NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.2119 8.3049 118.1929 53.3265 33.2355 171.7578 2 L 3.3519 7.8987 126.5658 52.9532 40.1723 172.6854 3 T 4.0018 8.7965 114.9240 63.6774 70.4996 174.9562 4 D 4.7364 7.6497 125.4836 50.8104 42.1604 173.7670 5 P 4.3192 0.0000 0.0000 65.5102 31.3463 178.6608 6 I 3.8686 7.6654 117.9615 64.2131 36.9457 178.0422 7 A 3.9440 8.5558 120.7349 55.7459 18.4007 178.3446 8 D 4.1762 8.7726 116.6262 57.6494 40.9892 178.4244 9 M 3.6323 9.6747 116.9749 58.6868 32.7075 178.6213 10 L 3.8165 8.5737 119.5426 58.3288 41.8578 180.1454 11 T 3.8282 8.5590 116.0729 66.5240 68.5017 176.8969 12 R 3.8569 7.8489 119.4980 60.0289 29.9469 178.4339 13 I 3.6564 8.1786 119.6746 63.7413 36.6168 178.1390 14 R 3.7001 8.3197 119.3857 59.8660 28.3728 178.5000 15 N 4.2444 8.8706 116.0031 56.3507 38.5127 177.0286 16 A 4.2285 8.0596 122.4938 55.6670 18.2560 179.8801 17 T 4.0799 8.1653 108.1278 65.1227 68.8668 177.0425 18 R 3.4773 7.1570 119.2967 58.2799 30.1409 178.1376 19 V 4.2352 6.7818 107.9178 59.7476 34.1212 174.1428 20 Y 2.8024 7.7145 116.0303 57.8902 34.4480 168.3893 21 K 4.5131 8.0386 121.5054 54.0780 34.0168 175.0601 22 E 3.7329 8.1278 122.2228 59.2268 30.1150 178.4276 23 S 5.1552 7.2968 113.8495 57.6006 67.2813 172.4999 24 T 4.2615 7.9602 112.2642 63.0934 73.6231 172.9089 25 D 5.6758 8.8359 126.7475 52.0634 42.2518 175.7589 26 V 4.2210 8.1904 124.1053 60.0542 33.2266 174.1717 27 P 3.1615 0.0000 0.0000 62.3653 31.6810 176.0648 28 A 4.0681 8.0851 125.0603 52.2889 19.0936 177.7185 29 S 4.4896 8.3292 115.3160 56.0126 66.1758 175.0907 30 R 3.4837 8.9566 129.0911 59.7569 29.5338 177.9127 31 F 4.5943 8.0474 120.0630 60.7246 39.3857 177.6615 32 K 3.6435 7.7842 117.8820 59.7868 31.3279 178.0150 33 E 3.5066 9.0832 119.1985 58.9263 28.9977 179.4663 34 E 3.9860 8.2359 120.7586 60.0133 30.3455 179.5695 35 I 3.5828 7.8057 120.0293 64.2030 37.0095 178.0897 36 L 3.9398 8.4860 119.7301 58.0039 41.4215 180.5923 37 R 4.6893 8.8577 117.5321 56.2477 30.4108 177.0312 38 I 4.7052 8.8620 117.9068 60.9175 42.7954 177.6874 39 L 4.3070 7.8204 119.4811 57.8458 41.2721 179.3352 40 A 4.1806 8.0557 120.1170 55.1785 18.4434 179.3145 41 R 3.8102 8.1177 115.0204 58.4349 30.2494 176.3102 42 E 4.4494 7.6790 114.7076 55.7816 31.8417 174.9980 43 G 3.4922 8.8454 106.7565 46.4498 0.0000 173.9075 44 F 4.9958 8.8848 114.4627 57.2321 40.4563 177.4372 45 I 4.7139 7.3686 111.5872 59.2573 40.5866 175.9177 46 K 3.7158 8.8449 122.7519 57.1760 32.0181 177.0051 47 G 4.1053 7.4458 106.2282 44.2199 0.0000 172.2865 48 Y 5.7986 7.9352 118.5583 57.3415 40.3844 173.5385 49 E 4.8742 8.7801 118.4693 54.5691 33.7941 174.6705 50 R 4.7393 8.5713 118.0624 55.5433 31.1605 177.4693 51 V 4.2091 8.1984 116.7679 60.0417 33.7822 175.0894 52 D 5.2822 7.7557 133.1842 55.5355 43.3340 177.0009 53 V 4.2697 8.1267 125.1735 61.1960 31.2491 173.4956 54 D 4.2327 8.1834 122.2579 54.8820 36.9458 174.7711 55 G 3.8436 8.3089 104.8782 45.5021 0.0000 171.4012 56 K 4.4712 8.0142 120.0608 53.3117 33.0128 174.1273 57 P 4.7374 0.0000 0.0000 63.5689 31.8423 175.6417 58 Y 4.3984 7.8373 114.9530 57.7845 41.3953 174.1277 59 L 4.8075 9.0349 120.8933 53.4908 45.1265 176.0043 60 R 4.4231 8.3574 123.4931 56.0356 31.2144 176.1917 61 V 4.3965 8.1241 124.4845 60.9698 33.6952 173.3216 62 Y 4.6350 8.3987 126.0351 57.4562 38.7981 176.0668 63 L 4.5527 8.8214 125.7255 54.2057 43.1931 176.0989 64 K 4.6045 7.5927 119.4533 55.4728 35.6010 174.4023 65 Y 5.0060 8.3990 121.8581 56.4357 43.3033 