.5321 51.2087 23.0215 175.3651 89 T 5.1650 8.4145 113.5434 60.7436 70.6380 173.1822 90 K 4.5636 8.8205 126.7778 54.4877 36.6805 175.2290 91 V 4.5872 8.4155 122.7588 61.3023 33.8127 174.2185 92 G 4.0225 8.5311 113.3304 43.7112 0.0000 174.5094 93 A 4.3197 8.0510 123.9227 50.4627 17.0355 177.4136 94 L 4.1598 7.6234 121.0378 53.9714 42.9893 178.0722 95 S 4.4630 8.2471 116.0953 57.6259 65.4280 175.0348 96 K 3.9833 8.6669 122.8742 59.6748 31.7564 179.1022 97 G 3.5737 7.9789 105.4830 47.9670 0.0000 175.7079 98 Q 4.0819 8.1011 120.9419 58.2559 28.6451 178.7790 99 L 4.0611 8.2078 123.9297 58.8357 42.2676 179.5078 100 K 4.0709 8.3478 126.2081 60.7698 31.4946 181.2502 101 E 4.2814 8.4307 119.0004 60.8724 29.6004 181.2027 102 F 4.4973 8.4178 121.9521 61.3382 39.3953 177.1161 103 L 3.6254 8.5632 118.8593 57.6201 41.2390 178.7947 104 D 4.4477 8.0690 117.9674 57.8891 41.0075 179.0544 105 A 4.0982 7.8002 119.4738 54.8406 18.4194 178.6822 106 N 4.4841 7.4146 113.0639 54.7354 39.2088 175.9146 107 L 4.2578 8.3541 124.8993 54.9341 41.8905 176.5986 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 3 K 8.31 4.26 0.00 1.86 1.93 0.00 1.53 0.00 0.00 1.70 0.00 0.00 2.94 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.45 1.46 7.81 4 I 7.21 4.24 1.72 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.64 0.78 0.00 0.00 5 I 9.10 4.04 1.79 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.65 0.85 0.00 0.00 6 H 8.66 5.11 0.00 3.08 3.33 0.00 5.70 0.00 0.00 0.00 0.00 6.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 L 8.64 4.58 0.00 1.61 1.72 0.85 0.55 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 8 T 8.49 4.93 4.33 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 1.24 0.00 0.00 9 D 8.90 4.41 0.00 2.71 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 10 D 8.16 4.54 0.00 2.65 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 11 S 8.14 4.52 0.00 4.17 4.12 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 12 F 8.10 3.82 0.00 3.32 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 13 D 8.44 4.44 0.00 2.86 2.72 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 14 T 7.70 3.92 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 1.27 0.00 0.00 15 D 8.35 4.38 0.00 2.57 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 16 V 7.44 3.79 0.78 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 -0.32 0.00 0.00 0.04 0.00 0.00 17 L 7.20 4.18 0.00 1.90 1.75 1.18 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 18 K 7.56 4.49 0.00 1.82 1.76 0.00 1.74 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 3.24 0.00 0.00 0.00 0.00 1.32 1.50 7.81 19 A 7.61 4.10 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 20 D 8.42 4.61 0.00 2.71 2.46 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 0.00 0.00 0.00 0.00 21 G 8.79 3.84 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 0.00 22 A 8.24 4.71 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 23 I 8.79 4.81 1.88 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.89 0.86 0.00 0.00 24 L 9.11 4.91 0.00 1.72 1.54 1.11 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 25 V 9.13 4.63 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 0.48 0.00 0.00 0.89 0.00 0.00 26 D 9.14 5.30 0.00 2.76 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 27 F 9.32 5.24 0.00 3.16 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 28 W 8.90 5.70 0.00 3.44 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 29 A 8.10 4.06 -0.39 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 0.00 0.00 30 E 8.26 4.05 0.00 1.85 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 2.37 2.47 0.00 31 W 7.14 4.63 0.00 3.56 3.18 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 32 C 7.66 4.81 0.00 2.71 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 33 G 8.79 3.70 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 P 0.00 4.34 0.00 2.20 2.13 0.00 3.61 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 2.15 2.21 0.00 35 C 7.93 4.18 0.00 3.24 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 36 K 7.88 3.98 0.00 2.06 2.02 0.00 1.92 0.00 0.00 1.70 0.00 0.00 2.95 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.45 1.35 7.81 37 M 7.53 4.17 0.00 2.04 2.28 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.76 2.54 0.00 38 I 7.66 3.83 1.84 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 1.40 1.58 0.94 0.00 0.00 39 A 7.65 3.78 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 40 P 0.00 4.61 0.00 2.24 2.28 0.00 3.92 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 2.13 1.88 0.00 41 I 7.51 3.94 2.02 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.76 0.89 0.00 0.00 42 L 8.10 3.97 0.00 1.75 1.61 0.79 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 43 D 7.95 4.35 0.00 2.85 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 44 E 7.87 4.07 0.00 2.19 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 2.32 2.55 0.00 45 I 7.81 3.81 1.80 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 1.33 0.57 0.63 0.00 0.00 46 A 7.85 4.03 1.34 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 0.00 0.00 47 D 7.78 4.58 0.00 3.02 2.73 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 48 E 8.28 4.21 0.00 2.18 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 2.37 2.73 0.00 49 Y 8.07 4.47 0.00 3.13 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 50 Q 7.12 4.21 0.00 2.23 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.42 0.00 