NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4954 8.3049 120.3278 55.8727 32.8607 173.1877 2 E 4.3742 8.0371 117.5344 54.7123 37.2830 172.9817 3 T 3.2991 7.8108 124.3032 64.0103 67.0123 170.5821 4 I 4.8498 8.0435 117.5024 58.7962 40.3064 174.6020 5 A 4.9974 8.1840 125.1620 50.4122 22.8222 174.6720 6 K 4.5392 8.2330 117.0031 56.4126 36.2964 174.6485 7 H 4.7495 9.3328 119.9293 54.6864 32.2994 172.1058 8 R 5.1753 8.7575 124.3968 56.1491 32.2094 176.3824 9 H 4.3048 9.2609 118.1659 55.8553 26.8694 175.1832 10 A 3.8150 7.3683 120.7552 51.7581 19.2262 177.9519 11 R 4.6373 8.2544 124.9170 54.2628 29.1486 174.8672 12 S 4.3849 7.1531 113.0224 56.6534 65.4863 172.4484 13 S 4.7171 8.3475 112.9026 56.9743 66.3231 174.5945 14 A 4.0076 8.3134 124.5375 55.3449 17.9671 179.9441 15 Q 3.9406 7.9210 116.9999 58.8817 29.5018 178.1024 16 K 4.1003 8.4895 120.1266 59.3202 32.2488 179.2767 17 V 3.5168 7.5661 118.2766 66.2869 31.6089 177.9185 18 R 3.9491 8.1356 118.1213 59.2872 29.4558 178.2020 19 L 4.0020 7.6490 119.8447 57.5545 42.4085 178.3273 20 V 4.0851 7.5735 116.1251 61.7871 31.8468 177.6631 21 A 3.9638 7.8409 123.9714 55.7634 18.3392 179.2707 22 D 4.6316 7.7630 112.0856 55.6354 40.9937 177.4478 23 L 4.1518 7.6461 122.3450 56.8998 42.1909 177.2625 24 I 4.3353 7.2180 108.9634 60.0900 38.4225 175.7583 25 R 3.8135 7.7951 122.3385 58.0312 29.7603 174.8152 26 G 4.1749 8.3092 121.7697 44.4235 0.0000 173.2289 27 K 3.9622 7.9231 117.4164 56.4109 34.3113 175.1876 28 K 4.5099 7.8065 113.5599 56.6417 32.8015 179.5518 29 V 4.5464 8.4385 126.8012 64.4723 35.3399 174.5828 30 S 4.3392 8.2087 115.8862 61.1560 63.4336 176.1711 31 Q 4.0017 8.1575 118.5000 58.2530 29.0823 176.0905 32 A 4.5868 7.8132 122.5795 51.0974 16.0251 176.8930 33 L 5.4407 7.9481 130.9619 56.1263 40.5500 175.6625 34 D 4.7834 7.3223 119.6379 56.4030 40.8098 177.8088 35 I 4.2631 7.8422 112.2105 61.2922 38.2287 176.4092 36 L 5.0099 8.1642 122.8171 56.4632 42.7638 178.4890 37 T 3.8536 7.9165 113.3715 65.3115 69.5481 174.0177 38 Y 4.8528 7.6132 117.2169 56.0835 40.2108 174.3801 39 T 4.5280 9.4112 117.9087 62.5097 70.0615 176.3984 40 N 5.0332 9.4754 132.6659 54.8256 35.4290 176.4956 41 K 3.9973 7.3980 120.0402 55.5931 32.7816 177.8090 42 K 3.7293 8.8501 122.2222 59.6843 31.7620 178.9091 43 A 4.0181 8.1385 120.3891 55.1667 17.4376 179.1552 44 A 3.9496 7.7710 119.7721 54.7901 18.2232 180.0860 45 V 4.2127 7.1540 107.0175 61.1646 32.2063 177.2021 46 L 4.3826 8.4501 121.6080 57.3321 42.8232 178.0335 47 V 3.8778 7.4891 110.9904 63.1290 31.8058 178.4068 48 K 3.9192 7.4755 116.9297 59.2393 31.6575 178.6456 49 K 4.0992 8.0816 119.4058 60.0339 31.9917 177.6137 50 V 3.7671 7.3663 116.3462 64.3634 31.2309 177.1690 51 L 3.9009 8.4741 119.4469 58.7297 42.2733 179.6313 52 E 3.8497 8.6648 118.4687 59.4160 29.3231 179.3617 53 S 4.0510 7.7325 111.7716 61.1254 62.3266 175.7209 54 A 3.9341 8.5115 123.8069 55.5624 18.2297 179.5884 55 I 3.5650 8.5442 118.0014 64.5791 37.1914 178.2848 56 A 3.9952 7.8732 121.2099 55.2567 18.0344 179.2054 57 N 4.4236 8.6505 114.0774 55.1600 38.5476 176.6845 58 A 4.6669 7.6298 122.2101 53.7462 19.6147 179.1866 59 E 3.9827 7.7985 116.2188 59.8371 29.7412 178.7471 60 H 4.2585 8.1212 116.6959 61.1246 30.6233 175.5624 61 N 4.7772 7.7114 123.1769 52.7167 38.8770 174.5383 62 D 4.2884 8.6073 123.1706 54.3413 39.9530 