NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 11 K 3.8959 8.3144 120.0302 56.5098 33.3831 173.3855 12 R 4.1496 8.6690 125.7624 54.7091 35.5844 169.9689 13 Q 3.6946 8.4208 121.1273 56.3317 27.1707 171.5831 14 V 3.8375 8.8027 121.1879 63.0507 32.8552 176.3616 15 A 4.6143 8.5380 125.9310 52.3027 16.8900 176.9649 16 S 5.1322 7.3389 109.1111 55.4585 65.2529 173.0005 17 G 4.1067 8.6968 114.1373 45.2089 0.0000 170.7768 18 R 5.1808 8.4988 117.1780 54.2261 34.7358 174.8236 19 A 5.1681 8.2971 122.3916 50.5641 21.8931 174.6124 20 Y 4.7909 9.6735 122.0663 57.4712 39.8567 174.9562 21 I 4.7158 9.0762 125.8973 59.7964 40.1819 174.1773 22 H 5.0945 9.3645 127.6286 54.4591 31.1495 171.7663 23 A 5.1589 8.6366 128.2012 50.4577 20.9192 175.9200 24 S 4.7082 8.8794 115.6738 56.5300 66.6207 174.7970 25 Y 4.0624 9.3303 118.2032 60.9171 37.7056 177.5464 26 N 4.7101 8.0099 114.7836 52.9366 39.7161 174.3017 27 N 4.4603 6.6834 116.8415 53.4677 42.4027 172.6788 28 T 5.3728 7.7712 117.3183 61.6171 72.2167 172.9755 29 I 4.7634 8.7356 119.8455 59.0879 40.6265 174.7495 30 V 5.0028 8.5610 124.2257 61.6925 34.8890 174.3194 31 T 5.1134 9.2391 121.5426 62.0823 73.3598 172.9040 32 I 4.9498 8.9854 126.5964 60.1510 40.2087 174.9909 33 T 4.7818 8.7488 119.5019 60.0636 72.2747 173.1581 34 D 5.1749 8.5959 120.7723 51.0879 41.3211 174.8999 35 P 4.0647 0.0000 0.0000 66.1713 31.5456 177.5354 36 D 4.4132 8.0220 118.9949 54.6846 39.3217 176.8078 37 G 3.9751 8.1125 108.2297 45.8955 0.0000 174.3296 38 N 4.4513 8.7548 119.5593 52.0617 39.0044 173.2659 39 P 4.8007 0.0000 0.0000 63.2580 32.1902 175.0534 40 I 4.2265 8.8725 118.4991 62.8213 39.0437 175.9842 41 T 4.9347 7.5039 116.1009 62.2391 73.1964 172.2631 42 W 5.5828 8.1214 118.6687 55.6573 31.4300 173.1806 43 S 4.6102 8.6868 115.0529 56.9655 66.2162 172.0941 44 S 4.9538 7.8015 113.2132 57.0282 64.3853 177.9012 45 G 4.0075 8.4982 108.4508 48.3859 0.0000 175.9510 46 G 4.2088 8.1879 107.5049 46.9756 0.0000 175.4493 47 V 3.4598 7.8175 119.7872 65.7977 31.6934 177.6865 48 I 3.7127 7.9885 113.3923 61.9656 37.4061 175.6834 49 G 3.8345 8.2486 111.3974 46.3856 0.0000 174.6932 50 Y 4.3550 7.5402 117.3424 57.8776 38.3631 175.4553 51 K 4.4877 8.6709 125.0051 58.6675 34.4360 174.0224 52 G 4.0978 8.3730 120.3306 44.4970 0.0000 175.4062 53 S 4.3190 8.5847 118.6537 60.7428 63.4328 176.7959 54 R 3.8043 7.9286 120.0302 58.5088 30.1658 178.4909 55 K 3.9502 7.8422 116.6145 59.4033 32.3299 179.3304 56 G 3.5707 7.6301 106.6413 48.1650 0.0000 174.8915 57 T 3.8080 7.4515 114.1061 61.6614 68.8672 172.2563 58 P 4.2245 0.0000 0.0000 66.6322 30.9178 177.4836 59 Y 4.3024 7.8136 118.9538 60.5256 38.4948 177.8254 60 A 4.0522 8.2302 120.3869 55.5626 18.3782 178.9283 61 A 3.8875 7.7564 118.2025 55.5837 18.2829 179.5035 62 Q 3.8867 8.3424 117.9475 59.3696 29.1631 178.4568 63 L 3.7866 7.7341 119.7507 58.0262 41.5972 178.9944 64 A 4.0928 9.0372 122.6136 54.5151 18.2852 