NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 M 4.4564 8.3049 120.3270 54.6020 33.4413 174.9743 1 I 3.6249 8.1384 121.5917 61.4767 37.5827 174.4352 2 Q 4.8193 9.3504 123.7902 54.4755 33.0901 174.2882 3 R 4.7362 9.3804 123.8044 54.4775 33.5597 174.8750 4 T 4.7696 8.8738 118.7671 59.6733 68.4573 172.4398 5 P 4.7074 0.0000 0.0000 63.2440 32.2048 175.7271 6 K 4.5242 9.2199 123.3947 55.6352 33.9173 175.7088 7 I 5.1073 8.3601 124.0691 59.6539 40.3203 174.8299 8 Q 4.7616 9.1406 125.1504 54.0979 32.4085 174.3366 9 V 5.0575 8.6645 124.0001 61.4838 33.5720 173.9292 10 Y 5.3416 8.6080 124.9054 56.6540 41.7581 173.1741 11 S 5.1034 8.9411 114.2964 56.7563 64.8242 174.2169 12 R 4.1185 8.9899 123.4905 59.5559 30.0216 176.3869 13 H 5.0594 8.5363 113.4063 52.7119 31.5314 172.3799 14 P 4.3129 0.0000 0.0000 62.8581 31.5752 176.4093 15 A 4.2441 8.8165 126.1246 52.2552 19.0025 176.5628 16 E 4.6072 8.5989 121.9997 54.1332 32.4316 175.1003 17 N 4.5888 8.8962 121.4190 55.3041 38.9139 175.6568 18 G 3.9371 8.9635 110.8831 45.2338 0.0000 173.1505 19 K 4.5403 7.5056 119.3365 53.8285 34.1311 176.5225 20 S 4.2469 8.3659 117.8825 59.1344 63.8970 173.5190 21 N 4.8423 8.3064 118.7074 53.7185 43.0997 172.2737 22 F 5.2349 8.8490 114.7061 56.1283 43.8321 173.2570 23 L 4.1327 8.7728 126.0374 53.3633 43.5256 174.8120 24 N 5.3791 8.9883 123.9861 51.4977 42.0216 173.0841 25 C 5.3348 9.2143 121.9923 55.1674 41.9439 172.0353 26 Y 5.3671 9.2704 129.2680 56.6545 40.0176 174.4088 27 V 5.0367 8.7121 120.9623 59.6825 34.4365 175.2385 28 S 5.0028 8.7871 118.3645 57.6891 67.0285 174.4017 29 G 4.5197 8.6831 106.3363 47.2190 0.0000 173.3454 30 F 5.2818 7.5060 113.8145 55.4676 41.4550 173.5778 31 H 5.1591 9.0424 116.5239 54.9314 33.7239 172.4331 32 P 4.6371 0.0000 0.0000 62.5594 32.5111 175.5959 33 S 4.1392 8.4685 112.6173 60.3343 63.4708 174.3952 34 D 4.3824 7.8878 121.1221 54.8896 40.9239 175.3103 35 I 4.5543 7.8884 122.0960 59.8156 41.3554 172.8978 36 E 4.5664 9.1063 129.1685 54.3032 32.1444 174.6185 37 V 4.5799 8.0126 126.1143 61.0588 34.0691 174.1418 38 D 4.9574 8.8584 126.7442 52.4384 45.2246 174.4831 39 L 5.0285 8.3411 120.7010 53.2041 44.3112 175.3563 40 L 5.2077 9.3079 123.1389 52.7400 45.3824 175.3829 41 K 4.2985 9.0003 124.1541 54.5469 34.4084 175.9427 42 N 4.1091 9.8898 128.1826 54.3079 36.6570 175.4635 43 G 3.9912 8.3286 105.6575 45.0432 0.0000 173.1668 44 E 4.5219 7.8870 120.5554 53.8607 31.2564 174.9441 45 R 4.3758 8.3631 125.6342 56.1935 30.5836 176.2428 46 I 3.9880 8.6161 127.5322 61.4200 37.8867 176.1006 47 E 4.0722 8.8469 125.0301 59.2220 29.6965 178.0786 48 K 4.2189 7.6963 121.9952 54.7584 30.7227 173.7354 49 V 4.4796 7.8229 121.5672 60.5738 34.0864 174.1704 50 E 4.6178 8.3199 127.0474 55.0949 32.6084 174.1454 51 H 5.7359 7.9121 114.4610 54.2100 31.3652 173.3269 52 S 4.5542 8.5760 114.9282 58.1718 64.2618 173.0385 53 D 4.6114 8.4570 119.9648 53.1972 41.4265 176.4627 54 L 4.0251 8.4106 125.3176 56.2002 42.8823 175.8385 55 S 4.6666 8.1220 119.7628 57.7269 66.5209 171.8048 56 F 5.1498 7.5070 114.1401 56.2127 40.5680 174.3562 57 S 4.7258 9.0017 116.9694 57.1654 64.7791 175.2713 58 K 3.6710 8.5136 119.7524 59.9023 31.6810 177.7757 59 D 4.4651 7.8340 115.3647 53.0091 39.3124 177.1941 60 W 3.7736 7.7853 119.3296 56.7853 28.1443 174.7322 61 S 4.3622 8.0022 114.4525 58.1172 63.9082 174.3091 62 F 4.9735 8.4497 121.8996 57.7302 39.2179 173.8383 63 Y 5.5009 8.2075 117.1498 56.0712 41.5174 173.8788 64 L 5.1731 9.6313 121.2007 53.1916 46.9853 174.7993 65 L 5.3434 9.0901 124.1434 53.9351 44.1620 174.5685 66 Y 5.0640 9.1325 124.7143 56.7581 40.4313 174.4005 67 Y 5.8204 8.3059 119.6338 57.3901 41.9362 173.3081 68 T 5.0246 8.3019 113.7529 60.7805 71.0786 172.4962 69 E 3.9397 8.5406 126.7327 56.4868 30.2922 176.0651 70 