NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.5232 8.3044 120.2811 54.8887 33.7501 174.4330 2 R 3.8028 8.3927 121.7433 56.2159 30.5449 174.5857 3 H 4.7248 10.0343 125.5830 56.0449 30.8041 174.5001 4 Y 4.8858 8.4651 118.3068 56.8112 42.2901 174.1601 5 E 4.2985 9.1405 127.0956 55.2737 29.6138 173.7211 6 I 4.7866 8.1294 126.1074 59.5429 40.0519 174.5298 7 V 5.0176 8.7981 127.8442 58.9522 33.3839 173.4447 8 F 4.8634 8.2616 122.0275 55.0196 40.6141 174.1718 9 M 4.5103 7.9189 118.9766 53.4181 33.3407 175.5677 10 V 4.5966 8.6999 123.2260 61.0616 34.5629 174.1571 11 H 4.4501 9.0521 124.7064 55.6366 29.8944 173.3267 12 P 4.4574 0.0000 0.0000 66.3773 31.0279 178.6026 13 D 4.9938 8.1512 116.3041 54.2257 40.3480 176.7458 14 Q 4.5718 8.5077 115.1039 54.5181 31.6510 177.0682 15 S 3.8482 8.4326 116.4471 61.9518 62.5412 176.2825 16 E 4.0874 8.1712 118.3142 59.0685 29.4291 178.5896 17 Q 4.1465 8.9263 120.2150 58.2948 28.9047 178.1458 18 V 3.5753 7.4712 119.6930 65.5636 31.5318 176.2551 19 P 4.3468 0.0000 0.0000 65.8018 31.1087 178.4765 20 G 3.4607 7.8873 105.0346 47.7061 0.0000 174.9455 21 M 3.4162 8.1671 122.2478 58.0685 31.9900 178.6163 22 I 3.7359 7.5778 119.2741 64.8369 37.2301 177.9152 23 E 3.9048 8.0912 119.6081 59.4750 29.2789 179.3126 24 R 3.9189 7.6855 117.8872 59.4771 30.2326 177.9193 25 Y 4.3526 7.5859 116.5931 61.5952 37.9353 178.8220 26 T 3.9352 8.3525 109.9725 65.2093 68.5790 175.7886 27 A 3.9405 7.7673 123.5480 54.5030 18.2027 179.1322 28 A 3.9302 8.5430 119.5575 55.5689 18.4026 179.8685 29 I 3.7179 8.1772 118.2876 64.9832 37.2197 178.7245 30 T 4.0348 8.1336 116.5763 66.7467 68.0790 176.6286 31 G 3.7989 8.6369 106.7260 47.2326 0.0000 174.0587 32 A 4.6624 7.4148 120.1784 51.8635 20.4669 176.7764 33 E 3.7045 8.3100 117.5867 58.7535 27.7035 175.6677 34 G 3.9055 7.7788 106.9721 46.6232 0.0000 174.3132 35 K 4.3687 8.0073 117.2710 55.7440 34.4208 174.4124 36 I 4.1123 8.2503 128.5835 61.3531 37.6165 175.6969 37 H 4.8786 8.4016 122.5484 55.4555 29.8355 173.5147 38 R 4.5157 7.2747 116.9214 55.7236 33.1130 173.3586 39 L 4.4664 8.1088 119.0062 54.5436 45.0355 173.1140 40 E 4.7196 8.3551 124.9795 55.0842 34.1297 173.9758 41 D 4.8056 8.8279 124.6989 52.2041 40.2903 175.6824 42 W 4.3075 8.7287 122.0923 56.8962 29.6981 177.9297 43 G 3.3115 8.2791 109.1440 45.8314 0.0000 172.6612 44 R 4.5037 8.2154 119.3578 56.4782 31.1128 177.2489 45 R 4.3968 8.1219 119.1080 55.3932 33.0743 173.5013 46 Q 4.6118 8.9886 126.5826 56.5782 30.0120 175.1138 47 L 4.8301 7.9039 121.4302 52.7391 44.2483 176.9322 48 A 4.1744 8.8601 126.4430 54.8261 18.6104 177.3625 49 Y 4.9646 6.8560 110.8668 54.3330 41.4504 174.4156 50 P 5.3667 0.0000 0.0000 62.0431 29.1095 175.2681 51 I 3.8095 7.4121 121.4989 62.8514 38.7799 174.9084 52 N 3.9842 9.8042 127.3378 54.4696 37.1901 174.0263 53 K 3.9672 8.2007 114.7809 55.8382 32.5181 173.0501 54 L 3.5112 8.1862 123.7954 54.6272 40.7725 174.4547 55 H 4.9730 8.1127 114.7591 55.2537 30.5929 173.2289 56 K 5.0116 7.9491 116.0074 55.1371 36.0045 175.4146 57 A 4.6603 9.1242 124.6532 50.6886 23.4560 174.8147 58 H 5.0630 9.0020 120.7068 54.9717 30.4446 173.9938 59 Y 4.3994 8.9486 124.0339 57.7701 39.6838 174.9544 60 V 4.3835 7.4937 119.4822 61.5968 35.4693 173.3423 61 L 4.5693 8.2126 125.8758 54.6921 44.4580 174.6009 62 M 4.6383 8.6926 119.6835 52.5449 38.2242 174.0496 63 N 4.2917 8.6376 113.0758 53.9111 36.0975 173.1865 64 V 4.5288 7.8179 120.0322 61.8689 33.9536 174.5666 65 E 4.8764 8.3450 116.3842 55.1908 29.7494 173.3720 66 A 5.0215 7.5363 123.2186 48.7989 23.1791 174.4247 67 P 4.4707 0.0000 0.0000 62.9102 32.2325 177.8916 68 Q 3.9976 8.8896 120.3849 59.2946 28.4508 178.2978 69 E 3.6355 7.8015 116.2181 59.7341 29.2234 178.8117 70 V 3.8211 7.6266 111.2031 