174.4023 66 G 4.1142 8.8867 108.8380 45.6948 0.0000 171.2899 67 P 4.9196 0.0000 0.0000 61.1008 33.6815 175.3625 68 R 4.0680 8.5244 121.4163 57.2053 30.8705 175.4560 69 R 4.7406 8.1968 117.7631 54.3692 34.3281 175.6407 70 Q 4.0284 8.7239 122.2434 56.6756 29.7305 176.1251 71 G 3.7953 8.5192 105.3893 43.7855 0.0000 171.5314 72 P 4.3996 0.0000 0.0000 62.5113 32.8453 175.4990 73 D 4.2914 8.5815 117.1898 55.1275 39.1886 172.5188 74 P 4.6405 0.0000 0.0000 62.8850 31.6439 177.1559 75 R 4.0993 7.6973 118.4070 55.6731 30.5214 174.8055 76 P 4.6944 0.0000 0.0000 61.9463 32.6832 174.9930 77 E 4.4327 8.7218 121.4213 56.3252 31.3840 174.6311 78 Q 5.0388 8.2551 119.7786 54.0926 30.9713 176.5570 79 V 3.7236 8.7809 123.7349 66.1698 31.8050 177.3515 80 I 4.2105 7.3709 123.9676 60.0170 35.5628 175.1223 81 H 4.1900 8.4130 122.2957 58.7541 29.2350 175.2294 82 H 4.0406 7.3222 116.7442 55.1449 33.3564 172.5227 83 I 4.2559 6.6876 117.5512 60.2862 39.1170 171.4151 84 R 4.4923 7.6852 125.9471 53.5107 32.6649 174.9765 85 R 3.9717 8.5396 126.9297 58.4030 30.6752 173.3136 86 I 3.8600 8.3679 127.5220 62.0975 37.0173 177.4554 87 S 3.8733 5.8100 118.8275 58.8889 63.4781 173.8832 88 K 4.7912 8.6973 126.0014 53.8157 34.9538 175.6451 89 P 4.3328 0.0000 0.0000 64.8450 31.6729 177.4936 90 G 3.8672 7.9213 106.1665 46.0331 0.0000 173.9225 91 R 4.4194 7.3141 119.4594 53.9800 30.6111 173.7216 92 R 4.5089 8.1206 120.9877 55.3991 31.0922 176.4199 93 V 4.1257 7.6581 119.7005 61.4038 34.2440 173.9745 94 Y 5.4373 8.1129 124.2688 56.7457 41.7670 175.3187 95 V 4.4777 8.0080 111.3005 60.4159 36.6925 174.5280 96 G 4.0808 9.3454 114.1501 44.8640 0.0000 174.8328 97 V 3.8206 8.3267 119.0812 63.6350 31.1963 177.8215 98 K 4.1880 7.9830 118.5728 58.7078 32.2705 176.8239 99 E 4.4893 8.1403 117.2920 56.5877 29.5506 176.0167 100 I 4.3225 7.5015 119.3755 59.2729 38.5165 174.3418 101 P 4.5412 0.0000 0.0000 62.8578 32.4083 176.7523 102 R 4.5622 7.9907 117.7262 53.4135 30.4239 174.4651 103 V 3.6469 7.8660 118.7614 64.6547 32.1530 175.6456 104 R 3.2264 9.4009 125.0545 56.8598 29.1066 175.6589 105 R 3.6211 8.1624 110.0041 56.5662 27.1063 177.9467 106 G 4.1358 8.3259 108.9314 46.4446 0.0000 174.0613 107 L 4.0451 8.0848 119.4158 57.5443 41.8410 177.7102 108 G 4.2989 7.6381 105.4514 44.7935 0.0000 171.7507 109 I 4.9723 9.2273 118.2967 59.3039 40.6225 175.4237 110 A 5.4907 8.5203 131.4018 48.9349 18.1916 174.6304 111 I 4.1711 7.6939 121.5244 61.4450 38.7543 175.6894 112 L 4.9825 8.8342 126.3099 54.4755 44.1159 175.0708 113 S 4.6914 8.9082 118.4822 58.7635 63.6560 172.7555 114 T 5.1044 8.2676 115.3088 59.9696 71.5464 173.8652 115 S 4.2143 8.9537 116.4993 60.8761 62.7463 174.8711 116 K 4.3154 7.8452 119.8206 54.1871 32.2763 176.4766 117 G 3.9785 8.1743 111.3050 44.8906 0.0000 170.9854 118 V 4.3083 7.9762 119.1856 61.5666 30.3260 175.4214 119 L 4.5751 8.0653 125.7441 53.3381 44.1201 175.6414 120 T 5.0229 7.9326 108.5504 59.5435 73.0657 173.9402 121 D 4.3647 7.9881 121.6866 57.4454 39.0097 179.2238 122 R 4.0746 8.0151 118.8249 58.1633 30.2998 178.1049 123 E 3.9410 8.3984 117.7964 59.7778 29.6228 179.8260 124 A 3.9620 8.6561 120.7597 55.2784 18.4156 179.4367 125 R 3.8203 7.5255 116.8084 59.7712 29.7889 178.2975 126 K 3.9999 8.3526 118.7682 59.4167 32.4341 178.5656 127 L 4.0775 8.2237 119.5230 55.3271 42.6266 176.8837 128 G 3.8421 8.4356 106.3189 45.2392 0.0000 172.2667 129 V 4.5455 7.2118 110.7119 59.8494 36.6441 174.1682 130 G 4.5746 9.3715 108.5338 45.0941 0.0000 171.6903 131 G 