F 4.7322 8.6123 116.4645 56.3820 41.8126 173.2182 71 T 4.6059 8.1110 117.0070 60.7795 70.1496 172.3901 72 P 4.3500 0.0000 0.0000 63.2114 32.7063 175.5434 73 T 5.0822 8.3532 116.2784 61.7979 72.8351 173.9392 74 E 4.0786 8.8125 123.4106 59.3717 29.7351 178.0560 75 K 4.0984 7.9278 118.7737 59.1657 32.7143 176.4550 76 D 4.6113 8.0422 118.1377 54.9091 41.5449 175.6561 77 E 4.9562 9.2273 122.8881 54.9694 32.2241 174.6886 78 Y 5.3065 8.7677 119.3283 56.6171 42.4929 174.0969 79 A 5.1575 8.9416 122.1404 51.3759 23.7926 173.9995 80 C 5.3235 9.5070 119.4000 54.8119 47.8564 172.6582 81 R 5.0733 8.8895 125.6620 54.6214 32.5360 173.9756 82 V 4.7889 8.8995 126.7959 61.1509 34.4711 174.0008 83 N 5.3149 8.8383 123.7619 52.0996 42.4920 172.7856 84 H 4.7767 8.2828 119.0626 55.4761 32.8759 174.9969 85 V 3.5738 8.1864 115.6775 64.4138 31.2304 177.5681 86 T 4.2386 8.0906 107.9884 62.0532 69.1453 173.4907 87 L 4.9408 7.8297 123.4148 52.9643 43.6790 176.3984 88 S 4.2868 9.0127 120.5797 61.0924 62.9316 174.2455 89 Q 4.5919 7.5029 114.2407 53.0132 31.6427 172.3302 90 P 4.3218 0.0000 0.0000 63.3895 31.9220 175.6651 91 K 4.3956 9.0228 126.1938 55.3331 33.7962 175.0197 92 I 4.9256 8.3678 128.0717 59.5832 39.3347 174.9629 93 V 4.4484 8.8690 127.5519 60.8734 33.9587 174.7859 94 K 4.7629 8.7573 127.4640 55.8237 33.1040 176.4000 95 W 4.6494 9.1618 135.0000 57.1740 31.7089 174.8497 96 D 4.5914 8.4507 126.4151 51.8734 42.5743 176.7434 97 R 3.5280 7.7549 122.9603 58.3679 29.5733 176.7993 98 D 4.7613 8.2060 117.8138 54.3706 40.9863 176.3436 99 M 4.3838 7.8146 124.8062 55.6223 33.0260 174.9795 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 0 M 8.30 4.46 0.00 2.03 2.08 0.00 0.00 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.56 0.00 1 I 8.14 3.62 1.81 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 1.41 0.56 0.89 0.00 0.00 2 Q 9.35 4.82 0.00 1.92 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.69 6.68 0.00 0.00 0.00 0.00 0.00 2.32 2.55 0.00 3 R 9.38 4.74 0.00 1.90 1.98 0.00 3.18 0.00 0.00 3.14 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.60 0.00 4 T 8.87 4.77 4.28 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 1.25 0.00 0.00 5 P 0.00 4.71 0.00 1.98 1.69 0.00 3.75 0.00 0.00 3.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.75 0.00 6 K 9.22 4.52 0.00 1.77 1.81 0.00 1.66 0.00 0.00 1.69 0.00 0.00 2.87 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.47 7.81 7 I 8.36 5.11 1.91 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 1.32 0.61 0.96 0.00 0.00 8 Q 9.14 4.76 0.00 2.32 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.76 0.00 0.00 0.00 0.00 0.00 2.35 2.41 0.00 9 V 8.66 5.06 2.35 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 0.94 0.00 0.00 1.08 0.00 0.00 10 Y 8.61 5.34 0.00 3.20 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 11 S 8.94 5.10 0.00 4.37 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 12 R 8.99 4.12 0.00 1.82 2.12 0.00 3.20 0.00 0.00 3.06 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.49 0.00 13 H 8.54 5.06 0.00 3.24 3.24 0.00 5.73 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 14 P 0.00 4.31 0.00 2.11 2.08 0.00 3.80 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 2.09 2.17 0.00 15 A 8.82 4.24 1.61 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 16 E 8.60 4.61 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 2.30 2.33 0.00 17 N 8.90 4.59 0.00 2.72 2.80 0.00 0.00 7.27 7.65 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 18 G 8.96 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 0.00 0.00 0.00 19 K 7.51 4.54 0.00 1.86 1.68 0.00 1.71 0.00 0.00 1.74 0.00 0.00 2.84 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.35 1.48 7.81 20 S 8.37 4.25 0.00 3.89 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 