NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9156 8.3549 109.7331 44.5827 0.0000 172.4897 2 S 4.2296 8.0878 118.6231 58.3202 66.9621 170.8203 3 S 3.8312 8.8370 123.9441 57.7883 64.2334 173.4866 4 G 4.1121 8.1920 118.7623 45.0059 0.0000 176.7219 5 S 4.2941 8.3625 122.0013 58.3042 63.1086 174.7133 6 S 4.4024 8.0511 121.8296 57.9391 64.6642 174.2011 7 G 3.7939 8.0806 110.9475 43.5733 0.0000 171.2627 8 S 4.3772 8.2134 115.7767 58.0481 63.6104 174.5256 9 T 3.8478 8.1205 119.0573 66.3981 68.3929 173.9257 10 M 4.2063 7.2466 118.8117 54.1276 35.0300 173.7661 11 S 4.7145 6.7529 118.2759 58.1618 64.2773 174.1828 12 G 3.6124 7.2013 112.9011 44.4259 0.0000 171.5986 13 Y 4.6886 8.7180 119.5512 58.4220 38.9057 175.4755 14 L 4.5295 9.1253 122.1808 53.4240 47.4657 174.3968 15 Y 5.4389 7.8269 116.7744 56.6890 40.5267 175.5365 16 R 4.9551 9.0838 125.4808 55.0838 31.5927 175.2841 17 S 4.5725 7.9316 119.0042 57.1488 67.5959 174.3910 18 K 4.3260 9.2783 120.0998 55.4218 32.1042 176.6351 19 G 3.7367 7.3333 105.8227 43.7073 0.0000 173.9554 20 S 4.1209 8.1753 115.3829 59.2696 63.4752 175.6693 21 K 4.0553 8.5119 120.9627 56.4725 29.6209 176.5412 22 K 4.3337 6.7578 117.0107 53.8145 33.6115 174.5370 23 P 4.2581 0.0000 0.0000 62.3254 32.0176 176.4109 24 W 4.6969 8.3232 121.3739 56.5884 30.5465 175.8862 25 K 4.6094 9.0773 119.7961 55.0535 35.3574 175.5129 26 H 5.2974 9.2626 126.4126 56.0142 30.2268 174.0405 27 L 4.9758 9.0056 124.7071 53.0568 46.8854 174.9756 28 W 4.9485 8.2951 130.2724 56.0369 32.6499 174.9180 29 F 5.5830 7.3666 122.2499 56.1425 43.2016 173.8450 30 V 4.8918 8.7761 118.6948 61.9188 35.6110 173.4137 31 I 4.7652 8.0880 126.6151 59.5664 38.7131 175.2548 32 K 4.5456 8.8917 127.9901 55.7890 35.2118 175.3703 33 N 4.2624 9.9012 121.4993 54.3502 37.6154 173.7311 34 K 3.9173 8.1449 111.6773 56.9448 29.5585 175.2224 35 V 4.3890 8.4571 118.6826 60.8172 34.0908 174.2562 36 L 4.9970 8.7998 129.7387 54.3238 41.8255 174.9717 37 Y 4.7643 8.8992 124.3613 57.6730 39.7674 174.7849 38 T 4.5223 9.1802 119.5884 62.5962 71.5903 173.6172 39 Y 4.7755 8.4485 120.6258 57.4733 42.4227 174.6434 40 A 4.4016 9.0881 118.6186 53.5854 21.6752 176.3903 41 A 4.8889 7.5870 116.7827 49.9466 22.2591 176.6432 42 S 2.7900 7.9092 115.6548 60.6494 62.4847 175.2892 43 E 4.3283 7.4078 118.6942 55.9357 29.5229 175.6942 44 D 4.6136 7.3269 117.5231 53.4999 40.4388 176.3266 45 V 4.1479 7.9601 111.1666 61.9696 33.1309 176.2449 46 A 4.5270 7.0910 119.1996 50.7965 22.2281 175.8879 47 A 3.6562 8.4814 124.3412 51.9607 19.1218 178.0650 48 L 4.2381 8.3686 123.0626 57.7499 42.2907 177.1073 49 E 4.9386 7.7951 115.9132 55.1742 34.6700 174.4208 50 S 4.8073 8.4204 114.7640 57.0382 66.0968 173.5512 51 Q 4.5599 8.5515 122.5600 53.3893 32.6120 172.7608 52 P 4.5667 0.0000 0.0000 62.0808 32.8429 175.9539 53 L 4.3921 8.3709 120.9828 55.0160 42.1439 176.7200 54 L 4.3194 8.1028 122.3250 57.3494 41.4662 175.4360 55 G 3.9945 8.9360 115.5683 45.2393 0.0000 172.1840 56 F 4.4365 7.9115 117.1772 58.0712 40.3128 173.8106 57 T 4.8661 9.7346 116.4520 63.0802 73.4025 173.1885 58 V 5.0493 8.0438 120.9102 62.4469 34.9884 173.5183 59 T 4.5305 8.3149 116.9288 61.0483 71.2097 172.2066 60 L 4.7793 8.6878 128.7970 54.8917 43.0877 176.1881 61 V 4.6292 8.0300 124.5913 59.6708 33.7814 175.7336 62 K 3.8861 9.0235 123.3512 59.9358 32.5141 177.1984 63 D 4.3957 7.9310 119.6817 53.0095 41.4371 172.0342 64 E 4.4519 8.5767 119.7943 57.6110 31.1407 176.5361 65 N 4.4137 8.5808 115.8817 56.2438 39.1326 174.3803 66 S 4.8823 7.7633 111.4945 56.6760 65.8063 173.3867 67 E 4.6757 8.3567 116.9700 56.9405 31.0908 177.3219 68 S 4.6103 7.6536 112.3199 57.3041 62.6412 174.4636 69 K 5.4033 8.6396 115.5891 54.6267 34.1473 176.0144 70 V 4.9998 7.7841 120.2680 59.9099 34.9852 174.4012 71 F 5.3343 8.9545 118.3303 55.2026 41.8513 173.3158 72 Q 4.9758 9.1725 116.3210 54.1352 32.6163 175.1636 73 L 4.8035 9.4859 126.0296 53.9556 42.7752 175.4558 74 L 4.5838 8.8160 127.2501 54.6784 43.8795 176.1767 75 H 4.5630 9.7848 122.6573 55.6285 31.4978 174.0057 76 K 4.0119 