4.3416 7.5755 105.4616 44.1899 0.0000 170.9377 132 E 4.8802 8.4531 120.6903 56.0333 30.4374 175.9956 133 L 4.4911 8.5716 130.9206 55.3237 39.7250 176.8445 134 I 3.8688 8.3891 125.1667 63.7344 38.9292 174.9034 135 C 4.9456 7.8136 115.0470 57.9446 33.7734 172.4551 136 E 4.9854 8.3257 115.9134 54.9246 31.7860 174.9885 137 V 4.4933 8.9785 125.5545 60.4112 35.0843 175.4666 138 W 4.4899 8.1612 122.1327 57.5764 28.7170 174.1078 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 4.21 0.00 2.13 2.25 0.00 0.00 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.51 0.00 2 L 7.90 3.35 0.00 1.88 1.75 0.88 0.62 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 3 T 8.80 4.00 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 1.20 0.00 0.00 4 D 7.65 4.74 0.00 2.75 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 5 P 0.00 4.32 0.00 2.18 2.05 0.00 3.67 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.17 0.00 6 I 7.67 3.87 2.12 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.39 0.76 0.00 0.00 7 A 8.56 3.94 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.77 4.18 0.00 2.72 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 9 M 9.67 3.63 0.00 2.21 1.87 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.50 0.00 10 L 8.57 3.82 0.00 1.76 1.60 0.77 0.53 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 11 T 8.56 3.83 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 1.16 0.00 0.00 12 R 7.85 3.86 0.00 2.00 1.99 0.00 3.14 0.00 0.00 3.37 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.87 0.00 13 I 8.18 3.66 1.96 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.67 0.79 0.00 0.00 14 R 8.32 3.70 0.00 1.92 1.96 0.00 2.99 0.00 0.00 3.04 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.54 0.00 15 N 8.87 4.24 0.00 2.79 2.80 0.00 0.00 6.89 8.20 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 16 A 8.06 4.23 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 17 T 8.17 4.08 4.49 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 1.18 0.00 0.00 18 R 7.16 3.48 0.00 1.85 1.96 0.00 3.02 0.00 0.00 3.40 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.66 0.00 19 V 6.78 4.24 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 0.74 0.00 0.00 0.96 0.00 0.00 20 Y 7.71 2.80 0.00 2.82 2.28 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 21 K 8.04 4.51 0.00 1.71 1.75 0.00 1.96 0.00 0.00 1.64 0.00 0.00 2.86 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.41 1.38 7.81 22 E 8.13 3.73 0.00 2.17 1.94 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 2.56 2.64 0.00 23 S 7.30 5.16 0.00 3.38 3.62 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 0.00 0.00 0.00 0.00 24 T 7.96 4.26 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 1.18 0.00 0.00 25 D 8.84 5.68 0.00 2.49 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 26 V 8.19 4.22 2.04 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 0.77 0.00 0.00 0.82 0.00 0.00 27 P 0.00 3.16 0.00 1.75 1.47 0.00 3.53 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 1.79 1.40 0.00 28 A 8.09 4.07 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 29 S 8.33 4.49 0.00 3.82 3.63 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 30 R 8.96 3.48 0.00 1.94 1.99 0.00 3.25 0.00 0.00 3.29 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.76 0.00 31 F 8.05 4.59 0.00 3.03 3.02 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 32 K 7.78 3.64 0.00 1.85 1.65 0.00 1.80 0.00 0.00 1.69 0.00 0.00 2.86 