NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.2474 8.2493 123.5800 52.2496 18.9687 176.4306 2 M 4.0668 8.2138 120.5116 53.9864 33.2244 173.8484 3 A 4.0036 8.5919 122.5184 53.2290 19.2237 180.2324 4 R 3.5525 7.7710 122.2768 58.5927 28.7850 177.0427 5 M 4.9547 7.7632 118.8030 53.4188 32.5448 173.9481 6 S 4.4376 7.7499 117.7961 56.6689 64.7146 174.3361 7 P 4.2519 0.0000 0.0000 65.5981 30.8002 178.8412 8 A 3.9754 7.9310 119.2306 55.3181 18.2318 179.1184 9 D 4.3902 7.9689 116.9542 57.3484 40.7845 178.9789 10 K 3.9920 7.9260 119.6109 59.5676 32.0287 178.6189 11 R 3.8117 8.2171 119.2518 59.1884 29.9715 178.2334 12 K 4.0775 8.5151 119.8220 59.5497 31.9321 178.5582 13 L 3.9862 8.2123 119.4175 57.9399 41.6190 179.2796 14 L 4.0806 8.6118 119.1339 58.1970 41.5098 179.2831 15 D 4.4193 9.5921 118.5951 57.7234 40.5449 178.9941 16 E 4.0925 8.3292 118.7673 59.1558 29.4672 179.1520 17 L 4.2852 8.9610 120.1989 57.9553 41.6303 179.8527 18 R 4.0568 8.7444 118.2183 59.3580 29.9761 179.1548 19 S 4.1256 7.9720 112.6487 61.3791 62.4424 176.1330 20 I 3.7912 9.4635 122.5028 64.6275 37.0457 177.5985 21 Y 3.6904 8.9517 121.2575 60.6675 38.6625 178.1811 22 R 3.9411 8.3204 119.5631 59.9425 30.2251 178.5887 23 T 3.9096 8.5655 116.1286 66.6418 68.1774 176.4935 24 I 3.6170 7.8276 121.2602 64.3817 37.4037 178.3506 25 V 3.5479 7.3294 118.2826 65.9908 31.1861 178.0888 26 L 4.1005 7.5681 117.0229 57.7248 41.7499 178.6881 27 E 4.2826 8.3224 116.4367 57.0780 29.4360 177.7223 28 Y 3.5287 7.4634 120.5937 60.1992 38.7868 176.9184 29 F 4.8865 7.7943 115.1782 56.7746 39.3878 175.3771 30 N 4.4348 8.5129 120.1353 53.5913 37.2388 175.2909 31 T 4.2603 8.4094 110.3470 63.4205 69.6574 175.1503 32 D 4.6643 7.8205 117.4448 53.6847 43.8357 175.6558 33 A 4.0944 7.9899 122.0117 52.2577 19.0488 178.8452 34 K 4.2860 8.3094 123.3034 54.3844 29.9802 177.5388 35 V 3.1746 7.8800 122.7400 65.9405 31.0659 176.1921 36 N 4.0918 8.2819 116.2515 57.0467 38.5478 176.3476 37 E 4.2120 8.9336 120.4045 59.3353 29.4290 179.6082 38 R 3.9446 7.7615 117.6277 59.3883 29.9846 179.0562 39 I 3.7336 8.5744 120.4657 64.3362 37.0841 177.9640 40 D 4.3270 9.3156 119.5954 57.1924 40.9354 178.0083 41 E 3.9055 8.5591 120.2443 59.2634 29.6942 178.5957 42 F 4.0180 8.5436 120.9486 61.1915 39.5646 177.1636 43 V 3.6821 9.0448 118.8367 66.1733 31.2663 178.2027 44 S 4.0932 8.4976 115.0793 61.6734 62.6586 176.9032 45 K 4.0502 8.2887 121.0792 59.4193 31.7999 179.2614 46 A 3.6504 8.1823 121.5013 54.9841 18.1803 179.4610 47 F 4.2153 8.1227 120.2549 60.9896 39.3572 177.1472 48 F 4.1196 8.7085 119.6956 61.3349 39.2786 175.8659 49 A 4.0561 8.9615 120.9965 51.8813 18.0747 176.2737 50 D 4.2812 7.6210 114.6994 55.0794 40.3128 173.8559 51 I 3.9537 8.0108 117.5525 60.8951 37.6340 176.5535 52 S 4.5878 8.2658 120.1059 57.3761 64.1155 175.5367 53 V 3.4554 8.3417 121.8725 65.8871 30.9110 178.1188 54 S 4.5280 8.1777 113.8385 62.0940 61.7677 176.5494 55 Q 4.0049 7.6678 121.8764 58.2009 28.4139 179.2086 56 V 3.8939 7.7451 118.6101 65.9101 31.4534 178.0243 57 L 3.9129 8.8608 119.5619 57.8802 41.6881 179.3918 58 E 3.9423 9.6578 118.4216 59.5454 29.6003 179.2964 59 I 3.6483 8.9819 120.1444 64.5544 37.0120 177.8933 60 H 3.8709 7.7967 118.6001 59.2951 29.7675 177.3668 61 V 3.6467 7.6056 119.7306 66.1205 31.3157 177.8158 62 E 3.9368 8.0376 117.8742 59.3373 29.3981 179.1624 63 L 3.9524 7.5972 121.1634 57.8880 42.1377 178.8385 64 M 4.0821 8.1175 118.8063 58.4239 31.7983 178.1860 65 D 4.4226 8.2758 118.2198 57.5835 40.8832 178.4379 66 T 3.7784 7.6014 115.8051 66.5667 68.3229 176.6414 67 F 4.2029 7.9464 119.3688 60.8274 39.1936 177.9077 68 S 4.2468 8.7405 115.2451 61.5016 62.7069 176.8030 69 K 3.9685 8.5304 122.6859 59.7085 31.2267 178.9564 70 Q 4.0430 8.0395 118.3236 58.8670 28.4335 178.6047 71 L 4.4725 8.3951 120.4345 57.8652 41.4471 179.7853 72 K 4.0162 7.7649 116.8708 59.3598 32.0587 179.2495 73 L 4.1526 7.5256 117.7442 58.0288 41.7739 179.1712 74 E 4.1471 9.4876 117.3749 56.9015 30.0654 176.9199 75 G 3.7204 