64.0841 32.2286 178.4948 71 I 3.5689 7.8049 117.2850 64.2325 37.2082 177.1961 72 D 4.5023 8.3684 120.5604 56.7498 40.7552 178.0531 73 E 3.6665 8.5480 119.4323 58.8707 29.3140 178.9718 74 L 4.1559 7.5216 121.9397 56.9937 42.0542 178.3190 75 E 4.0150 8.0351 118.8384 59.2905 29.2953 179.4084 76 T 4.0114 7.2433 109.5753 64.3502 69.5164 176.8853 77 T 3.8874 7.0776 112.7207 64.7990 68.2596 176.1697 78 F 4.4846 7.2940 118.6383 59.9644 38.8727 177.2325 79 R 4.1345 8.1796 117.3310 57.4119 30.8877 177.6646 80 F 5.2284 7.6038 117.5113 55.4530 39.5693 177.7360 81 N 5.0122 7.7939 116.9127 52.0595 40.0972 173.7146 82 D 4.3640 8.5100 122.6891 57.0077 41.8934 178.4547 83 A 4.1694 8.2571 122.4843 55.0560 18.4551 177.6812 84 V 4.3759 7.8198 114.4291 61.4895 33.5906 174.1367 85 I 4.3911 7.5215 122.8396 60.6564 35.5500 179.3913 86 R 4.0402 8.6687 131.2327 57.7335 30.5947 173.5540 87 S 4.6483 8.3398 118.8158 57.1378 66.2021 172.1913 88 M 4.9167 8.1546 122.5155 54.5616 36.2483 174.5593 89 V 4.3259 8.0408 123.2399 61.3208 33.3681 173.9103 90 M 4.6181 8.7725 128.4720 54.7677 34.6579 175.2026 91 R 4.8149 8.2979 116.0049 54.5908 32.5877 175.5158 92 T 3.4142 8.5149 111.8630 65.5602 67.2676 175.4225 93 K 3.5372 9.3877 120.6156 57.7361 30.0967 171.5520 94 H 4.0550 6.9463 120.7763 55.7047 27.9534 174.5705 95 A 3.7883 8.0664 125.7254 51.5902 18.4345 176.6103 96 V 4.4133 8.1889 122.9845 61.9184 33.5595 174.9037 97 T 4.6122 7.9397 119.3390 62.7248 72.3580 174.6593 98 E 3.5548 9.5865 122.1149 56.9186 30.6404 174.9652 99 A 3.4924 8.7738 118.1997 54.4041 16.3602 177.9373 100 S 4.3605 8.7932 110.2312 59.6955 62.4890 169.4904 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 4.52 0.00 2.09 2.27 0.00 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.65 0.00 2 R 8.39 3.80 0.00 1.83 1.37 0.00 3.29 0.00 0.00 3.21 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 1.58 0.00 3 H 10.03 4.72 0.00 2.88 3.22 0.00 5.71 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 Y 8.47 4.89 0.00 2.95 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 5 E 9.14 4.30 0.00 2.12 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 2.39 2.59 0.00 6 I 8.13 4.79 1.95 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 1.58 1.28 1.06 0.00 0.00 7 V 8.80 5.02 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 0.65 0.00 0.00 8 F 8.26 4.86 0.00 2.51 2.30 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 9 M 7.92 4.51 0.00 0.67 1.47 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.00 0.00 10 V 8.70 4.60 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 1.14 0.00 0.00 1.10 0.00 0.00 11 H 9.05 4.45 0.00 3.29 3.19 0.00 5.82 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 P 0.00 4.46 0.00 2.24 2.28 0.00 3.18 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 1.84 1.93 0.00 13 D 8.15 4.99 0.00 2.79 2.77 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 14 Q 8.51 4.57 0.00 2.30 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.47 6.65 0.00 0.00 0.00 0.00 0.00 2.24 2.44 0.00 15 S 8.43 3.85 0.00 3.91 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 16 E 8.17 4.09 0.00 2.12 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 2.29 2.36 0.00 17 Q 8.93 4.15 0.00 2.27 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.64 0.00 0.00 0.00 0.00 0.00 2.37 2.48 0.00 18 V 7.47 3.58 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 1.08 0.00 0.00 0.44 0.00 0.00 19 P 0.00 4.35 0.00 2.30 2.30 0.00 3.83 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.03 0.00 20 G 7.89 3.46 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 0.00 0.00 0.00 21 M 8.17 3.42 0.00 1.83 2.30 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.80 2.61 0.00 22 I 7.58 3.74 2.03 