8.1974 123.9432 55.5491 29.9460 176.2324 77 G 3.4678 6.5856 108.7333 45.2298 0.0000 174.0968 78 M 4.4111 7.7152 118.4857 53.3986 32.8700 175.5482 79 V 4.2735 8.2104 121.5595 63.2220 32.2600 175.2306 80 F 4.6065 9.9110 130.9536 60.7373 40.1834 175.1307 81 Y 4.6416 7.5189 112.4754 57.2402 42.1571 173.8978 82 V 4.4861 9.0354 122.3172 62.2336 34.2237 174.8591 83 F 5.4761 8.6150 122.1061 56.3957 43.4718 173.1554 84 K 4.7001 8.5546 124.4883 54.5282 34.3369 174.6718 85 A 4.5875 9.2079 129.6325 50.4107 20.9019 175.4659 86 D 4.0180 9.1511 115.4973 57.1747 41.6770 179.1530 87 D 5.0781 7.7011 118.2350 52.3587 44.8864 177.0469 88 A 4.0487 8.6253 120.3326 56.0100 18.3885 179.1546 89 H 3.9647 8.3846 114.3118 59.3806 28.6993 177.6444 90 S 4.1646 8.2729 115.8818 62.1233 62.7702 176.4559 91 T 4.0636 8.0712 118.0980 67.1859 68.2382 175.9273 92 Q 3.9668 8.2321 119.4253 59.3437 28.7229 179.5755 93 R 3.8277 7.6920 118.0587 59.1776 30.0887 178.9439 94 W 3.9248 8.2584 118.5937 60.5062 29.0034 177.8964 95 I 3.5727 8.4449 120.2852 64.6886 36.3410 177.4789 96 D 4.2576 9.2310 118.8072 57.7341 40.8532 179.0272 97 A 3.6374 8.6651 122.2690 55.0202 17.8178 179.4410 98 F 4.4227 8.6909 116.3185 59.9718 38.9896 178.4174 99 Q 4.1243 8.6516 118.5454 58.9319 28.5168 177.7609 100 E 4.3744 8.7926 117.3774 57.4748 29.5653 178.7805 101 G 3.8008 7.2676 107.0158 47.6637 0.0000 176.0050 102 T 4.8875 7.4317 111.5314 65.0105 69.3520 175.0449 103 V 4.2183 7.5153 114.0738 60.5378 33.7764 176.5358 104 S 4.4895 8.4860 117.2712 58.6809 63.6449 175.6438 105 G 4.0089 8.3119 103.3805 44.6541 0.0000 171.8860 106 P 4.5493 0.0000 0.0000 61.5984 32.5983 175.7289 107 S 4.4155 8.3671 115.0668 58.1282 63.1641 174.2507 108 S 4.5852 8.0943 119.0796 57.1871 65.9817 174.1537 109 G 4.3178 8.7942 109.9281 46.3129 0.0000 173.1581 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 8.35 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 2 S 8.09 4.23 0.00 3.88 3.72 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 3 S 8.84 3.83 0.00 3.98 3.82 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 4 G 8.19 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 5 S 8.36 4.29 0.00 3.91 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 6 S 8.05 4.40 0.00 3.81 3.78 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 7 G 8.08 3.79 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 0.00 0.00 0.00 0.00 0.00 0.00 8 S 8.21 4.38 0.00 3.84 3.76 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 9 T 8.12 3.85 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 0.96 0.00 0.00 10 M 7.25 4.21 0.00 0.51 0.92 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.69 0.00 11 S 6.75 4.71 0.00 4.06 3.79 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 0.00 0.00 0.00 12 G 7.20 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 13 Y 8.72 4.69 0.00 3.05 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 14 L 9.13 4.53 0.00 1.51 1.42 -0.61 0.02 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 15 Y 7.83 5.44 0.00 2.40 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 16 R 9.08 4.96 0.00 1.86 1.76 0.00 2.21 0.00 0.00 3.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.77 0.00 17 S 7.93 4.57 0.00 2.86 3.09 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 0.00 0.00 0.00 0.00 18 K 9.28 4.33 0.00 1.61 1.69 0.00 1.60 0.00 0.00 1.62 0.00 0.00 2.88 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.40 1.64 7.81 19 G 7.33 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 20 S 8.18 4.12 0.00 3.84 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 21 K 8.51 4.06 0.00 1.85 1.95 0.00 1.70 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.26 1.38 7.81 22 K 6.76 4.33 0.00 1.71 1.45 0.00 1.60 0.00 0.00 1.62 0.00 0.00 2.79 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.26 1.33 7.81 23 P 0.00 4.26 0.00 2.12 1.99 0.00 3.60 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.91 0.00 24 W 8.32 4.70 0.00 3.02 3.03 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 25 K 9.08 4.61 