174.6005 63 G 3.6725 8.8234 109.4418 44.9195 0.0000 172.8318 64 A 4.5143 8.4515 134.1326 53.4119 18.7522 177.5264 65 D 4.3419 8.1220 117.3646 54.4645 39.6557 177.7159 66 I 3.9923 8.4671 119.1243 62.6225 38.0047 177.5836 67 D 4.4537 8.1916 121.0636 56.9401 41.2567 176.4133 68 D 4.9595 7.5551 115.2864 52.4006 39.3144 177.0663 69 L 5.4260 7.6358 118.5214 51.8119 42.1146 176.6454 70 K 3.8327 8.0155 118.7708 56.9771 33.7997 178.1064 71 V 4.0321 8.7171 126.5222 63.2842 29.6267 177.7413 72 T 4.1063 8.3933 120.0058 63.7591 69.0729 176.6096 73 K 4.2651 9.2957 118.3027 56.0437 34.2419 177.0417 74 I 4.8288 8.4865 125.6961 59.7074 40.0439 173.4578 75 F 5.1786 8.5082 124.3612 54.8901 41.1448 174.2348 76 V 4.7880 8.6002 121.2838 60.5200 33.5705 174.5403 77 D 5.0698 8.4349 121.0046 52.4256 45.7590 174.5489 78 E 4.2487 8.9344 120.4327 56.6137 29.9783 177.0923 79 G 4.5540 8.5108 115.2898 42.7867 0.0000 170.7017 80 P 4.4158 0.0000 0.0000 62.3937 31.4584 176.4780 81 S 4.1506 8.6264 121.7903 59.3114 63.4820 174.0982 82 M 4.3500 8.6358 125.7104 54.5454 33.0888 175.7771 83 K 4.5191 8.6083 123.9679 56.0275 33.1140 176.2113 84 R 4.8613 8.2238 124.6816 54.7751 33.9082 173.5876 85 I 4.8342 8.2711 114.0890 59.2131 40.8481 175.0538 86 M 4.7045 8.3508 122.7652 53.0079 35.0192 172.1648 87 P 4.6113 0.0000 0.0000 62.9374 32.2279 175.6120 88 R 4.7439 9.0678 124.8480 53.4484 34.1668 174.3196 89 A 3.9888 8.4419 122.1177 53.9698 18.5217 178.1612 90 K 3.7830 9.2348 119.3450 56.8810 29.3932 176.1523 91 G 3.8024 7.8334 105.4617 46.9185 0.0000 174.0242 92 R 4.6983 7.5497 117.0482 53.9714 32.6677 175.4433 93 A 5.0649 8.5520 125.0765 50.7340 20.9233 176.3605 94 D 4.6778 8.3799 122.6309 53.3494 42.9238 176.2827 95 R 4.0720 8.6473 117.5131 58.0134 31.0478 175.3339 96 I 3.3651 7.6724 113.5564 61.7520 35.6836 171.8099 97 L 4.1301 7.6930 119.7567 54.6700 42.5944 178.7780 98 K 4.4071 8.8634 126.2972 54.7383 30.8139 176.4953 99 R 4.3970 8.1152 122.4337 56.3812 31.4324 176.2702 100 T 4.9536 7.9623 110.1649 61.2107 70.3843 172.6197 101 S 4.9078 7.1464 112.4999 58.7871 66.1736 177.3504 102 H 4.9987 8.9321 120.5797 53.5403 29.5121 171.2117 103 I 3.9925 8.5755 121.9313 62.1255 37.8564 174.4487 104 T 4.5432 8.2579 124.3161 62.2029 69.8411 174.4538 105 V 4.6602 7.9827 123.9203 61.5776 36.2364 173.8904 106 V 4.7322 8.7558 124.1989 61.5038 35.4202 173.8399 107 V 4.4356 8.0870 126.2293 60.4914 33.6289 174.7215 108 S 4.7479 8.1543 122.8124 57.0899 64.6681 173.5907 109 D 4.5081 8.7579 117.5868 54.3912 40.1272 176.2353 110 R 4.1729 7.5181 122.9732 56.1959 30.1277 174.9675 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 4.50 0.00 2.03 2.12 0.00 0.00 0.00 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.52 0.00 2 E 8.04 4.37 0.00 1.99 1.83 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 2.23 2.36 0.00 3 T 7.81 3.30 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 1.26 0.00 0.00 4 I 8.04 4.85 2.11 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.54 0.92 0.00 0.00 5 A 8.18 5.00 1.19 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 6 K 8.23 4.54 0.00 1.86 1.68 0.00 1.48 0.00 0.00 1.58 0.00 0.00 2.74 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.27 1.40 7.81 7 H 9.33 4.75 0.00 3.14 3.12 0.00 5.54 0.00 0.00 0.00 0.00 6.