21 N 8.31 4.84 0.00 2.78 2.70 0.00 0.00 7.04 7.24 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 22 F 8.85 5.23 0.00 2.94 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 23 L 8.77 4.13 0.00 0.27 0.58 -0.26 -0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 24 N 8.99 5.38 0.00 1.57 2.03 0.00 0.00 5.97 7.67 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 25 C 9.21 5.33 0.00 2.94 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 9.27 5.37 0.00 3.42 3.16 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 27 V 8.71 5.04 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 0.61 0.00 0.00 1.02 0.00 0.00 28 S 8.79 5.00 0.00 3.89 3.37 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 29 G 8.68 4.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 F 7.51 5.28 0.00 3.02 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 0.00 31 H 9.04 5.16 0.00 3.30 3.22 0.00 5.58 0.00 0.00 0.00 0.00 6.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 P 0.00 4.64 0.00 2.13 2.17 0.00 3.90 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 2.01 2.00 0.00 33 S 8.47 4.14 0.00 3.13 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 34 D 7.89 4.38 0.00 2.65 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 35 I 7.89 4.55 1.66 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.53 0.90 0.00 0.00 36 E 9.11 4.57 0.00 1.96 1.67 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 2.09 2.11 0.00 37 V 8.01 4.58 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 0.40 0.00 0.00 0.53 0.00 0.00 38 D 8.86 4.96 0.00 2.51 2.43 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 39 L 8.34 5.03 0.00 1.56 1.52 0.85 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 40 L 9.31 5.21 0.00 1.53 1.51 0.92 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 41 K 9.00 4.30 0.00 1.84 1.62 0.00 1.91 0.00 0.00 1.66 0.00 0.00 2.85 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.12 0.85 7.81 42 N 9.89 4.11 0.00 2.73 2.77 0.00 0.00 7.21 8.04 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 43 G 8.33 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 44 E 7.89 4.52 0.00 1.98 1.78 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 2.22 2.21 0.00 45 R 8.36 4.38 0.00 1.79 1.82 0.00 3.41 0.00 0.00 3.20 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.63 0.00 46 I 8.62 3.99 1.88 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.80 0.92 0.00 0.00 47 E 8.85 4.07 0.00 1.94 2.00 0.00 0.00 0.00 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 2.35 0.00 48 K 7.70 4.22 0.00 1.71 1.73 0.00 1.74 0.00 0.00 1.63 0.00 0.00 2.94 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.38 1.36 7.81 49 V 7.82 4.48 2.11 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 1.01 0.00 0.00 0.94 0.00 0.00 50 E 8.32 4.62 0.00 1.16 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.06 0.00 51 H 7.91 5.74 0.00 2.28 1.76 0.00 5.33 0.00 0.00 0.00 0.00 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 S 8.58 4.55 0.00 3.99 4.07 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 0.00 0.00 0.00 53 D 8.46 4.61 0.00 2.70 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 54 L 8.41 4.03 0.00 1.63 1.62 0.79 0.62 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 55 S 8.12 4.67 0.00 3.84 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 56 F 7.51 5.15 0.00 2.98 2.51 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 57 S 9.00 4.73 0.00 4.09 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 58 K 8.51 3.67 0.00 1.61 1.71 0.00 1.57 0.00 0.00 1.70 0.00 0.00 3.10 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.36 1.38 7.81 59 D 7.83 4.47 0.00 2.78 2.71 0.00 0.00 0.00 0.00 0.00 0.00 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 