NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4250 8.3044 120.3555 54.5798 33.4377 174.3491 2 F 4.2350 8.5955 123.4729 58.8336 39.8417 173.0210 3 A 4.2373 8.5915 124.8976 51.1311 23.9147 174.4376 4 I 5.2739 8.1939 123.7694 59.0182 39.1564 175.5556 5 V 4.5667 8.3238 126.5438 59.9855 34.7845 175.0532 6 K 5.5734 8.4509 121.6299 54.0300 33.8226 174.7431 7 T 4.5944 8.3957 120.3111 61.1101 70.4772 174.8580 8 G 4.0301 8.6185 115.3126 44.9460 0.0000 174.0530 9 G 4.0666 8.3142 106.0735 44.8990 0.0000 172.8105 10 K 4.8018 7.8093 117.4763 54.5750 36.2694 174.6981 11 Q 5.1542 8.1870 117.6823 55.2342 32.9896 174.2541 12 Y 4.7457 9.2946 118.0003 56.8223 43.2696 174.1862 13 R 4.6259 8.7657 119.7904 55.0242 31.0708 174.6475 14 V 4.3278 9.0755 119.6774 59.9609 33.9912 174.7801 15 E 5.1214 8.4762 123.7286 53.3940 33.8697 172.7437 16 P 4.4547 0.0000 0.0000 63.6452 32.1015 176.9340 17 G 3.9261 8.8788 110.1571 45.1434 0.0000 173.2537 18 L 4.2329 7.3299 122.8047 54.5398 43.2128 175.9152 19 K 4.5988 8.6937 126.5196 56.3628 33.3980 175.6911 20 L 4.5688 8.6007 128.1134 52.9668 44.4860 174.9349 21 R 4.8071 8.5092 127.1982 55.1817 30.8820 175.1993 22 V 4.6653 8.8460 125.8483 59.0936 35.3777 174.4056 23 E 4.4534 9.0167 121.6330 56.4571 30.2409 175.9172 24 K 4.8184 8.4842 124.3337 55.7298 32.9538 176.2104 25 L 4.7472 8.4790 127.2782 53.3363 44.4037 176.1332 26 D 4.8176 8.3029 118.0636 52.4290 40.1600 174.4865 27 A 4.6891 7.7038 123.8461 49.9830 22.6406 176.3178 28 E 4.3562 8.5332 120.3346 55.2564 30.4483 176.5062 29 P 4.6398 0.0000 0.0000 63.6873 30.9229 176.8691 30 G 3.8334 8.1850 106.3342 47.1106 0.0000 174.3397 31 A 4.0137 7.5339 123.5682 51.5696 19.6326 176.5008 32 T 5.1109 7.8759 114.2035 61.2305 67.7407 174.3594 33 V 3.6231 7.6910 123.0560 63.7134 33.0265 174.9905 34 E 5.5024 8.9578 127.0124 53.6894 32.4917 174.9707 35 L 4.6098 8.1453 122.2990 52.8861 42.6128 174.2681 36 P 4.6300 0.0000 0.0000 62.3117 28.6598 175.9841 37 V 4.1968 7.1233 126.7864 59.6812 35.7784 177.7710 38 L 3.6022 8.7282 123.8970 56.4637 37.3892 174.1773 39 L 4.5770 8.3720 118.8565 54.3730 42.8919 176.5104 40 L 4.5203 7.3267 118.0927 53.6185 45.4974 174.6634 41 G 4.4224 8.3287 111.3979 43.2707 0.0000 173.8729 42 G 3.9010 8.6760 107.5346 48.8627 0.0000 174.9896 43 E 4.2423 8.0675 120.4843 56.2050 28.4745 175.7433 44 K 3.4412 8.5917 118.2525 59.0370 34.1752 175.0091 45 T 3.3856 8.5406 102.3106 63.9021 68.8286 174.0544 46 V 3.9260 9.6896 117.3346 62.4788 30.8818 176.9752 47 V 3.8151 7.6592 122.3283 62.3510 29.1727 174.9728 48 G 3.8852 8.0697 116.4915 45.5885 0.0000 169.5802 49 T 3.8708 9.0430 115.3214 65.6286 67.4347 173.6749 50 P 4.3205 0.0000 0.0000 65.7736 32.0735 176.1118 51 V 4.5215 7.2929 115.0329 60.7816 35.2294 174.2074 52 V 4.0509 8.0169 123.9125 61.6169 31.9098 175.4903 53 E 3.2780 8.9367 127.0521 58.6754 29.2423 175.2350 54 G 3.7443 8.3418 115.0309 44.5132 0.0000 172.8763 55 A 3.8391 6.7218 121.2154 46.1842 20.4478 176.4785 56 S 4.6767 8.7246 115.5069 57.4527 67.5335 172.9635 57 V 4.5962 8.2705 118.8975 61.0079 34.8163 174.1369 58 V 4.4363 8.3805 126.5668 61.3928 32.9092 174.0269 59 A 5.1791 8.5892 129.4942 50.0996 22.1191 174.7764 60 E 4.2073 8.7973 120.1167 55.1230 30.8499 177.0003 61 V 3.2438 8.3102 123.3692 62.2980 30.9414 179.5996 62 L 3.6305 8.0826 125.2278 55.1688 41.3380 178.4775 63 G 3.9740 7.6808 103.2247 46.3825 0.0000 171.5134 64 H 4.9585 7.8058 119.2954 56.1486 32.0095 172.9725 65 G 4.2927 9.2423 115.2967 45.6665 0.0000 171.8172 66 R 4.5421 8.6841 117.8063 55.8580 30.1116 177.6917 67 G 4.1903 8.4548 115.0313 45.8638 0.0000 173.2100 68 K 4.4383 8.5182 122.6949 54.1656 33.5780 176.2663 69 K 3.8346 8.6863 124.8259 57.3301 32.3021 176.3408 70 I 3.9967 8.4158 126.1532 60.7410 36.9524 174.6973 71 L 3.5065 6.6496 123.2682 54.3156 41.7185 174.6559 72 V 3.1804 6.6455 114.3261 