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 R 8.76 5.18 0.00 1.72 1.88 0.00 3.22 0.00 0.00 3.17 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.62 0.00 9 H 9.26 4.30 0.00 3.25 3.67 0.00 5.93 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 10 A 7.37 3.81 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 11 R 8.25 4.64 0.00 1.80 1.90 0.00 3.38 0.00 0.00 3.14 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.55 0.00 12 S 7.15 4.38 0.00 3.76 3.65 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 13 S 8.35 4.72 0.00 4.06 3.94 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 14 A 8.31 4.01 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 15 Q 7.92 3.94 0.00 2.06 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 7.02 0.00 0.00 0.00 0.00 0.00 2.34 2.45 0.00 16 K 8.49 4.10 0.00 1.79 1.82 0.00 1.72 0.00 0.00 1.56 0.00 0.00 2.88 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.45 1.43 7.81 17 V 7.57 3.52 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 0.97 0.00 0.00 0.95 0.00 0.00 18 R 8.14 3.95 0.00 2.28 2.01 0.00 3.16 0.00 0.00 3.12 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.69 0.00 19 L 7.65 4.00 0.00 1.97 1.79 0.93 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 20 V 7.57 4.09 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 0.97 0.00 0.00 0.94 0.00 0.00 21 A 7.84 3.96 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 7.76 4.63 0.00 2.72 2.74 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 23 L 7.65 4.15 0.00 1.52 1.84 0.93 0.98 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 24 I 7.22 4.34 1.88 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 1.37 0.82 0.92 0.00 0.00 25 R 7.80 3.81 0.00 1.82 1.90 0.00 3.26 0.00 0.00 3.26 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.76 0.00 26 G 8.31 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 0.00 0.00 0.00 27 K 7.92 3.96 0.00 1.76 1.82 0.00 1.81 0.00 0.00 1.71 0.00 0.00 2.81 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.47 1.47 7.81 28 K 7.81 4.51 0.00 1.84 0.87 0.00 1.68 0.00 0.00 1.75 0.00 0.00 2.91 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.54 1.50 7.81 29 V 8.44 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 0.75 0.00 0.00 0.98 0.00 0.00 30 S 8.21 4.34 0.00 3.94 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 31 Q 8.16 4.00 0.00 2.09 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 7.13 0.00 0.00 0.00 0.00 0.00 2.42 2.30 0.00 32 A 7.81 4.59 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 33 L 7.95 5.44 0.00 2.05 1.74 0.92 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 34 D 7.32 4.78 0.00 3.14 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 35 I 7.84 4.26 1.91 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 1.85 0.58 0.94 0.00 0.00 36 L 8.16 5.01 0.00 1.78 1.69 0.92 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 37 T 7.92 3.85 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 0.52 0.00 0.00 38 Y 7.61 4.85 0.00 2.91 2.83 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 39 T 9.41 4.53 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 1.22 0.00 0.00 40 N 9.48 5.03 0.00 2.93 3.03 0.00 0.00 5.96 7.13 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 41 K 7.40 4.00 0.00 1.82 1.86 0.00 1.70 0.00 0.00 1.57 0.00 0.00 3.11 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.46 1.53 7.81 