179.1042 65 A 3.9504 8.8680 118.3785 55.6739 18.4946 179.9905 66 L 3.9933 8.1702 117.1534 57.6593 41.6400 179.3113 67 D 4.2175 8.1728 118.0540 57.3009 41.0053 177.9274 68 A 3.9961 8.3637 121.4456 55.3675 17.9591 179.2606 69 A 4.0545 7.9206 118.8741 55.1737 18.5278 179.5587 70 K 4.1977 8.5680 115.8729 60.1432 31.9535 179.1832 71 K 3.9527 8.3408 117.9092 59.5800 31.7439 179.4070 72 A 3.9532 7.6887 120.8200 55.4134 18.1227 179.3046 73 M 3.9711 8.8383 116.8452 59.0236 32.2105 178.1388 74 A 4.0626 7.8620 120.0767 55.9456 18.5291 178.7315 75 Y 4.1203 8.1065 111.1775 58.7955 38.1771 178.1135 76 G 3.8988 8.4404 109.0366 45.8898 0.0000 173.6115 77 M 4.6888 7.4766 118.0769 55.9938 32.1669 176.1290 78 Q 4.7357 9.4747 116.9555 56.1500 35.5158 174.4153 79 S 5.5411 8.0240 112.7929 55.7531 65.7233 173.7831 80 V 4.9563 8.2778 117.5936 59.0504 34.6163 174.8423 81 D 5.1261 8.2118 122.1316 51.4521 40.6441 174.8706 82 V 3.7782 7.8770 120.3289 63.7176 33.1506 174.3798 83 I 4.8729 8.7866 127.8639 59.5333 40.4901 174.6384 84 V 4.7948 9.1800 127.7346 61.6318 34.1736 174.7469 85 R 4.8312 8.7077 124.0652 55.9704 34.6415 176.2070 86 G 4.2428 9.5276 108.2648 47.1230 0.0000 173.0652 87 T 4.5149 8.0676 105.2905 60.5202 69.5517 174.0775 88 G 3.8713 8.2263 110.9547 45.3485 0.0000 173.1764 89 A 3.8915 8.0133 122.0255 52.8676 19.3367 177.4144 90 G 3.6939 8.4989 106.9908 47.0082 0.0000 172.8117 91 R 4.3286 6.9964 117.8690 57.7824 32.8614 176.4242 92 E 4.0500 8.0342 116.5736 57.5374 29.7788 177.6382 93 Q 4.2800 8.4018 119.3159 58.9059 29.7496 177.1652 94 A 4.0081 7.7989 121.2124 55.2203 18.5042 179.1882 95 I 3.6281 7.8378 117.7592 64.9317 37.0160 178.6770 96 R 4.7580 7.8319 117.9669 58.6856 30.0671 178.3077 97 A 4.1424 8.2934 121.8723 54.0938 18.2337 179.2476 98 L 3.8727 7.8182 116.9013 58.0298 42.2245 179.7690 99 Q 4.1633 8.0327 116.8926 58.6591 28.5763 178.5255 100 A 4.4042 7.8614 120.7692 52.7769 18.9761 177.9163 101 S 4.5715 8.2530 113.5549 59.3001 64.3901 173.3048 102 G 4.1204 8.4398 108.5694 45.8860 0.0000 174.3733 103 L 3.9556 7.2629 119.2461 54.8335 41.8835 176.5135 104 Q 3.9680 9.4359 126.5688 56.1630 29.8627 175.4473 105 V 4.2180 8.4533 128.1655 61.5020 29.8431 175.0579 106 K 4.2086 8.8064 126.3119 58.2226 32.7977 176.0275 107 S 4.6386 7.2416 110.2723 58.4411 65.5595 175.8431 108 I 5.2870 8.2365 118.5621 59.3278 40.9785 175.1884 109 V 4.4660 8.1488 123.1926 61.6213 35.3640 172.3842 110 D 5.1224 8.6564 125.8233 52.4095 42.4519 175.0351 111 D 4.9736 9.2304 126.0812 54.0336 42.5804 175.3707 112 T 4.0065 8.0792 113.7802 62.8854 68.6945 172.6758 113 P 4.4342 0.0000 0.0000 62.9246 32.1201 176.4980 114 V 4.1883 7.7247 117.7437 60.1550 33.3271 171.9221 115 P 4.3510 0.0000 0.0000 63.0287 32.4189 176.1170 116 H 4.7843 8.2684 116.2421 55.2179 27.9659 174.8613 117 N 4.2105 7.9117 119.1097 53.1958 36.5838 175.0365 118 G 3.6475 8.7119 111.6781 45.5910 0.0000 172.5921 119 C 4.4551 