NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 R 4.3410 8.2549 119.7096 55.6655 30.3746 173.4834 3 H 3.5032 8.4126 117.2770 55.8034 29.2547 171.8268 4 L 3.9666 10.8200 129.0885 55.8850 43.0987 173.4075 5 K 4.4682 8.2889 121.7969 56.8981 37.2117 175.3923 6 S 4.5543 7.9156 112.4627 57.3557 65.7633 174.6905 7 G 4.2062 9.5463 114.6643 44.7173 0.0000 171.2671 8 R 3.7181 8.7004 113.0751 54.7403 28.9700 174.0785 9 K 4.0386 7.8815 121.7430 57.0401 33.3170 177.9031 10 L 4.0453 7.9595 118.1945 54.5516 44.2966 174.2193 11 N 4.6900 9.9419 123.5881 54.0642 39.6022 173.9268 12 R 4.6131 7.6257 123.3540 55.2673 32.8091 173.8824 13 H 4.9124 7.5989 115.0014 55.4969 31.8369 174.8477 14 S 3.5253 8.5486 111.3756 61.0709 63.2838 176.5822 15 S 3.8808 8.0726 114.7155 61.0613 62.8508 176.0531 16 H 3.9831 7.9609 119.8225 59.4933 29.6386 177.0985 17 R 3.6079 8.1145 120.6501 59.2166 29.6785 178.2607 18 L 3.3452 7.7541 119.6042 57.9942 42.1738 178.4761 19 A 3.9644 7.8389 120.7073 55.4053 18.1027 178.8324 20 L 3.8416 8.2094 118.7677 58.6660 41.9894 178.4672 21 Y 4.3635 7.4971 115.9078 61.6958 37.8901 179.0147 22 R 4.3037 8.0534 118.2462 59.8678 30.0170 178.7434 23 N 4.5265 8.7001 116.3397 56.1043 38.5542 176.8681 24 Q 4.0770 7.8907 118.3812 58.0309 29.6173 177.4030 25 A 4.0618 8.7979 122.1078 55.5326 18.1302 179.8140 26 K 3.9172 8.3978 115.8100 59.7339 32.3902 179.4501 27 S 4.3024 7.5216 115.0379 61.5009 62.7258 176.3788 28 L 4.0399 8.4873 123.1900 58.2351 41.5627 179.2139 29 L 4.5521 8.0543 115.4654 55.3711 41.5604 177.7422 30 T 4.3906 7.5862 114.9175 65.2253 71.3034 174.7403 31 H 4.6523 8.5389 115.3364 54.9800 29.5052 175.7452 32 G 4.3861 8.8231 113.8871 45.2635 0.0000 173.7730 33 R 5.1898 7.7574 117.4864 54.0994 32.8919 175.2024 34 I 4.6611 8.6794 124.3172 59.6969 41.1406 175.0375 35 T 5.0091 8.7280 120.4260 61.3291 71.2261 172.9781 36 T 4.6749 8.0553 117.7839 59.4890 72.0537 172.9674 37 T 4.5027 7.7364 112.0461 61.2005 70.7798 174.8907 38 V 3.5015 8.3885 123.2973 66.1349 31.5214 176.4188 39 P 4.1918 0.0000 0.0000 65.8122 31.4437 178.5797 40 K 3.9186 7.8405 116.9169 59.8352 31.9169 178.9111 41 A 3.9955 8.1322 121.0196 54.8816 18.2350 179.6320 42 K 3.8077 8.5122 116.9429 59.0721 32.6310 178.6248 43 E 4.0721 8.0494 119.5605 58.5183 29.7733 177.7342 44 L 3.8559 7.6320 119.9024 59.0391 41.8968 178.2747 45 R 3.6010 8.2272 115.6302 60.3062 29.8872 178.0802 46 G 3.5724 7.8855 104.2013 47.7103 0.0000 174.7360 47 F 4.2800 7.7143 122.2426 61.0799 39.3362 177.6734 48 V 3.2997 7.9818 118.6881 64.8538 31.2218 177.5602 49 D 4.2915 7.5709 120.0711 57.6181 40.6984 178.4371 50 H 4.0120 7.8870 118.0643 59.6720 29.4581 177.1482 51 L 3.8810 6.9650 119.4162 57.7419 41.6992 179.0594 52 I 3.6450 7.7468 119.8349 64.6460 36.5871 177.7206 53 H 4.1720 9.0474 119.4202 59.5298 28.7421 176.9679 54 L 4.0621 7.6964 121.3376 57.6618 41.7102 178.5500 55 A 3.1796 7.8858 120.2686 53.9641 18.1674 179.5930 56 K 4.0647 6.9586 113.8966 59.2741 32.5846 180.2635 57 R 4.3852 8.3634 115.9204 61.8358 29.6431 179.3523 58 G 4.0514 7.3991 107.9026 48.2419 0.0000 175.3239 59 D 4.4431 9.6779 119.5737 53.5105 40.0051 177.3345 60 L 3.7601 8.7735 122.5353 58.9095 41.8945 178.6461 61 H 4.0913 8.4336 117.0806 59.5906 29.6535 176.5546 62 A 4.0221 9.3302 123.0433 55.1149 18.2292 179.3197 63 R 4.2129 7.9109 117.0594 60.1019 29.8799 179.0389 64 R 4.0208 7.9763 116.2279 58.8927 30.3529 178.9248 65 L 4.1440 7.8626 119.1358 57.8393 41.8500 179.5623 66 V 3.6949 8.4643 118.1495 65.3854 31.2067 177.6658 67 L 4.2981 7.8333 120.6581 57.0717 41.8833 178.8885 68 