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.37 1.46 7.81 33 E 9.08 3.51 0.00 2.12 1.89 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 2.22 2.31 0.00 34 E 8.24 3.99 0.00 2.24 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 0.00 2.66 2.68 0.00 35 I 7.81 3.58 1.67 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.15 0.70 0.00 0.00 36 L 8.49 3.94 0.00 1.37 1.25 0.56 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 37 R 8.86 4.69 0.00 2.03 2.15 0.00 3.31 0.00 0.00 3.32 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.87 0.00 38 I 8.86 4.71 2.07 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.72 0.98 0.00 0.00 39 L 7.82 4.31 0.00 1.99 1.87 0.80 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 40 A 8.06 4.18 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 41 R 8.12 3.81 0.00 1.87 2.05 0.00 3.22 0.00 0.00 3.34 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.77 0.00 42 E 7.68 4.45 0.00 2.05 1.87 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 2.42 2.46 0.00 43 G 8.85 3.49 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 0.00 0.00 0.00 44 F 8.88 5.00 0.00 2.97 2.96 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 45 I 7.37 4.71 2.17 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.88 0.94 0.00 0.00 46 K 8.84 3.72 0.00 1.93 1.92 0.00 1.75 0.00 0.00 1.70 0.00 0.00 2.78 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.49 1.57 7.81 47 G 7.45 4.11 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 0.00 0.00 0.00 48 Y 7.94 5.80 0.00 3.08 2.94 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 49 E 8.78 4.87 0.00 2.08 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 0.00 2.59 2.46 0.00 50 R 8.57 4.74 0.00 1.79 1.97 0.00 3.24 0.00 0.00 3.28 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.78 0.00 51 V 8.20 4.21 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 0.72 0.00 0.00 1.02 0.00 0.00 52 D 7.76 5.28 0.00 2.73 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 53 V 8.13 4.27 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 0.78 0.00 0.00 0.63 0.00 0.00 54 D 8.18 4.23 0.00 2.91 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 55 G 8.31 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 56 K 8.01 4.47 0.00 1.94 1.86 0.00 1.75 0.00 0.00 1.76 0.00 0.00 3.08 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.38 1.62 7.81 57 P 0.00 4.74 0.00 2.18 2.09 0.00 3.83 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.00 0.00 58 Y 7.84 4.40 0.00 2.89 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 59 L 9.03 4.81 0.00 1.55 1.55 0.74 1.14 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 60 R 8.36 4.42 0.00 1.81 1.27 0.00 3.23 0.00 0.00 3.01 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.59 0.00 61 V 8.12 4.40 2.20 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 1.03 0.00 0.00 0.99 0.00 0.00 62 Y 8.40 4.64 0.00 2.93 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 63 L 8.82 4.55 0.00 1.47 1.00 0.85 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 64 K 7.59 4.60 0.00 1.65 1.66 0.00 1.71 0.00 0.00 1.69 0.00 0.00 2.90 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.30 1.46 7.81 65 Y 8.40 5.01 0.00 3.05 3.16 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 0.00 0.00 0.00 0.00 66 G 8.89 4.11 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 0.00 0.00 0.00 67 P 0.00 4.92 0.00 2.13 2.19 0.00 3.77 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 2.04 1.98 0.00 68 R 8.52 4.07 0.00 1.80 