9.1155 106.7866 46.8071 0.0000 173.2722 76 R 4.6405 7.5728 115.6107 53.3714 33.6295 176.5247 77 S 4.0531 8.5801 114.6730 59.1426 62.5879 174.6357 78 E 4.4207 8.8133 124.0802 56.9329 30.1019 177.9507 79 D 4.2831 7.7351 120.3746 57.8229 40.7650 178.3467 80 I 3.5483 7.7129 118.3849 63.6054 37.9100 177.0778 81 L 3.2917 7.9166 121.3915 56.8913 41.7220 178.6852 82 L 4.0099 7.8507 120.2697 58.9836 40.1056 178.5699 83 D 4.0928 7.8219 120.0615 56.7464 38.7206 178.5306 84 Y 4.2979 6.4681 116.3341 60.8917 37.8275 178.8120 85 R 4.0135 7.7768 118.5556 59.1729 30.2095 178.9999 86 L 3.9274 8.0625 119.2325 57.9925 41.5938 179.7156 87 T 3.4652 9.1587 115.4094 66.1056 68.3136 176.7457 88 L 4.6845 9.2704 123.6028 57.9532 42.1615 179.1857 89 I 3.7434 7.8460 119.7546 64.3555 36.9659 177.9830 90 D 4.3576 8.2476 119.0171 57.2101 41.0555 178.4665 91 V 3.6102 8.3454 119.0574 66.1129 31.6168 178.0267 92 I 3.8208 8.0080 119.3131 64.5182 37.0023 178.3020 93 A 4.1554 8.5088 121.9818 55.2686 18.0194 179.1948 94 H 4.0474 8.6069 117.3782 59.4706 30.0134 177.5944 95 L 4.0977 8.1592 121.7208 58.7568 40.2709 178.3735 96 C 4.3093 8.8698 120.0224 62.6865 31.4447 175.3832 97 E 4.0288 8.4122 120.9370 59.3560 29.1527 178.5688 98 M 4.0051 7.8298 117.0769 58.5392 31.0681 178.2587 99 Y 4.3569 8.1328 117.9006 60.9544 37.9433 178.3214 100 R 3.9979 7.9254 119.6646 59.6878 29.9968 178.7883 101 R 4.0954 8.0282 116.4069 58.6655 30.1361 178.2070 102 S 4.7131 7.9802 112.9171 58.1072 63.1180 174.1432 103 I 4.3133 7.2519 124.0759 58.5793 37.0389 173.2125 104 P 4.4675 0.0000 0.0000 62.3046 31.6192 176.3518 105 R 4.6830 8.3918 121.7647 54.1604 33.4277 174.7419 106 E 4.6510 8.2867 120.8189 55.0515 31.5378 176.5819 107 V 3.9641 8.0072 119.8303 62.6768 30.7716 172.1164 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 A 8.25 4.25 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 2 M 8.21 4.07 0.00 2.19 2.09 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.56 0.00 3 A 8.59 4.00 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 4 R 7.77 3.55 0.00 2.03 2.44 0.00 3.00 0.00 0.00 3.18 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.65 0.00 5 M 7.76 4.95 0.00 1.93 2.12 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.45 0.00 6 S 7.75 4.44 0.00 4.04 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 7 P 0.00 4.25 0.00 2.17 2.15 0.00 3.59 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.15 0.00 8 A 7.93 3.98 1.32 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 9 D 7.97 4.39 0.00 2.90 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 10 K 7.93 3.99 0.00 1.85 2.01 0.00 1.59 0.00 0.00 1.71 0.00 0.00 2.95 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.49 1.55 7.81 11 R 8.22 3.81 0.00 1.95 2.09 0.00 3.27 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 1.63 1.96 0.00 12 K 8.52 4.08 0.00 1.82 2.04 0.00 1.71 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.46 1.51 7.81 13 L 8.21 3.99 0.00 1.87 1.71 0.96 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 14 L 8.61 4.08 0.00 1.81 1.75 0.92 1.34 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 15 D 9.59 4.42 0.00 2.87 2.75 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 16 E 8.33 4.09 0.00 2.23 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 0.00 2.36 2.58 0.00 17 L 8.96 4.29 0.00 1.75 1.92 0.78 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 18 R 8.74 4.06 0.00 1.99 2.02 0.00 3.14 0.00 0.00 3.11 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.90 0.00 19 S 7.97 4.13 0.00 3.90 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 20 I 9.46 3.79 2.20 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.54 1.10 0.00 0.00 21 Y 8.95 3.69 0.00 3.04 3.12 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 22 R 8.32 3.94 0.00 2.09 2.11 0.00 3.17 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.77 0.00 23 T 8.57 3.91 4.38 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 1.22 0.00 0.00 24 I 7.83 3.62 1.61 0.00 0.00 