0.00 1.89 1.76 0.00 1.63 0.00 0.00 1.58 0.00 0.00 2.77 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.40 1.39 7.81 26 H 9.26 5.30 0.00 3.44 3.38 0.00 5.70 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 L 9.01 4.98 0.00 1.54 1.22 0.95 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 28 W 8.30 4.95 0.00 2.94 2.79 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 0.00 0.00 0.00 29 F 7.37 5.58 0.00 2.65 2.79 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 0.00 0.00 0.00 30 V 8.78 4.89 2.54 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 1.14 0.00 0.00 1.11 0.00 0.00 31 I 8.09 4.77 1.66 0.00 0.00 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.70 0.79 0.00 0.00 32 K 8.89 4.55 0.00 1.83 1.85 0.00 1.79 0.00 0.00 1.55 0.00 0.00 2.61 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.53 1.43 7.81 33 N 9.90 4.26 0.00 2.93 2.94 0.00 0.00 7.21 6.73 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 34 K 8.14 3.92 0.00 2.05 1.92 0.00 1.65 0.00 0.00 1.75 0.00 0.00 3.26 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.55 1.40 7.81 35 V 8.46 4.39 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 0.35 0.00 0.00 0.91 0.00 0.00 36 L 8.80 5.00 0.00 1.82 1.69 1.17 1.22 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 37 Y 8.90 4.76 0.00 3.15 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 38 T 9.18 4.52 4.43 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 39 Y 8.45 4.78 0.00 3.14 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 40 A 9.09 4.40 1.28 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 0.00 0.00 41 A 7.59 4.89 1.20 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 0.00 0.00 0.00 42 S 7.91 2.79 0.00 2.72 3.43 0.00 0.00 0.00 0.00 0.00 0.00 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 7.41 4.33 0.00 1.87 1.84 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 2.16 2.13 0.00 44 D 7.33 4.61 0.00 2.91 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 45 V 7.96 4.15 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 0.68 0.00 0.00 0.94 0.00 0.00 46 A 7.09 4.53 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 47 A 8.48 3.66 0.77 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 48 L 8.37 4.24 0.00 1.47 1.73 0.99 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 49 E 7.80 4.94 0.00 1.86 1.84 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 2.31 2.30 0.00 50 S 8.42 4.81 0.00 3.60 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 51 Q 8.55 4.56 0.00 1.97 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 7.12 0.00 0.00 0.00 0.00 0.00 2.33 2.62 0.00 52 P 0.00 4.57 0.00 2.12 2.03 0.00 3.79 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 2.05 2.01 0.00 53 L 8.37 4.39 0.00 1.88 1.83 0.95 0.60 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 54 L 8.10 4.32 0.00 1.67 1.69 0.96 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 55 G 8.94 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 0.00 0.00 0.00 56 F 7.91 4.44 0.00 2.96 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 57 T 9.73 4.87 4.31 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 1.26 0.00 0.00 58 V 8.04 5.05 2.19 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 0.77 0.00 0.00 0.88 0.00 0.00 59 T 8.31 4.53 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 1.28 0.00 0.00 60 L 8.69 4.78 0.00 1.77 1.61 1.03 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 61 V 8.03 4.63 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 0.97 0.00 0.00 1.02 0.00 0.00 62 K 9.02 3.89 0.00 2.03 2.14 0.00 1.57 0.00 0.00 1.76 0.00 0.00 2.99 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.52 1.53 7.81 63 D 7.93 4.40 0.00 2.88 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 64 E 8.58 4.45 0.00 1.97 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 2.23 2.28 0.00 65 N 8.58 4.41 0.00 2.92 2.81 0.00 0.00 6.94 7.69 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 66 S 7.76 4.88 0.00 3.84 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 67 