R 4.1020 7.5528 117.4602 59.3827 30.1333 178.3383 69 D 4.5745 7.9900 116.5534 56.1335 41.8172 176.7505 70 L 4.5334 7.4956 119.4425 53.7676 42.7640 177.0953 71 Q 4.5457 8.4644 122.2058 56.2942 30.5730 175.3582 72 D 4.4700 7.9318 116.7965 53.9839 41.5498 175.8867 73 V 3.5886 8.4589 127.6140 66.2946 31.2875 177.0288 74 K 3.7861 8.3100 118.3235 59.9305 31.9282 178.0306 75 L 3.9925 7.9779 119.7109 58.1232 41.9304 179.4763 76 V 3.7027 8.3662 119.5949 64.9044 31.2188 178.3882 77 R 4.0030 8.0614 118.5408 59.0554 30.0129 178.6299 78 K 3.8686 7.9545 119.2444 60.0577 31.9915 178.0436 79 L 3.9305 7.9349 120.5650 57.7973 41.8256 178.5783 80 F 4.0859 8.4483 117.9635 60.7594 39.1258 177.1699 81 D 4.9126 8.5411 115.9581 54.2755 41.3111 176.3047 82 E 4.8550 7.8222 120.6816 56.6987 37.4300 177.6458 83 I 3.6949 7.9741 119.0995 64.5896 37.5423 177.8605 84 A 4.0722 8.6631 121.4576 55.3525 18.1018 177.6561 85 P 4.0025 0.0000 0.0000 65.9576 31.3906 178.6084 86 R 3.5306 7.1101 115.5035 58.3793 30.4152 177.2998 87 Y 4.5445 7.7425 115.2564 57.0066 38.8813 176.8848 88 R 3.7792 8.3392 122.1207 59.4800 30.1755 176.9996 89 D 4.5525 7.8501 115.1075 55.5330 41.5432 176.6471 90 R 4.1298 7.9014 119.9380 55.7377 30.5900 175.7648 91 Q 4.4573 8.6398 126.4236 54.7257 28.8873 172.0925 92 G 3.6004 9.5945 117.9903 46.0843 0.0000 171.9097 93 G 3.6401 7.8973 108.5120 46.2133 0.0000 172.9154 94 Y 4.6216 6.4898 107.5737 57.3823 38.8337 176.2388 95 T 4.7884 7.4431 112.2701 60.9499 70.5899 172.3226 96 R 4.8048 9.3578 127.6770 54.6454 34.1231 174.6147 97 V 5.0306 8.1895 115.2224 59.8050 35.1962 174.9377 98 L 4.8699 8.7750 125.4204 52.6171 45.7668 175.7915 99 K 4.7556 8.7395 123.7827 55.8815 33.3075 176.6040 100 L 4.4340 8.1583 126.1453 54.7962 41.5814 176.9569 101 A 4.1371 8.3367 123.1933 52.9804 19.2356 176.3167 102 E 4.0712 8.8805 120.1703 57.0410 28.8388 175.2043 103 R 4.5897 8.0809 121.3197 54.4780 32.7490 175.4680 104 R 4.3209 7.9856 118.1264 55.7636 30.6798 177.5887 105 R 4.7024 8.4622 123.2039 54.1650 28.1402 174.7164 106 G 4.1583 7.8737 113.8702 45.9577 0.0000 171.8074 107 D 4.5154 8.4205 114.1671 52.6891 43.3082 174.8379 108 G 3.8066 7.9012 108.0648 46.7270 0.0000 173.5328 109 A 4.7991 7.9424 120.5323 49.2133 21.0603 176.4495 110 P 4.4551 0.0000 0.0000 62.8667 32.8165 175.3296 111 L 5.0844 8.4889 120.5717 53.3891 45.8436 175.3015 112 A 5.0389 8.5892 122.0237 50.9846 23.3497 174.5891 113 L 4.9376 8.9957 116.4813 54.3671 44.6279 175.8627 114 V 4.6514 9.2066 121.4225 61.4872 33.5051 174.1140 115 E 5.0093 8.8726 129.3682 54.6498 31.9204 175.8064 116 L 4.4509 8.1149 123.0610 54.1991 42.1600 174.3297 117 V 3.3820 8.1486 124.6458 62.1710 32.4501 171.5350 118 E 4.7632 9.0688 124.3961 55.8779 30.0385 176.2783 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 2 R 8.25 4.34 0.00 1.81 2.00 0.00 3.27 0.00 0.00 3.23 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.73 0.00 3 H 8.41 3.50 0.00 3.15 3.28 0.00 5.90 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 L 10.82 3.97 0.00 1.72 1.92 0.97 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 5 K 8.29 4.47 0.00 1.72 1.75 0.00 1.86 0.00 0.00 1.76 0.00 0.00 2.85 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.30 1.31 7.81 6 S 7.92 4.55 0.00 3.93 3.79 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 7 G 9.55 4.21 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 0.00 8 R 8.70 3.72 0.00 1.89 2.16 0.00 3.27 0.00 0.00 3.28 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.45 0.00 9 K 7.88 4.04 0.00 1.87 1.83 0.00 1.63 0.00 0.00 1.71 0.00 0.00 3.04 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.83 1.50 7.81 10 L 7.96 4.05 0.00 1.58 1.55 0.91 1.00 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 11 N 9.94 4.69 0.00 2.61 2.68 0.00 0.00 7.23 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 12 R 7.63 4.61 0.00 1.70 1.66 0.00 3.01 0.00 0.00 2.75 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 1.13 0.00 13 H 7.60 4.91 0.00 3.37 3.41 0.00 5.69 0.00 0.00 0.00 0.00 6.