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 1.66 0.97 1.00 0.00 0.00 23 E 8.09 3.90 0.00 2.14 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 0.00 2.29 2.36 0.00 24 R 7.69 3.92 0.00 1.88 1.83 0.00 3.14 0.00 0.00 3.11 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.57 0.00 25 Y 7.59 4.35 0.00 3.13 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 26 T 8.35 3.94 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 1.36 0.00 0.00 27 A 7.77 3.94 1.42 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 28 A 8.54 3.93 1.39 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 29 I 8.18 3.72 2.06 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.16 0.95 0.00 0.00 30 T 8.13 4.03 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 31 G 8.64 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 32 A 7.41 4.66 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 33 E 8.31 3.70 0.00 2.14 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 0.00 2.25 2.39 0.00 34 G 7.78 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 K 8.01 4.37 0.00 1.80 1.67 0.00 1.64 0.00 0.00 1.85 0.00 0.00 2.85 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.10 1.34 7.81 36 I 8.25 4.11 1.88 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 1.39 0.67 0.97 0.00 0.00 37 H 8.40 4.88 0.00 3.07 3.32 0.00 5.89 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 R 7.27 4.52 0.00 1.83 1.98 0.00 3.38 0.00 0.00 3.29 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.64 0.00 39 L 8.11 4.47 0.00 1.69 1.53 0.98 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 40 E 8.36 4.72 0.00 2.12 2.22 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 2.45 2.45 0.00 41 D 8.83 4.81 0.00 2.71 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 42 W 8.73 4.31 0.00 3.19 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 43 G 8.28 3.31 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 0.00 44 R 8.22 4.50 0.00 1.83 1.86 0.00 3.12 0.00 0.00 2.25 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.52 0.00 45 R 8.12 4.40 0.00 1.84 1.82 0.00 2.87 0.00 0.00 2.37 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.33 0.00 46 Q 8.99 4.61 0.00 2.07 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.67 6.48 0.00 0.00 0.00 0.00 0.00 2.33 2.46 0.00 47 L 7.90 4.83 0.00 1.49 1.51 0.88 0.79 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 48 A 8.86 4.17 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 6.86 4.96 0.00 3.06 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 50 P 0.00 5.37 0.00 2.29 2.23 0.00 3.56 0.00 0.00 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 1.97 0.00 51 I 7.41 3.81 1.72 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 1.32 0.94 0.77 0.00 0.00 52 N 9.80 3.98 0.00 2.85 2.83 0.00 0.00 7.25 6.68 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 53 K 8.20 3.97 0.00 1.97 1.90 0.00 2.02 0.00 0.00 1.71 0.00 0.00 3.08 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.32 1.41 7.81 54 L 8.19 3.51 0.00 1.81 1.53 0.90 0.97 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 55 H 8.11 4.97 0.00 3.04 3.21 0.00 5.60 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 K 7.95 5.01 0.00 1.56 1.66 0.00 1.69 0.00 0.00 1.71 0.00 0.00 2.86 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.35 1.46 7.81 57 A 9.12 4.66 1.13 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 0.00 0.00 58 H 9.00 5.06 0.00 3.26 3.28 0.00 5.60 0.00 0.00 0.00 0.00 6.