0.00 0.00 0.00 0.00 2.53 2.31 0.00 51 G 9.26 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 52 K 8.08 4.51 0.00 1.84 1.86 0.00 1.63 0.00 0.00 1.55 0.00 0.00 2.54 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.33 1.29 7.81 53 L 7.69 4.75 0.00 1.67 1.59 0.94 0.70 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 54 T 8.42 4.54 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 1.16 0.00 0.00 55 V 8.34 4.63 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 0.90 0.00 0.00 0.88 0.00 0.00 56 A 9.29 5.23 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 57 K 9.09 5.02 0.00 1.71 1.82 0.00 1.37 0.00 0.00 1.40 0.00 0.00 2.13 0.00 0.00 2.28 0.00 0.00 0.00 0.00 1.33 1.23 7.81 58 L 9.10 4.88 0.00 1.59 1.09 0.98 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 59 N 8.74 3.97 0.00 2.10 2.53 0.00 0.00 6.90 7.87 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 60 I 8.10 4.00 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 1.23 0.65 1.03 0.00 0.00 61 D 8.09 4.57 0.00 2.74 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 62 Q 8.43 4.23 0.00 1.96 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 7.15 0.00 0.00 0.00 0.00 0.00 2.32 2.44 0.00 63 N 7.75 5.04 0.00 2.76 3.03 0.00 0.00 7.03 8.05 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 64 P 0.00 4.56 0.00 2.18 2.17 0.00 3.75 0.00 0.00 3.75 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 65 G 8.54 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 0.00 0.00 0.00 66 T 8.01 3.92 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.42 0.00 0.00 67 A 8.35 3.75 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.15 0.00 2.09 2.09 0.00 3.53 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.17 0.00 69 K 7.85 3.96 0.00 1.23 1.26 0.00 1.44 0.00 0.00 1.52 0.00 0.00 2.98 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.29 1.43 7.81 70 Y 7.67 4.56 0.00 2.72 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 71 G 7.30 3.61 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 0.00 0.00 0.00 72 I 7.69 2.93 1.76 0.00 0.00 0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.22 0.87 0.00 0.00 73 R 8.38 4.57 0.00 1.79 1.78 0.00 3.30 0.00 0.00 3.23 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.15 0.00 74 G 7.50 4.33 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 0.00 75 I 7.89 4.84 1.90 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.77 0.94 0.00 0.00 76 P 0.00 4.79 0.00 2.26 2.27 0.00 3.67 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.00 0.00 77 T 8.69 4.80 4.34 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 1.20 0.00 0.00 78 L 8.94 5.22 0.00 1.56 1.65 0.87 0.76 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 79 L 9.09 5.04 0.00 1.87 1.22 0.90 0.34 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 80 L 8.97 4.96 0.00 1.74 1.60 0.93 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 81 F 9.60 5.21 0.00 3.07 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 82 K 9.22 4.51 0.00 1.39 1.64 0.00 1.94 0.00 0.00 1.65 0.00 0.00 2.76 0.00 0.00 2.70 0.00 0.00 0.00 0.00 1.28 1.29 7.81 83 N 9.59 3.99 0.00 2.91 2.99 0.00 0.00 7.20 7.65 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 84 G 8.96 4.04 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 0.00 0.00 0.00 85 E 7.88 4.84 0.00 2.22 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 2.50 2.23 0.00 86 V 8.39 3.53 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 0.56 0.00 0.00 0.43 0.00 0.00 87 A 8.88 4.52 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 88 A 7.55 4.78 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 89 T 8.41 5.16 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 90 K 8.82 4.56 0.00 0.91 1.22 0.00 1.30 0.00 0.00 0.86 0.00 0.00 2.88 0.00 0.00 2.64 0.00 0.00 0.00 0.00 0.61 1.08 7.81 91 V 8.42 4.59 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 0.84 0.00 0.00 0.90 0.00 0.00 92 G 8.53 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 0.00 0.00 0.00 93 A 8.05 4.32 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.62 4.16 0.00 1.57 1.58 0.84 0.78 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 95 S 8.25 4.46 0.00 4.05 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 96 K 8.67 3.98 0.00 1.84 1.87 0.00 1.93 0.00 0.00 1.84 0.00 0.00 2.96 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.54 1.54 7.81 97 G 7.98 3.57 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 98 Q 8.10 4.08 0.00 2.12 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.77 0.00 0.00 0.00 0.00 0.00 2.38 2.37 0.00 99 L 8.21 4.06 0.00 1.93 1.64 0.89 0.57 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 0.00 100 K 8.35 4.07 0.00 1.80 1.83 0.00 1.86 0.00 0.00 1.68 0.00 0.00 2.90 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.38 1.35 7.81 101 E 8.43 4.28 0.00 1.98 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 2.24 2.18 0.00 102 F 8.42 4.50 0.00 3.12 3.28 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 0.00 103 L 8.56 3.63 0.00 1.53 1.49 0.28 0.88 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 0.00 104 D 8.07 4.45 0.00 2.71 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 0.00 105 A 7.80 4.10 1.41 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 0.00 0.00 106 N 7.41 4.48 0.00 2.29 2.62 0.00 0.00 7.08 9.19 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 0.00 107 L 8.35 4.26 0.00 1.64 1.59 0.87 1.18 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