42 K 8.85 3.73 0.00 1.80 1.82 0.00 1.71 0.00 0.00 1.80 0.00 0.00 2.95 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.49 1.52 7.81 43 A 8.14 4.02 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 44 A 7.77 3.95 1.40 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 0.00 0.00 45 V 7.15 4.21 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 0.67 0.00 0.00 0.91 0.00 0.00 46 L 8.45 4.38 0.00 1.79 1.69 0.66 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 47 V 7.49 3.88 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 0.69 0.00 0.00 0.95 0.00 0.00 48 K 7.48 3.92 0.00 1.93 1.81 0.00 1.67 0.00 0.00 1.53 0.00 0.00 2.84 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.41 1.42 7.81 49 K 8.08 4.10 0.00 1.85 1.97 0.00 1.77 0.00 0.00 1.74 0.00 0.00 2.93 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.51 1.50 7.81 50 V 7.37 3.77 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 0.81 0.00 0.00 1.01 0.00 0.00 51 L 8.47 3.90 0.00 1.77 1.67 0.92 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 52 E 8.66 3.85 0.00 2.12 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 2.32 2.31 0.00 53 S 7.73 4.05 0.00 3.96 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 54 A 8.51 3.93 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 55 I 8.54 3.56 2.03 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 0.93 0.91 0.00 0.00 56 A 7.87 4.00 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 57 N 8.65 4.42 0.00 2.86 2.88 0.00 0.00 6.88 7.33 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 58 A 7.63 4.67 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 59 E 7.80 3.98 0.00 2.10 2.03 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 2.68 2.46 0.00 60 H 8.12 4.26 0.00 3.14 3.40 0.00 5.75 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 61 N 7.71 4.78 0.00 3.11 2.69 0.00 0.00 7.17 7.94 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 62 D 8.61 4.29 0.00 2.78 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 63 G 8.82 3.67 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 0.00 0.00 0.00 64 A 8.45 4.51 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 65 D 8.12 4.34 0.00 2.74 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 66 I 8.47 3.99 1.88 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 1.42 0.91 1.04 0.00 0.00 67 D 8.19 4.45 0.00 2.67 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 68 D 7.56 4.96 0.00 2.79 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 69 L 7.64 5.43 0.00 1.76 1.62 0.97 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 70 K 8.02 3.83 0.00 1.86 1.79 0.00 1.75 0.00 0.00 1.87 0.00 0.00 3.00 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.55 1.54 7.81 71 V 8.72 4.03 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 0.98 0.00 0.00 72 T 8.39 4.11 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 1.23 0.00 0.00 73 K 9.30 4.27 0.00 1.84 2.07 0.00 1.69 0.00 0.00 1.83 0.00 0.00 2.88 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.59 1.47 7.81 74 I 8.49 4.83 1.88 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.72 0.96 0.00 0.00 75 F 8.51 5.18 0.00 3.13 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 76 V 8.60 4.79 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 0.80 0.00 0.00 0.95 0.00 0.00 77 D 8.43 5.07 0.00 2.70 2.63 