W 7.79 3.77 0.00 3.32 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 61 S 8.00 4.36 0.00 4.04 4.05 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 62 F 8.45 4.97 0.00 1.61 2.31 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 63 Y 8.21 5.50 0.00 3.03 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 L 9.63 5.17 0.00 1.85 1.63 1.18 0.33 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 65 L 9.09 5.34 0.00 2.07 1.74 1.13 0.78 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 66 Y 9.13 5.06 0.00 3.12 2.84 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 0.00 67 Y 8.31 5.82 0.00 3.17 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 68 T 8.30 5.02 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 1.07 0.00 0.00 69 E 8.54 3.94 0.00 1.66 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.47 0.00 70 F 8.61 4.73 0.00 2.80 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 T 8.11 4.61 4.14 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 1.11 0.00 0.00 72 P 0.00 4.35 0.00 2.20 2.13 0.00 3.46 0.00 0.00 2.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 1.70 0.00 73 T 8.35 5.08 4.44 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 74 E 8.81 4.08 0.00 1.95 2.00 0.00 0.00 0.00 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 2.31 0.00 75 K 7.93 4.10 0.00 1.79 1.83 0.00 1.86 0.00 0.00 1.72 0.00 0.00 2.97 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.43 1.47 7.81 76 D 8.04 4.61 0.00 2.92 2.46 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 77 E 9.23 4.96 0.00 1.86 1.88 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 2.27 2.26 0.00 78 Y 8.77 5.31 0.00 3.07 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 79 A 8.94 5.16 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 80 C 9.51 5.32 0.00 2.95 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 R 8.89 5.07 0.00 1.85 1.68 0.00 3.07 0.00 0.00 3.07 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.50 0.00 82 V 8.90 4.79 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.82 0.00 0.00 83 N 8.84 5.31 0.00 2.52 2.59 0.00 0.00 6.35 8.10 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 84 H 8.28 4.78 0.00 3.03 3.03 0.00 5.68 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 V 8.19 3.57 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 0.72 0.00 0.00 0.84 0.00 0.00 86 T 8.09 4.24 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 1.33 0.00 0.00 87 L 7.83 4.94 0.00 1.62 1.79 0.89 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 88 S 9.01 4.29 0.00 3.86 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 89 Q 7.50 4.59 0.00 2.08 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.56 6.78 0.00 0.00 0.00 0.00 0.00 2.21 2.35 0.00 90 P 0.00 4.32 0.00 1.93 2.05 0.00 3.65 0.00 0.00 3.64 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 91 K 9.02 4.40 0.00 1.86 1.65 0.00 1.49 0.00 0.00 1.65 0.00 0.00 2.97 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.38 1.45 7.81 92 I 8.37 4.93 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 1.22 0.75 0.93 0.00 0.00 93 V 8.87 4.45 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 0.92 0.00 0.00 0.97 0.00 0.00 94 K 8.76 4.76 0.00 1.75 1.81 0.00 1.82 0.00 0.00 1.66 0.00 0.00 2.87 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.50 1.48 7.81 95 W 9.16 4.65 0.00 3.31 3.44 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.45 4.59 0.00 2.61 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 97 R 7.75 3.53 0.00 1.80 1.20 0.00 3.00 0.00 0.00 3.18 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.51 0.00 98 D 8.21 4.76 0.00 2.67 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 99 M 7.81 4.38 0.00 1.99 1.92 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.45 0.00