NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 K 4.3119 8.2993 120.1355 56.4943 34.3481 176.4355 6 T 3.7903 7.8775 108.3119 60.7467 69.1391 168.0907 7 V 4.3734 8.8223 124.4870 60.9468 35.2205 175.9447 8 I 4.0966 8.0930 126.9063 60.6196 37.8247 176.3671 9 K 4.4267 8.1416 125.0152 53.1020 32.0831 174.0546 10 P 4.4398 0.0000 0.0000 62.6820 32.6717 177.3423 11 L 4.8421 7.8265 119.6075 55.5981 43.2307 176.5658 12 G 4.0398 7.9402 106.0320 47.5816 0.0000 173.0199 13 D 4.4896 9.1081 119.7987 54.0859 39.0199 175.0854 14 R 4.3614 8.4608 120.3008 56.5521 31.2528 176.4284 15 V 4.5742 8.5064 116.3907 59.6529 35.5441 174.9106 16 V 4.4985 7.9781 119.0650 61.5260 33.6419 174.3955 17 V 5.1064 8.2653 128.1590 60.7199 34.2663 174.7740 18 K 4.8145 8.2352 126.3371 54.4497 33.7255 174.7083 19 R 5.0528 8.1066 125.3231 54.5386 31.8908 175.8033 20 I 4.6501 8.1356 121.6204 59.1894 39.8131 175.4653 21 E 4.1065 8.8663 125.8923 55.8281 30.2683 176.8377 22 E 4.1344 8.4951 121.4516 55.9178 30.2511 176.6138 23 E 4.1281 8.5828 120.7819 56.1659 29.9954 175.9899 24 P 4.3043 0.0000 0.0000 65.2464 31.5445 177.0647 25 K 4.7118 7.9433 114.9281 54.3123 34.7743 173.8781 26 T 4.8184 7.7412 109.3285 59.9371 71.0817 174.4454 27 K 4.1272 8.7445 119.3835 59.1398 32.5711 177.3881 28 G 3.8511 7.8834 107.2123 45.1660 0.0000 174.5012 29 G 3.8844 7.8665 107.6051 44.9704 0.0000 173.9037 30 I 3.7109 7.5189 120.8572 60.8278 36.4607 175.3047 31 V 4.0121 8.1555 126.6926 62.7118 31.5174 175.4167 32 L 4.4324 8.0834 130.5232 54.0465 43.1715 174.5167 33 P 4.6054 0.0000 0.0000 61.6654 32.9488 177.3191 34 D 4.7449 8.7029 120.0015 54.2472 38.6399 176.9118 35 T 4.4384 7.7859 116.6767 64.4677 71.0028 175.4340 36 A 4.2152 8.4890 124.3967 54.1669 19.0270 178.1840 37 K 4.1179 7.8485 114.4436 56.6819 33.3617 176.6732 38 E 4.4807 8.3340 122.4939 54.1478 31.5188 175.6318 39 K 3.9933 8.4101 119.5265 55.9920 32.3667 175.7359 40 P 4.3064 0.0000 0.0000 63.4533 31.7566 175.9202 41 Q 3.5769 8.3539 117.5442 55.3044 29.1546 174.8717 42 K 5.7978 7.8784 117.5246 52.9407 36.3391 175.1046 43 G 4.6628 8.0251 110.7943 46.3062 0.0000 171.2599 44 K 5.7925 7.7928 119.4831 53.8892 34.1907 176.3593 45 V 4.1878 8.3043 123.9295 63.1621 32.4911 176.0438 46 I 4.4940 8.7665 126.9743 60.6380 38.7763 175.4918 47 A 4.2511 7.3562 118.4754 51.3345 21.1451 176.2387 48 V 3.8736 8.5632 114.7550 61.9819 33.1150 175.8833 49 G 4.3099 7.6750 109.3654 44.2013 0.0000 172.5315 50 T 3.9936 8.6365 115.1551 64.2077 69.5862 175.4521 51 G 4.4235 8.6888 111.4662 45.6890 0.0000 172.0331 52 R 4.3855 8.3825 116.7502 54.8165 30.9813 175.7356 53 V 3.7531 8.5122 124.6437 62.8127 30.1371 175.1615 54 L 4.2037 8.9047 131.2774 54.3818 42.6802 177.3494 55 E 4.1552 8.7074 120.0094 58.1744 30.1127 176.4112 56 N 4.8470 7.5235 114.3758 52.4989 36.5926 173.5590 57 G 3.9909 8.1536 105.8295 47.1777 0.0000 170.6005 58 Q 4.2079 8.4184 120.5423 55.3410 29.9554 175.5710 59 R 4.7968 8.5568 124.3879 54.6395 30.4340 175.9352 60 V 3.7077 8.1213 124.7348 62.0235 32.3418 174.1082 61 P 4.6782 0.0000 0.0000 62.2428 32.1772 176.0818 62 L 4.1921 8.2307 120.8445 54.6275 42.1294 178.1439 63 E 4.2062 8.8564 119.8760 57.1800 29.1559 176.5112 64 V 4.3835 7.5907 119.2950 60.7422 33.7830 175.5840 65 K 4.2842 9.2762 126.7801 55.8043 32.9427 176.8569 66 E 4.4445 8.3943 122.9345 53.8775 26.8682 175.5823 67 G 3.9270 7.5927 116.1873 44.9883 0.0000 170.0731 68 D 4.7868 7.4610 121.7687 53.0322 43.5165 175.6823 69 I 4.5991 8.1588 120.7506 60.6060 38.3611 175.2522 70 V 4.8072 9.0771 128.0761 61.1907 34.4019 174.6345 71 V 4.8277 8.7185 126.4531 61.2037 33.2680 174.3933 72 F 5.5409 8.9028 122.3993 