1.89 0.00 3.14 0.00 0.00 3.19 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.70 0.00 69 R 8.20 4.74 0.00 1.78 1.73 0.00 3.20 0.00 0.00 3.51 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.74 0.00 70 Q 8.72 4.03 0.00 2.04 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.50 0.00 0.00 0.00 0.00 0.00 2.36 2.30 0.00 71 G 8.52 3.80 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 0.00 0.00 0.00 72 P 0.00 4.40 0.00 2.06 1.98 0.00 3.83 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.06 0.00 73 D 8.58 4.29 0.00 2.81 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 74 P 0.00 4.64 0.00 2.21 2.22 0.00 3.89 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 2.02 1.91 0.00 75 R 7.70 4.10 0.00 1.75 1.59 0.00 3.20 0.00 0.00 3.30 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.85 0.00 76 P 0.00 4.69 0.00 2.14 2.03 0.00 2.40 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 1.17 1.30 0.00 77 E 8.72 4.43 0.00 2.20 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 2.50 2.47 0.00 78 Q 8.26 5.04 0.00 1.86 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.00 6.83 0.00 0.00 0.00 0.00 0.00 2.46 2.29 0.00 79 V 8.78 3.72 2.26 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 1.02 0.00 0.00 0.96 0.00 0.00 80 I 7.37 4.21 1.75 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.75 0.65 0.00 0.00 81 H 8.41 4.19 0.00 3.08 3.33 0.00 5.93 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 H 7.32 4.04 0.00 1.78 1.31 0.00 5.82 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 83 I 6.69 4.26 1.48 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.42 0.64 0.00 0.00 84 R 7.69 4.49 0.00 1.68 1.74 0.00 3.16 0.00 0.00 3.11 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.48 0.00 85 R 8.54 3.97 0.00 1.80 1.77 0.00 3.31 0.00 0.00 3.20 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.78 0.00 86 I 8.37 3.86 2.11 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 1.12 0.99 0.90 0.00 0.00 87 S 5.81 3.87 0.00 3.96 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 88 K 8.70 4.79 0.00 1.81 1.64 0.00 1.70 0.00 0.00 1.67 0.00 0.00 2.92 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.65 1.46 7.81 89 P 0.00 4.33 0.00 2.17 2.18 0.00 3.73 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.95 0.00 90 G 7.92 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 91 R 7.31 4.42 0.00 1.76 1.71 0.00 3.15 0.00 0.00 3.28 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.61 0.00 92 R 8.12 4.51 0.00 1.42 1.47 0.00 3.58 0.00 0.00 3.83 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.61 0.00 93 V 7.66 4.13 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 0.96 0.00 0.00 0.87 0.00 0.00 94 Y 8.11 5.44 0.00 2.93 2.81 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 95 V 8.01 4.48 2.20 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 0.90 0.00 0.00 1.03 0.00 0.00 96 G 9.35 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 97 V 8.33 3.82 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 0.95 0.00 0.00 0.92 0.00 0.00 98 K 7.98 4.19 0.00 1.78 1.91 0.00 1.75 0.00 0.00 1.71 0.00 0.00 3.01 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.44 1.46 7.81 99 E 8.14 4.49 0.00 1.97 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 2.33 2.37 0.00 100 I 7.50 4.32 1.89 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.71 0.94 0.00 0.00 101 P 0.00 4.54 0.00 2.07 2.01 0.00 3.64 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 2.05 2.12 0.00 102 R 7.99 