60.3643 31.1689 174.2812 73 S 4.9391 8.2993 121.6666 56.7372 66.3324 172.4877 74 K 4.8393 8.5021 120.3184 54.6812 35.4601 174.3530 75 F 5.1629 8.7173 125.2014 56.5134 42.4157 173.6592 76 K 4.4033 7.7854 125.1217 53.9459 34.1949 175.6531 77 A 3.8770 8.4580 127.2467 53.1902 19.3230 177.3197 78 K 3.8790 8.6092 121.4633 57.1335 31.5100 174.1923 79 V 4.3828 7.2055 111.4063 64.4761 39.4783 173.5539 80 Q 4.0128 6.2209 113.2879 53.4120 30.3454 171.7707 81 Y 5.0953 6.4552 117.4794 55.2273 41.2185 174.8157 82 R 4.6983 8.3089 118.5204 54.5974 32.5608 175.5315 83 R 4.1702 8.1434 121.0403 52.8373 30.7731 173.6560 84 K 3.4930 7.7069 123.6853 57.6245 33.2650 174.2124 85 K 4.6167 7.2263 125.8670 52.7669 36.3296 174.5905 86 G 3.9182 8.3127 107.9624 44.2243 0.0000 174.0802 87 H 3.8426 7.8674 110.3457 55.0790 27.6929 173.9412 88 R 4.1470 8.2129 127.6927 54.8633 30.4887 176.1804 89 Q 3.9063 8.1408 126.2904 55.2302 30.5179 173.2724 90 P 4.6379 0.0000 0.0000 62.5707 32.1849 175.1640 91 Y 5.1645 8.7513 122.3453 56.5446 41.2768 174.7369 92 T 4.8952 9.5346 120.9313 61.7858 71.5486 173.0540 93 E 4.9300 8.8772 126.8410 54.6890 31.7832 175.0221 94 L 5.1597 8.7971 127.3750 53.2218 45.2634 175.7828 95 L 5.0010 8.2300 121.4167 53.0763 44.5666 175.2992 96 I 3.8270 7.9166 127.1572 61.6837 38.1021 176.5810 97 K 4.4606 8.4475 127.3017 54.9735 32.0691 175.2503 98 E 5.1192 8.9502 129.2134 54.3085 30.0089 174.0457 99 I 3.1175 8.6218 132.2405 60.7861 34.5689 172.3070 100 R 4.5810 8.7206 120.7018 53.9960 31.9440 176.3705 101 G 3.7115 8.7117 110.4533 45.5347 0.0000 172.3391 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 4.42 0.00 2.04 2.08 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 2.55 2.66 0.00 2 F 8.60 4.23 0.00 3.05 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 3 A 8.59 4.24 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 4 I 8.19 5.27 1.71 0.00 0.00 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.61 0.87 0.00 0.00 5 V 8.32 4.57 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 0.94 0.00 0.00 6 K 8.45 5.57 0.00 1.75 1.73 0.00 1.55 0.00 0.00 2.30 0.00 0.00 2.92 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.34 1.44 7.81 7 T 8.40 4.59 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 1.18 0.00 0.00 8 G 8.62 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 0.00 0.00 0.00 9 G 8.31 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 10 K 7.81 4.80 0.00 1.67 1.46 0.00 1.56 0.00 0.00 1.73 0.00 0.00 3.06 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.27 1.39 7.81 11 Q 8.19 5.15 0.00 1.80 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.76 0.00 0.00 0.00 0.00 0.00 2.25 2.33 0.00 12 Y 9.29 4.75 0.00 2.70 2.84 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 13 R 8.77 4.63 0.00 1.85 1.90 0.00 3.39 0.00 0.00 3.35 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.84 0.00 14 V 9.08 4.33 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 0.66 0.00 0.00 0.93 0.00 0.00 15 E 8.48 5.12 0.00 2.08 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 2.30 2.38 0.00 16 P 0.00 4.45 0.00 2.22 2.03 0.00 3.86 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.97 0.00 17 G 8.88 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 0.00 0.00 0.00 18 L 7.33 4.23 0.00 1.88 1.68 0.94 0.40 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 19 K 8.69 4.60 0.00 1.75 1.81 0.00 1.46 0.00 0.00 1.61 0.00 0.00 2.94 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.37 1.48 7.81 20 L 8.60 4.57 0.00 1.67 1.37 0.91 -0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 21 R 8.51 4.81 0.00 1.71 1.60 0.00 3.07 0.00 0.00 2.87 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 1.51 0.00 22 V 8.85 4.67 1.75 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 0.69 0.00 0.00 0.92 0.00 0.00 23 E 9.02 4.45 0.00 2.11 