E 8.36 4.68 0.00 2.07 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 2.19 2.24 0.00 68 S 7.65 4.61 0.00 3.85 3.85 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 69 K 8.64 5.40 0.00 1.75 1.82 0.00 1.97 0.00 0.00 1.87 0.00 0.00 2.94 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.48 1.28 7.81 70 V 7.78 5.00 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 0.97 0.00 0.00 1.01 0.00 0.00 71 F 8.95 5.33 0.00 3.18 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 72 Q 9.17 4.98 0.00 2.06 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.81 6.89 0.00 0.00 0.00 0.00 0.00 2.27 2.32 0.00 73 L 9.49 4.80 0.00 1.92 2.06 0.81 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 74 L 8.82 4.58 0.00 1.73 1.61 0.98 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 75 H 9.78 4.56 0.00 2.77 2.98 0.00 5.61 0.00 0.00 0.00 0.00 6.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 K 8.20 4.01 0.00 1.75 1.90 0.00 1.57 0.00 0.00 1.35 0.00 0.00 2.68 0.00 0.00 2.66 0.00 0.00 0.00 0.00 0.74 0.62 7.81 77 G 6.59 3.47 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 0.00 0.00 0.00 78 M 7.72 4.41 0.00 2.18 2.18 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.62 0.00 79 V 8.21 4.27 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 0.83 0.00 0.00 0.95 0.00 0.00 80 F 9.91 4.61 0.00 2.84 3.39 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 81 Y 7.52 4.64 0.00 2.60 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 0.00 0.00 0.00 82 V 9.04 4.49 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 1.09 0.00 0.00 0.90 0.00 0.00 83 F 8.62 5.48 0.00 1.51 1.58 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 84 K 8.55 4.70 0.00 1.26 1.31 0.00 1.13 0.00 0.00 1.84 0.00 0.00 2.73 0.00 0.00 2.64 0.00 0.00 0.00 0.00 1.35 1.27 7.81 85 A 9.21 4.59 1.57 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 86 D 9.15 4.02 0.00 2.75 2.70 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 87 D 7.70 5.08 0.00 2.74 2.64 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 88 A 8.63 4.05 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 89 H 8.38 3.96 0.00 3.21 3.40 0.00 5.64 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 S 8.27 4.16 0.00 4.20 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 0.00 91 T 8.07 4.06 4.55 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 1.54 0.00 0.00 92 Q 8.23 3.97 0.00 2.23 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.79 0.00 0.00 0.00 0.00 0.00 2.51 2.53 0.00 93 R 7.69 3.83 0.00 1.89 1.72 0.00 2.99 0.00 0.00 3.10 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.88 0.00 94 W 8.26 3.92 0.00 3.09 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 I 8.44 3.57 1.92 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.52 0.91 0.00 0.00 96 D 9.23 4.26 0.00 2.76 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 97 A 8.67 3.64 0.94 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 0.00 0.00 98 F 8.69 4.42 0.00 3.29 3.03 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 99 Q 8.65 4.12 0.00 2.16 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.53 6.94 0.00 0.00 0.00 0.00 0.00 2.44 2.58 0.00 100 E 8.79 4.37 0.00 2.08 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 2.33 2.46 0.00 101 G 7.27 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 0.00 102 T 7.43 4.89 4.40 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 103 V 7.52 4.22 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 0.64 0.00 0.00 1.03 0.00 0.00 104 S 8.49 4.49 0.00 3.76 3.75 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 0.00 0.00 0.00 0.00 105 G 8.31 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 0.00 106 P 0.00 4.55 0.00 2.19 2.10 0.00 3.76 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 1.98 1.98 0.00 107 S 8.37 4.42 0.00 3.88 3.85 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 0.00 108 S 8.09 4.59 0.00 3.90 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 0.00 109 G 8.79 4.32 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 0.00