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.61 0.70 0.00 0.00 25 V 7.33 3.55 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 0.99 0.00 0.00 0.60 0.00 0.00 26 L 7.57 4.10 0.00 1.75 1.80 1.01 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 27 E 8.32 4.28 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 2.45 0.00 28 Y 7.46 3.53 0.00 2.80 2.40 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 0.00 29 F 7.79 4.89 0.00 3.17 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 30 N 8.51 4.43 0.00 2.78 2.88 0.00 0.00 6.86 5.73 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 31 T 8.41 4.26 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 1.23 0.00 0.00 32 D 7.82 4.66 0.00 2.62 2.67 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 0.00 0.00 0.00 0.00 33 A 7.99 4.09 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 34 K 8.31 4.29 0.00 1.80 1.75 0.00 1.70 0.00 0.00 1.73 0.00 0.00 2.88 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.47 7.81 35 V 7.88 3.17 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 1.00 0.00 0.00 0.83 0.00 0.00 36 N 8.28 4.09 0.00 2.78 2.81 0.00 0.00 7.30 7.70 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 37 E 8.93 4.21 0.00 2.09 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 2.44 0.00 38 R 7.76 3.94 0.00 1.95 1.96 0.00 3.30 0.00 0.00 3.35 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.81 0.00 39 I 8.57 3.73 1.94 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 1.36 0.96 0.73 0.00 0.00 40 D 9.32 4.33 0.00 2.89 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 41 E 8.56 3.91 0.00 2.25 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 2.35 2.40 0.00 42 F 8.54 4.02 0.00 3.34 3.23 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 43 V 9.04 3.68 2.27 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 0.95 0.00 0.00 0.90 0.00 0.00 44 S 8.50 4.09 0.00 3.87 3.88 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 45 K 8.29 4.05 0.00 1.81 1.84 0.00 1.69 0.00 0.00 1.66 0.00 0.00 3.12 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.47 1.61 7.81 46 A 8.18 3.65 1.09 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 0.00 0.00 47 F 8.12 4.22 0.00 3.00 3.21 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 48 F 8.71 4.12 0.00 3.13 3.20 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 49 A 8.96 4.06 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 50 D 7.62 4.28 0.00 2.53 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 51 I 8.01 3.95 1.94 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.82 0.94 0.00 0.00 52 S 8.27 4.59 0.00 3.85 3.73 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 53 V 8.34 3.46 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 1.09 0.00 0.00 0.99 0.00 0.00 54 S 8.18 4.53 0.00 4.07 4.13 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 55 Q 7.67 4.00 0.00 2.01 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.82 0.00 0.00 0.00 0.00 0.00 2.38 2.37 0.00 56 V 7.75 3.89 2.29 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 1.15 0.00 0.00 1.22 0.00 0.00 57 L 8.86 3.91 0.00 1.74 1.68 0.94 0.89 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 58 E 9.66 3.94 0.00 2.00 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 2.32 2.45 0.00 59 I 8.98 3.65 1.77 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 1.38 0.97 0.79 0.00 0.00 60 H 7.80 3.87 0.00 3.12 3.49 0.00 5.79 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 61 V 7.61 3.65 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 1.09 0.00 0.00 1.08 0.00 0.00 62 E 8.04 3.94 0.00 2.17 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 2.48 2.44 0.00 63 L 7.60 3.95 0.00 1.76 1.60 0.83 0.80 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 64 M 8.12 4.08 0.00 2.28 2.13 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.36 0.00 65 D 8.28 4.42 0.00 2.95 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 66 T 7.60 3.78 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 0.95 0.00 