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 Y 8.95 4.40 0.00 3.04 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 60 V 7.49 4.38 0.67 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 0.78 0.00 0.00 0.42 0.00 0.00 61 L 8.21 4.57 0.00 1.48 1.51 0.95 -0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 62 M 8.69 4.64 0.00 2.12 2.02 0.00 0.00 0.00 0.00 0.00 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.72 0.00 63 N 8.64 4.29 0.00 3.12 2.95 0.00 0.00 6.40 7.68 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 64 V 7.82 4.53 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 1.04 0.00 0.00 1.03 0.00 0.00 65 E 8.34 4.88 0.00 1.82 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 2.23 1.96 0.00 66 A 7.54 5.02 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 67 P 0.00 4.47 0.00 2.26 2.23 0.00 3.78 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 1.98 0.00 68 Q 8.89 4.00 0.00 2.31 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.87 6.78 0.00 0.00 0.00 0.00 0.00 2.49 2.45 0.00 69 E 7.80 3.64 0.00 2.06 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 2.45 2.44 0.00 70 V 7.63 3.82 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 0.95 0.00 0.00 1.02 0.00 0.00 71 I 7.80 3.57 1.84 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.59 0.88 1.04 0.00 0.00 72 D 8.37 4.50 0.00 2.83 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 73 E 8.55 3.67 0.00 2.05 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 2.29 2.53 0.00 74 L 7.52 4.16 0.00 1.43 1.51 -0.85 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 75 E 8.04 4.01 0.00 2.15 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 2.30 2.25 0.00 76 T 7.24 4.01 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 1.23 0.00 0.00 77 T 7.08 3.89 3.95 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 1.15 0.00 0.00 78 F 7.29 4.48 0.00 2.93 2.93 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 79 R 8.18 4.13 0.00 1.58 1.61 0.00 3.21 0.00 0.00 3.14 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.67 0.00 80 F 7.60 5.23 0.00 3.05 2.93 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 81 N 7.79 5.01 0.00 2.88 2.75 0.00 0.00 7.02 8.49 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 82 D 8.51 4.36 0.00 2.73 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 83 A 8.26 4.17 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.82 4.38 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 1.05 0.00 0.00 0.93 0.00 0.00 85 I 7.52 4.39 1.80 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.60 0.89 0.00 0.00 86 R 8.67 4.04 0.00 1.79 1.69 0.00 3.30 0.00 0.00 3.23 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.60 0.00 87 S 8.34 4.65 0.00 3.53 3.51 0.00 0.00 0.00 0.00 0.00 0.00 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 M 8.15 4.92 0.00 1.90 1.80 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.50 0.00 89 V 8.04 4.33 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 0.68 0.00 0.00 0.88 0.00 0.00 90 M 8.77 4.62 0.00 2.05 2.14 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.67 0.00 91 R 8.30 4.81 0.00 1.91 2.02 0.00 3.05 0.00 0.00 3.24 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.61 0.00 92 T 8.51 3.41 4.09 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 0.88 0.00 0.00 93 K 9.39 3.54 0.00 1.91 1.94 0.00 1.83 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.30 1.43 7.81 94 H 6.95 4.05 0.00 3.28 3.37 0.00 5.71 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 95 A 8.07 3.79 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 96 V 8.19 4.41 2.13 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 0.90 0.00 0.00 1.04 0.00 0.00 97 T 7.94 4.61 4.27 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 1.29 0.00 0.00 98 E 9.59 3.55 0.00 2.23 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 2.20 2.24 0.00 99 A 8.77 3.49 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 0.00 100 S 8.79 4.36 0.00 4.52 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 0.00