53.5543 41.4133 175.8646 73 A 4.1155 8.8337 122.1299 51.4820 15.9358 178.8819 74 K 4.1265 7.5044 120.6000 59.6959 33.8727 178.2556 75 Y 4.2345 7.7212 117.4671 59.1870 38.1113 176.3725 76 G 3.8718 7.5091 108.9367 44.6482 0.0000 170.4269 77 G 3.8288 8.7099 112.7143 45.1906 0.0000 173.7668 78 T 4.1264 8.3776 121.3141 64.2863 69.8274 172.8676 79 E 5.2228 8.5377 121.5608 55.1047 33.2433 175.1551 80 I 4.6539 8.7684 122.0263 60.3196 42.3017 173.2475 81 E 5.0564 8.6800 124.2688 55.0585 32.4208 175.4245 82 I 4.5077 9.4653 125.6058 61.5611 41.5659 175.0299 83 D 4.2346 9.9014 125.9309 55.4361 38.9079 173.5037 84 G 3.6014 8.1986 101.8860 44.1234 0.0000 173.3010 85 E 5.0082 7.2156 119.1472 55.7431 34.4962 175.8056 86 E 4.9627 8.4898 124.6305 55.0089 32.3475 174.4837 87 Y 4.9335 9.4975 119.6179 56.6862 43.4238 173.5476 88 V 4.6782 8.7777 119.2568 61.7374 34.4538 175.1794 89 I 4.4621 8.5345 129.8589 59.8895 36.5364 175.3859 90 L 4.5538 8.0210 126.7514 53.4113 43.4088 176.4096 91 S 4.9736 8.3201 116.8554 57.4195 65.5514 174.6191 92 E 4.1847 8.9823 119.6791 59.6216 29.8483 179.4322 93 R 3.9510 8.1138 116.8422 59.4241 30.2697 177.8041 94 D 4.4048 7.6082 115.2692 56.5299 41.0004 176.1751 95 L 4.4079 7.5908 119.9328 54.5948 41.6841 176.3444 96 L 4.4478 8.8569 124.7487 56.8192 43.0839 176.3086 97 A 4.4559 7.2535 117.6017 51.6902 22.6809 174.9606 98 V 4.8164 8.2965 115.8408 61.4796 34.8925 174.9723 99 L 4.5546 8.8756 127.4157 53.3993 42.8607 176.6599 100 Q 4.1890 8.6051 123.7872 56.1398 29.1725 174.8595 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 5 K 8.30 4.31 0.00 1.76 1.94 0.00 1.74 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.35 1.38 7.81 6 T 7.88 3.79 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 7 V 8.82 4.37 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 0.82 0.00 0.00 0.91 0.00 0.00 8 I 8.09 4.10 1.71 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.44 0.82 0.00 0.00 9 K 8.14 4.43 0.00 1.67 1.70 0.00 1.74 0.00 0.00 1.73 0.00 0.00 3.03 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.29 1.35 7.81 10 P 0.00 4.44 0.00 2.33 2.00 0.00 3.74 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.20 0.00 11 L 7.83 4.84 0.00 1.69 1.55 0.91 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 12 G 7.94 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 0.00 0.00 0.00 13 D 9.11 4.49 0.00 2.93 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 14 R 8.46 4.36 0.00 1.90 1.84 0.00 2.96 0.00 0.00 3.14 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.59 0.00 15 V 8.51 4.57 2.01 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 0.68 0.00 0.00 0.89 0.00 0.00 16 V 7.98 4.50 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 0.66 0.00 0.00 0.83 0.00 0.00 17 V 8.27 5.11 1.81 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 0.92 0.00 0.00 0.70 0.00 0.00 18 K 8.24 4.81 0.00 2.22 1.77 0.00 1.65 0.00 0.00 1.58 0.00 0.00 2.81 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.49 1.53 7.81 19 R 8.11 5.05 0.00 1.78 1.92 0.00 3.30 0.00 0.00 3.95 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.69 0.00 20 I 8.14 4.65 1.89 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 1.44 0.72 0.93 0.00 0.00 21 E 8.87 4.11 0.00 2.07 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 2.27 2.27 0.00 22 E 8.50 4.13 0.00 1.95 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 2.30 2.37 0.00 23 E 8.58 4.13 0.00 2.09 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 2.36 0.00 24 P 0.00 4.30 0.00 2.17 2.09 0.00 3.57 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 2.10 0.00 25 K 7.94 4.71 0.00 1.73 1.66 0.00 1.75 