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 S 8.55 3.53 0.00 4.05 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 15 S 8.07 3.88 0.00 3.94 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 16 H 7.96 3.98 0.00 2.87 2.98 0.00 5.76 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 R 8.11 3.61 0.00 1.62 1.80 0.00 2.93 0.00 0.00 2.96 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 1.24 0.00 18 L 7.75 3.35 0.00 1.59 1.68 0.90 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 19 A 7.84 3.96 1.35 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 0.00 0.00 0.00 0.00 0.00 0.00 20 L 8.21 3.84 0.00 1.64 1.59 0.96 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 21 Y 7.50 4.36 0.00 2.57 1.93 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 22 R 8.05 4.30 0.00 2.10 2.22 0.00 3.22 0.00 0.00 3.47 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.96 0.00 23 N 8.70 4.53 0.00 2.99 2.94 0.00 0.00 7.09 7.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 Q 7.89 4.08 0.00 2.36 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.67 0.00 0.00 0.00 0.00 0.00 2.38 2.66 0.00 25 A 8.80 4.06 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 0.00 0.00 0.00 0.00 0.00 26 K 8.40 3.92 0.00 1.79 1.92 0.00 1.77 0.00 0.00 1.74 0.00 0.00 3.19 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.52 1.72 7.81 27 S 7.52 4.30 0.00 3.90 4.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.49 4.04 0.00 1.66 1.87 0.92 0.81 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 29 L 8.05 4.55 0.00 1.82 1.66 0.90 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 30 T 7.59 4.39 4.33 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 0.94 0.00 0.00 31 H 8.54 4.65 0.00 3.14 3.33 0.00 5.73 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 32 G 8.82 4.39 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 0.00 33 R 7.76 5.19 0.00 1.66 1.84 0.00 3.23 0.00 0.00 3.25 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.71 0.00 34 I 8.68 4.66 1.89 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 1.27 1.32 0.94 0.00 0.00 35 T 8.73 5.01 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 1.26 0.00 0.00 36 T 8.06 4.67 4.26 0.00 0.00 0.00 0.00 0.00 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 37 T 7.74 4.50 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 38 V 8.39 3.50 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 0.89 0.00 0.00 0.93 0.00 0.00 39 P 0.00 4.19 0.00 2.20 2.09 0.00 3.62 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 2.12 2.18 0.00 40 K 7.84 3.92 0.00 1.91 1.92 0.00 1.69 0.00 0.00 1.68 0.00 0.00 2.98 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.50 1.50 7.81 41 A 8.13 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 42 K 8.51 3.81 0.00 1.66 1.89 0.00 1.69 0.00 0.00 1.62 0.00 0.00 2.95 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.47 1.69 7.81 43 E 8.05 4.07 0.00 2.20 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 2.26 1.97 0.00 44 L 7.63 3.86 0.00 1.89 1.82 0.94 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 45 R 8.23 3.60 0.00 2.07 1.83 0.00 3.11 0.00 0.00 3.13 8.