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 78 E 8.93 4.25 0.00 1.88 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 0.00 2.32 2.34 0.00 79 G 8.51 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 0.00 0.00 0.00 0.00 80 P 0.00 4.42 0.00 2.05 2.11 0.00 3.71 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 1.91 1.89 0.00 81 S 8.63 4.15 0.00 3.77 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 82 M 8.64 4.35 0.00 1.98 2.11 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.50 0.00 83 K 8.61 4.52 0.00 1.64 1.74 0.00 1.71 0.00 0.00 1.63 0.00 0.00 2.88 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.42 1.37 7.81 84 R 8.22 4.86 0.00 1.75 1.74 0.00 3.24 0.00 0.00 3.27 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.60 0.00 85 I 8.27 4.83 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 1.23 0.73 0.96 0.00 0.00 86 M 8.35 4.70 0.00 2.02 1.92 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.45 0.00 87 P 0.00 4.61 0.00 2.11 2.06 0.00 3.76 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 1.98 1.96 0.00 88 R 9.07 4.74 0.00 1.89 1.83 0.00 3.11 0.00 0.00 3.49 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.54 0.00 89 A 8.44 3.99 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 90 K 9.23 3.78 0.00 1.94 1.97 0.00 1.83 0.00 0.00 1.71 0.00 0.00 3.01 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.32 1.42 7.81 91 G 7.83 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 92 R 7.55 4.70 0.00 1.88 1.83 0.00 3.10 0.00 0.00 3.17 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.55 0.00 93 A 8.55 5.06 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 94 D 8.38 4.68 0.00 2.57 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 95 R 8.65 4.07 0.00 1.88 1.90 0.00 3.37 0.00 0.00 3.26 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.66 0.00 96 I 7.67 3.37 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 1.41 0.83 0.94 0.00 0.00 97 L 7.69 4.13 0.00 1.57 1.61 0.92 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 98 K 8.86 4.41 0.00 1.68 1.74 0.00 1.66 0.00 0.00 1.64 0.00 0.00 2.81 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.38 1.40 7.81 99 R 8.12 4.40 0.00 1.68 1.86 0.00 3.14 0.00 0.00 3.27 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.63 0.00 100 T 7.96 4.95 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 1.24 0.00 0.00 101 S 7.15 4.91 0.00 3.85 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 0.00 102 H 8.93 5.00 0.00 3.06 3.23 0.00 5.62 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 I 8.58 3.99 1.86 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 1.18 0.50 0.86 0.00 0.00 104 T 8.26 4.54 3.11 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 0.78 0.00 0.00 105 V 7.98 4.66 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 0.89 0.00 0.00 0.86 0.00 0.00 106 V 8.76 4.73 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 0.91 0.00 0.00 0.96 0.00 0.00 107 V 8.09 4.44 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 0.78 0.00 0.00 0.97 0.00 0.00 108 S 8.15 4.75 0.00 3.98 3.81 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 0.00 109 D 8.76 4.51 0.00 2.80 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 0.00 110 R 7.52 4.17 0.00 1.80 1.80 0.00 3.29 0.00 0.00 3.27 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.53 0.00