0.00 0.00 2.49 0.00 0.00 3.02 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.36 1.36 7.81 26 T 7.74 4.82 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 27 K 8.74 4.13 0.00 1.88 1.98 0.00 1.54 0.00 0.00 1.70 0.00 0.00 3.00 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.40 1.44 7.81 28 G 7.88 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 0.00 0.00 0.00 29 G 7.87 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 0.00 0.00 0.00 30 I 7.52 3.71 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 1.30 1.12 0.91 0.00 0.00 31 V 8.16 4.01 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 0.73 0.00 0.00 0.93 0.00 0.00 32 L 8.08 4.43 0.00 1.70 1.54 0.92 0.98 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 33 P 0.00 4.61 0.00 2.15 2.15 0.00 3.75 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 1.96 0.00 34 D 8.70 4.74 0.00 2.80 2.80 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 35 T 7.79 4.44 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 36 A 8.49 4.22 1.30 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 0.00 0.00 37 K 7.85 4.12 0.00 1.87 1.83 0.00 1.56 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.57 1.45 7.81 38 E 8.33 4.48 0.00 1.96 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 0.00 2.25 2.31 0.00 39 K 8.41 3.99 0.00 1.75 1.78 0.00 1.80 0.00 0.00 1.80 0.00 0.00 3.09 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.46 1.45 7.81 40 P 0.00 4.31 0.00 2.16 2.30 0.00 3.75 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 2.03 2.05 0.00 41 Q 8.35 3.58 0.00 1.85 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.74 0.00 0.00 0.00 0.00 0.00 2.07 2.16 0.00 42 K 7.88 5.80 0.00 1.68 1.72 0.00 2.08 0.00 0.00 1.76 0.00 0.00 2.84 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.39 1.17 7.81 43 G 8.03 4.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.79 5.79 0.00 1.75 1.74 0.00 1.97 0.00 0.00 1.72 0.00 0.00 3.05 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.47 1.29 7.81 45 V 8.30 4.19 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 0.96 0.00 0.00 0.91 0.00 0.00 46 I 8.77 4.49 1.68 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 1.41 1.09 0.81 0.00 0.00 47 A 7.36 4.25 1.14 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 0.00 0.00 0.00 0.00 0.00 48 V 8.56 3.87 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 0.75 0.00 0.00 0.90 0.00 0.00 49 G 7.68 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 0.00 0.00 0.00 0.00 50 T 8.64 3.99 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 1.20 0.00 0.00 51 G 8.69 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 52 R 8.38 4.39 0.00 1.89 2.08 0.00 2.97 0.00 0.00 3.51 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.61 0.00 53 V 8.51 3.75 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 0.75 0.00 0.00 0.93 0.00 0.00 54 L 8.90 4.20 0.00 1.88 1.58 0.92 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 55 E 8.71 4.16 0.00 1.95 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 2.29 2.36 0.00 56 N 7.52 4.85 0.00 2.91 2.90 0.00 0.00 6.95 7.18 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 57 G 8.15 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 58 Q 8.42 4.21 0.00 1.97 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.81 6.83 0.00 0.00 0.00 0.00 0.00 2.36 2.75 0.00 59 R 8.56 4.80 0.00 1.68 1.90 0.00 3.20 0.00 0.00 3.14 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.61 0.00 60 V 8.12 3.71 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 0.93 0.00 0.00 0.93 0.00 0.00 61 P 0.00 4.68 0.00 2.07 1.96 0.00 3.72 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.10 