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.65 0.00 46 G 7.89 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.71 4.28 0.00 2.89 3.07 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 48 V 7.98 3.30 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 0.76 0.00 0.00 0.86 0.00 0.00 49 D 7.57 4.29 0.00 2.78 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 50 H 7.89 4.01 0.00 3.13 3.37 0.00 5.78 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 L 6.96 3.88 0.00 1.52 1.53 0.40 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 52 I 7.75 3.64 2.27 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.86 0.59 0.00 0.00 53 H 9.05 4.17 0.00 3.42 3.33 0.00 5.58 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 L 7.70 4.06 0.00 1.92 1.59 0.83 1.37 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 55 A 7.89 3.18 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 K 6.96 4.06 0.00 1.87 1.78 0.00 1.13 0.00 0.00 1.49 0.00 0.00 2.93 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.33 1.40 7.81 57 R 8.36 4.39 0.00 2.13 2.18 0.00 2.85 0.00 0.00 3.22 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.92 0.00 58 G 7.40 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 0.00 0.00 0.00 59 D 9.68 4.44 0.00 2.94 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 60 L 8.77 3.76 0.00 1.73 1.72 0.87 0.87 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 61 H 8.43 4.09 0.00 3.24 3.58 0.00 5.75 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 A 9.33 4.02 1.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.91 4.21 0.00 1.68 1.97 0.00 2.67 0.00 0.00 2.98 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.04 0.00 64 R 7.98 4.02 0.00 1.98 2.00 0.00 3.24 0.00 0.00 3.24 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.89 0.00 65 L 7.86 4.14 0.00 1.98 1.71 0.86 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 66 V 8.46 3.69 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 0.89 0.00 0.00 0.92 0.00 0.00 67 L 7.83 4.30 0.00 2.10 1.82 1.00 0.81 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 68 R 7.55 4.10 0.00 2.07 2.02 0.00 3.24 0.00 0.00 3.26 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.91 0.00 69 D 7.99 4.57 0.00 2.67 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 70 L 7.50 4.53 0.00 1.76 1.60 0.89 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 71 Q 8.46 4.55 0.00 2.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 7.14 0.00 0.00 0.00 0.00 0.00 2.27 2.40 0.00 72 D 7.93 4.47 0.00 2.80 2.59 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.46 3.59 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 0.99 0.00 0.00 0.95 0.00 0.00 74 K 8.31 3.79 0.00 1.92 2.20 0.00 1.68 0.00 0.00 1.75 0.00 0.00 3.02 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.52 1.59 7.81 75 L 7.98 3.99 0.00 1.96 1.82 0.95 0.96 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 76 V 8.37 3.70 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 1.10 0.00 0.00 1.07 0.00 0.00 77 R 8.06 4.00 0.00 2.18 2.06 0.00 3.17 0.00 0.00 3.09 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.80 0.00 78 K 7.95 3.87 0.00 1.78 2.06 0.00 1.63 0.00 0.00 1.58 0.00 0.00 2.91 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.66 7.81 79 L 7.93 3.93 0.00 1.94 1.72 0.64 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 80 F 8.45 4.09 0.00 3.19 3.07 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 81 D 8.54 4.91 0.00 2.64 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 82 E 7.82 4.85 0.00 2.27 