4.56 0.00 1.85 1.81 0.00 3.20 0.00 0.00 3.26 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.63 0.00 103 V 7.87 3.65 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 1.12 0.00 0.00 1.10 0.00 0.00 104 R 9.40 3.23 0.00 1.32 1.78 0.00 2.69 0.00 0.00 2.25 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 1.23 0.00 105 R 8.16 3.62 0.00 1.98 1.93 0.00 3.40 0.00 0.00 3.13 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.64 0.00 106 G 8.33 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 0.00 107 L 8.08 4.05 0.00 1.58 1.78 0.86 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 108 G 7.64 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 0.00 109 I 9.23 4.97 2.07 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 1.80 1.33 0.00 0.00 110 A 8.52 5.49 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 0.00 111 I 7.69 4.17 1.85 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 1.43 0.57 0.90 0.00 0.00 112 L 8.83 4.98 0.00 1.89 1.77 0.98 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 113 S 8.91 4.69 0.00 4.20 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 0.00 114 T 8.27 5.10 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 1.32 0.00 0.00 115 S 8.95 4.21 0.00 3.98 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 0.00 116 K 7.85 4.32 0.00 1.70 1.75 0.00 1.78 0.00 0.00 1.71 0.00 0.00 3.01 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.36 1.35 7.81 117 G 8.17 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 0.00 118 V 7.98 4.31 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 0.92 0.00 0.00 1.16 0.00 0.00 119 L 8.07 4.58 0.00 1.83 1.70 0.95 0.53 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 0.00 120 T 7.93 5.02 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 1.27 0.00 0.00 121 D 7.99 4.36 0.00 3.08 3.06 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 0.00 122 R 8.02 4.07 0.00 1.91 1.98 0.00 3.18 0.00 0.00 3.35 7.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.74 0.00 123 E 8.40 3.94 0.00 2.17 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 2.40 0.00 124 A 8.66 3.96 1.35 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 0.00 125 R 7.53 3.82 0.00 2.24 2.11 0.00 3.11 0.00 0.00 3.10 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.67 0.00 126 K 8.35 4.00 0.00 1.86 2.01 0.00 1.88 0.00 0.00 1.72 0.00 0.00 3.05 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.46 1.49 7.81 127 L 8.22 4.08 0.00 1.76 1.74 0.93 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 128 G 8.44 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 0.00 129 V 7.21 4.55 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 0.98 0.00 0.00 0.95 0.00 0.00 130 G 9.37 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 0.00 131 G 7.58 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 0.00 0.00 0.00 0.00 132 E 8.45 4.88 0.00 2.47 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 2.39 2.10 0.00 133 L 8.57 4.49 0.00 1.76 1.56 0.94 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 134 I 8.39 3.87 2.08 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.01 0.91 0.00 0.00 135 C 7.81 4.95 0.00 3.06 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 0.00 136 E 8.33 4.99 0.00 2.17 2.14 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 2.41 2.37 0.00 137 V 8.98 4.49 1.69 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 0.09 0.00 0.00 0.75 0.00 0.00 138 W 8.16 4.49 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