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 2.36 2.44 0.00 24 K 8.48 4.82 0.00 1.86 1.73 0.00 1.50 0.00 0.00 2.34 0.00 0.00 2.88 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.47 1.52 7.81 25 L 8.48 4.75 0.00 1.64 1.60 0.90 1.03 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 26 D 8.30 4.82 0.00 2.62 2.58 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 27 A 7.70 4.69 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 8.53 4.36 0.00 2.10 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 2.40 2.40 0.00 29 P 0.00 4.64 0.00 2.05 2.22 0.00 3.64 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 2.05 2.12 0.00 30 G 8.18 3.83 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 0.00 0.00 0.00 31 A 7.53 4.01 1.27 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 32 T 7.88 5.11 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 33 V 7.69 3.62 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 0.92 0.00 0.00 0.91 0.00 0.00 34 E 8.96 5.50 0.00 1.98 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 2.18 2.22 0.00 35 L 8.15 4.61 0.00 1.61 1.59 0.92 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 36 P 0.00 4.63 0.00 2.09 2.16 0.00 3.70 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 2.00 2.02 0.00 37 V 7.12 4.20 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 0.81 0.00 0.00 1.02 0.00 0.00 38 L 8.73 3.60 0.00 1.84 1.66 0.91 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 39 L 8.37 4.58 0.00 1.74 1.66 0.96 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 40 L 7.33 4.52 0.00 1.45 1.37 0.94 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 41 G 8.33 4.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.68 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 0.00 0.00 0.00 43 E 8.07 4.24 0.00 2.00 1.96 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 2.32 2.26 0.00 44 K 8.59 3.44 0.00 2.04 2.02 0.00 1.66 0.00 0.00 1.88 0.00 0.00 2.94 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.44 1.43 7.81 45 T 8.54 3.39 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 46 V 9.69 3.93 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 0.81 0.00 0.00 0.94 0.00 0.00 47 V 7.66 3.82 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 0.73 0.00 0.00 0.94 0.00 0.00 48 G 8.07 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 49 T 9.04 3.87 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 1.21 0.00 0.00 50 P 0.00 4.32 0.00 2.04 2.10 0.00 3.61 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 2.07 0.00 51 V 7.29 4.52 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 0.81 0.00 0.00 0.93 0.00 0.00 52 V 8.02 4.05 2.17 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 0.80 0.00 0.00 0.98 0.00 0.00 53 E 8.94 3.28 0.00 1.88 1.93 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 2.33 2.31 0.00 54 G 8.34 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 0.00 0.00 0.00 55 A 6.72 3.84 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 8.72 4.68 0.00 3.86 3.92 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 57 V 8.27 4.60 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 0.94 0.00 0.00 0.90 0.00 0.00 58 V 8.38 4.44 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 0.96 0.00 0.00 0.92 0.00 0.00 59 A 8.59 5.18 1.11 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 60 E 8.80 4.21 0.00 1.90 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 2.26 2.23 0.00 61 V 8.31 3.24 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 0.69 0.00 0.00 0.98 0.00 0.00 62 L 8.08 3.63 0.00 1.87 1.09 0.91 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 63 G 7.68 3.97 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 0.00 0.00 0.00 64 H 7.81 4.96 0.00 3.12 3.15 0.00 5.85 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 G 9.24 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 