0.00 62 L 8.23 4.19 0.00 1.73 1.57 0.98 0.87 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 63 E 8.86 4.21 0.00 1.95 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 2.31 2.30 0.00 64 V 7.59 4.38 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 0.87 0.00 0.00 0.93 0.00 0.00 65 K 9.28 4.28 0.00 2.14 1.70 0.00 1.72 0.00 0.00 1.57 0.00 0.00 2.87 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.45 1.37 7.81 66 E 8.39 4.44 0.00 1.90 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 2.27 2.27 0.00 67 G 7.59 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 68 D 7.46 4.79 0.00 2.59 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 69 I 8.16 4.60 1.89 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 1.25 0.71 0.94 0.00 0.00 70 V 9.08 4.81 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 1.05 0.00 0.00 0.99 0.00 0.00 71 V 8.72 4.83 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 0.91 0.00 0.00 0.93 0.00 0.00 72 F 8.90 5.54 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 73 A 8.83 4.12 0.70 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 0.00 0.00 74 K 7.50 4.13 0.00 1.80 1.60 0.00 1.62 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.32 1.51 7.81 75 Y 7.72 4.23 0.00 3.07 3.18 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 76 G 7.51 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 0.00 0.00 0.00 77 G 8.71 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 78 T 8.38 4.13 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 79 E 8.54 5.22 0.00 1.82 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 2.23 2.45 0.00 80 I 8.77 4.65 1.93 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 1.13 0.71 0.95 0.00 0.00 81 E 8.68 5.06 0.00 1.92 1.80 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 2.19 2.38 0.00 82 I 9.47 4.51 2.06 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 1.36 0.71 0.95 0.00 0.00 83 D 9.90 4.23 0.00 2.79 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 84 G 8.20 3.60 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 0.00 0.00 0.00 85 E 7.22 5.01 0.00 2.01 1.81 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 2.00 1.47 0.00 86 E 8.49 4.96 0.00 1.91 1.80 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 2.03 2.16 0.00 87 Y 9.50 4.93 0.00 2.77 3.13 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 88 V 8.78 4.68 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 1.02 0.00 0.00 0.97 0.00 0.00 89 I 8.53 4.46 1.85 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 1.45 0.88 0.00 0.00 90 L 8.02 4.55 0.00 1.39 1.40 -0.31 0.67 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 91 S 8.32 4.97 0.00 3.80 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 92 E 8.98 4.18 0.00 2.09 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 2.37 2.32 0.00 93 R 8.11 3.95 0.00 1.85 2.00 0.00 3.28 0.00 0.00 3.24 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.67 0.00 94 D 7.61 4.40 0.00 2.64 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 95 L 7.59 4.41 0.00 1.83 1.64 0.92 0.94 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 96 L 8.86 4.45 0.00 1.69 1.72 0.87 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 97 A 7.25 4.46 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 98 V 8.30 4.82 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 0.93 0.00 0.00 0.94 0.00 0.00 99 L 8.88 4.55 0.00 1.53 1.59 0.93 0.71 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 0.00 100 Q 8.61 4.19 0.00 1.96 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.85 6.65 0.00 0.00 0.00 0.00 0.00 2.24 2.37 0.00