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 2.30 0.00 83 I 7.97 3.69 1.95 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 1.71 0.74 1.01 0.00 0.00 84 A 8.66 4.07 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 85 P 0.00 4.00 0.00 2.21 2.06 0.00 3.68 0.00 0.00 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.22 0.00 86 R 7.11 3.53 0.00 1.42 1.52 0.00 2.98 0.00 0.00 3.30 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.51 0.00 87 Y 7.74 4.54 0.00 2.61 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 0.00 0.00 0.00 0.00 88 R 8.34 3.78 0.00 1.88 1.91 0.00 3.39 0.00 0.00 3.21 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.76 0.00 89 D 7.85 4.55 0.00 2.69 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 90 R 7.90 4.13 0.00 1.89 2.10 0.00 3.60 0.00 0.00 3.52 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.70 0.00 91 Q 8.64 4.46 0.00 2.09 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.62 0.00 0.00 0.00 0.00 0.00 2.33 2.39 0.00 92 G 9.59 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 93 G 7.90 3.64 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 0.00 0.00 0.00 94 Y 6.49 4.62 0.00 2.61 1.70 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 95 T 7.44 4.79 4.26 0.00 0.00 0.00 0.00 0.00 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 96 R 9.36 4.80 0.00 1.85 1.71 0.00 3.10 0.00 0.00 3.17 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.56 0.00 97 V 8.19 5.03 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 0.77 0.00 0.00 0.91 0.00 0.00 98 L 8.78 4.87 0.00 1.56 1.50 0.93 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 99 K 8.74 4.76 0.00 1.75 1.83 0.00 1.58 0.00 0.00 1.75 0.00 0.00 2.81 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.37 1.37 7.81 100 L 8.16 4.43 0.00 1.64 1.71 0.93 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 101 A 8.34 4.14 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.88 4.07 0.00 2.10 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 2.17 2.29 0.00 103 R 8.08 4.59 0.00 1.79 2.02 0.00 3.20 0.00 0.00 3.22 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.62 0.00 104 R 7.99 4.32 0.00 1.84 1.85 0.00 3.12 0.00 0.00 3.45 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.72 0.00 105 R 8.46 4.70 0.00 1.80 1.90 0.00 3.26 0.00 0.00 3.23 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.62 0.00 106 G 7.87 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 0.00 0.00 0.00 107 D 8.42 4.52 0.00 2.75 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 0.00 108 G 7.90 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 0.00 0.00 0.00 109 A 7.94 4.80 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 0.00 110 P 0.00 4.46 0.00 2.13 2.19 0.00 3.64 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 2.07 2.00 0.00 111 L 8.49 5.08 0.00 1.57 1.55 0.92 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 112 A 8.59 5.04 1.22 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 0.00 0.00 0.00 0.00 0.00 113 L 9.00 4.94 0.00 1.77 1.71 0.93 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 114 V 9.21 4.65 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 0.93 0.00 0.00 115 E 8.87 5.01 0.00 2.11 1.79 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 2.26 2.29 0.00 116 L 8.11 4.45 0.00 1.77 1.79 0.96 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 117 V 8.15 3.38 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 0.90 0.00 0.00 0.96 0.00 0.00 118 E 9.07 4.76 0.00 2.14 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 2.02 2.09 0.00