0.00 67 F 7.95 4.20 0.00 3.52 3.33 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 68 S 8.74 4.25 0.00 3.90 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 69 K 8.53 3.97 0.00 1.90 1.96 0.00 1.62 0.00 0.00 1.62 0.00 0.00 2.95 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.43 1.48 7.81 70 Q 8.04 4.04 0.00 2.37 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.54 0.00 0.00 0.00 0.00 0.00 2.35 2.58 0.00 71 L 8.40 4.47 0.00 1.98 1.87 1.14 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 72 K 7.76 4.02 0.00 1.96 1.89 0.00 1.73 0.00 0.00 1.72 0.00 0.00 3.04 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.50 1.77 7.81 73 L 7.53 4.15 0.00 1.78 1.73 0.92 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 74 E 9.49 4.15 0.00 2.07 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 0.00 2.37 2.47 0.00 75 G 9.12 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 0.00 0.00 0.00 76 R 7.57 4.64 0.00 1.82 1.85 0.00 3.27 0.00 0.00 3.27 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.60 0.00 77 S 8.58 4.05 0.00 3.83 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 78 E 8.81 4.42 0.00 2.21 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 0.00 2.37 2.33 0.00 79 D 7.74 4.28 0.00 2.73 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 80 I 7.71 3.55 1.77 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.22 0.91 0.00 0.00 81 L 7.92 3.29 0.00 1.98 1.61 1.18 0.90 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 82 L 7.85 4.01 0.00 1.86 2.06 0.94 0.84 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 83 D 7.82 4.09 0.00 2.42 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 84 Y 6.47 4.30 0.00 3.18 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 85 R 7.78 4.01 0.00 2.01 1.97 0.00 3.13 0.00 0.00 3.35 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.75 0.00 86 L 8.06 3.93 0.00 1.33 1.60 1.02 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 87 T 9.16 3.47 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 0.77 0.00 0.00 88 L 9.27 4.68 0.00 1.98 1.72 0.88 0.96 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 89 I 7.85 3.74 1.95 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 1.41 0.56 0.93 0.00 0.00 90 D 8.25 4.36 0.00 2.94 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 91 V 8.35 3.61 2.33 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 0.85 0.00 0.00 0.71 0.00 0.00 92 I 8.01 3.82 1.98 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 1.56 0.69 1.00 0.00 0.00 93 A 8.51 4.16 1.43 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 0.00 0.00 94 H 8.61 4.05 0.00 3.39 3.53 0.00 5.61 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 95 L 8.16 4.10 0.00 1.99 2.10 1.20 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 96 C 8.87 4.31 0.00 3.29 3.21 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 97 E 8.41 4.03 0.00 2.28 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 0.00 2.29 2.36 0.00 98 M 7.83 4.01 0.00 2.35 2.13 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.32 0.00 99 Y 8.13 4.36 0.00 3.40 3.10 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 0.00 0.00 0.00 100 R 7.93 4.00 0.00 1.90 2.14 0.00 3.12 0.00 0.00 3.20 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.72 0.00 101 R 8.03 4.10 0.00 1.92 1.94 0.00 3.17 0.00 0.00 3.19 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.88 0.00 102 S 7.98 4.71 0.00 4.31 4.16 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 0.00 103 I 7.25 4.31 1.97 0.00 0.00 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 1.54 0.82 0.96 0.00 0.00 104 P 0.00 4.47 0.00 2.20 2.09 0.00 3.75 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.02 0.00 105 R 8.39 4.68 0.00 1.78 1.84 0.00 3.21 0.00 0.00 3.24 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.80 0.00 106 E 8.29 4.65 0.00 1.93 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 2.24 2.34 0.00 107 V 8.01 3.96 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 0.94 0.00 0.00