0.00 0.00 0.00 0.00 66 R 8.68 4.54 0.00 1.78 1.89 0.00 3.00 0.00 0.00 3.21 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.63 0.00 67 G 8.45 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 68 K 8.52 4.44 0.00 1.80 1.78 0.00 1.81 0.00 0.00 1.65 0.00 0.00 2.97 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.41 1.37 7.81 69 K 8.69 3.83 0.00 1.71 1.75 0.00 1.77 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.46 1.52 7.81 70 I 8.42 4.00 2.02 0.00 0.00 0.91 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 0.72 0.94 0.00 0.00 71 L 6.65 3.51 0.00 1.89 1.64 0.93 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 0.00 0.00 0.00 0.00 0.00 0.00 72 V 6.65 3.18 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 0.87 0.00 0.00 1.06 0.00 0.00 73 S 8.30 4.94 0.00 4.13 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 74 K 8.50 4.84 0.00 1.86 1.71 0.00 1.61 0.00 0.00 1.61 0.00 0.00 2.84 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.39 1.41 7.81 75 F 8.72 5.16 0.00 2.94 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 76 K 7.79 4.40 0.00 1.90 1.57 0.00 1.81 0.00 0.00 1.57 0.00 0.00 3.00 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.31 1.36 7.81 77 A 8.46 3.88 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 78 K 8.61 3.88 0.00 1.98 1.93 0.00 1.63 0.00 0.00 1.72 0.00 0.00 3.00 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.33 1.43 7.81 79 V 7.21 4.38 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 0.63 0.00 0.00 0.89 0.00 0.00 80 Q 6.22 4.01 0.00 2.04 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.00 6.67 0.00 0.00 0.00 0.00 0.00 1.95 1.69 0.00 81 Y 6.46 5.10 0.00 3.15 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 82 R 8.31 4.70 0.00 1.96 1.86 0.00 3.17 0.00 0.00 3.18 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 83 R 8.14 4.17 0.00 1.82 1.83 0.00 3.53 0.00 0.00 3.23 7.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.72 0.00 84 K 7.71 3.49 0.00 1.86 1.79 0.00 1.81 0.00 0.00 1.64 0.00 0.00 2.96 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.34 1.41 7.81 85 K 7.23 4.62 0.00 1.78 1.72 0.00 1.68 0.00 0.00 1.72 0.00 0.00 3.13 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.43 1.84 7.81 86 G 8.31 3.92 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 0.00 0.00 0.00 87 H 7.87 3.84 0.00 3.36 3.68 0.00 5.52 0.00 0.00 0.00 0.00 6.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 R 8.21 4.15 0.00 1.65 1.86 0.00 3.35 0.00 0.00 3.17 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.59 0.00 89 Q 8.14 3.91 0.00 1.99 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.68 7.11 0.00 0.00 0.00 0.00 0.00 2.00 2.11 0.00 90 P 0.00 4.64 0.00 1.91 1.92 0.00 3.54 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.03 0.00 91 Y 8.75 5.16 0.00 3.11 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 92 T 9.53 4.90 4.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 93 E 8.88 4.93 0.00 2.01 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 2.17 2.21 0.00 94 L 8.80 5.16 0.00 1.49 1.48 0.84 0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 95 L 8.23 5.00 0.00 1.58 1.47 0.91 1.38 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 7.92 3.83 1.98 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 1.06 0.66 0.91 0.00 0.00 97 K 8.45 4.46 0.00 1.65 1.65 0.00 2.24 0.00 0.00 1.58 0.00 0.00 2.87 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.35 1.38 7.81 98 E 8.95 5.12 0.00 2.01 1.72 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 2.04 2.01 0.00 99 I 8.62 3.12 1.87 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 1.46 0.38 0.90 0.00 0.00 100 R 8.72 4.58 0.00 1.95 2.08 0.00 2.70 0.00 0.00 3.64 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.53 0.00 101 G 8.71 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