8.9257 114.2101 57.7392 30.3133 173.5013 120 R 3.8257 8.5855 124.1146 55.9279 29.7740 174.5147 121 P 4.5107 0.0000 0.0000 62.2118 32.2562 175.7071 122 K 4.3478 8.5925 117.3783 56.1136 33.9549 178.1292 123 K 4.0905 8.6743 122.4884 59.8642 32.6958 178.1226 124 K 3.6774 7.8873 118.2711 59.1136 31.8969 177.1717 125 F 4.9719 8.5098 115.1014 57.1913 40.1397 178.0267 126 R 4.1934 7.9959 123.9767 56.2572 29.4287 174.7437 127 K 3.5808 8.7755 131.8732 56.8297 29.3333 175.7027 128 A 4.1598 8.4332 127.9652 51.5214 17.7887 177.3165 129 S 4.1753 8.5632 115.3034 59.7045 63.9873 171.5145 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 11 K 8.31 3.90 0.00 1.65 1.71 0.00 1.68 0.00 0.00 1.63 0.00 0.00 2.82 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.16 1.25 7.81 12 R 8.67 4.15 0.00 1.94 2.08 0.00 3.42 0.00 0.00 3.25 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.74 0.00 13 Q 8.42 3.69 0.00 2.24 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.70 0.00 0.00 0.00 0.00 0.00 2.23 2.28 0.00 14 V 8.80 3.84 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 0.84 0.00 0.00 1.01 0.00 0.00 15 A 8.54 4.61 1.42 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 16 S 7.34 5.13 0.00 3.94 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 17 G 8.70 4.11 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 0.00 0.00 0.00 18 R 8.50 5.18 0.00 1.75 1.61 0.00 3.17 0.00 0.00 3.24 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.54 0.00 19 A 8.30 5.17 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 20 Y 9.67 4.79 0.00 2.90 2.91 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 0.00 0.00 0.00 21 I 9.08 4.72 1.90 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 1.16 0.72 0.95 0.00 0.00 22 H 9.36 5.09 0.00 3.28 3.33 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 23 A 8.64 5.16 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 24 S 8.88 4.71 0.00 3.97 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 25 Y 9.33 4.06 0.00 2.94 3.17 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 26 N 8.01 4.71 0.00 2.84 2.93 0.00 0.00 6.82 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 27 N 6.68 4.46 0.00 2.88 2.74 0.00 0.00 7.20 8.16 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 28 T 7.77 5.37 4.29 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 1.26 0.00 0.00 29 I 8.74 4.76 1.98 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 1.00 0.62 0.94 0.00 0.00 30 V 8.56 5.00 2.16 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 1.03 0.00 0.00 0.98 0.00 0.00 31 T 9.24 5.11 4.34 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 1.24 0.00 0.00 32 I 8.99 4.95 1.86 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 1.33 1.50 0.98 0.00 0.00 33 T 8.75 4.78 4.47 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 34 D 8.60 5.17 0.00 2.83 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 35 P 0.00 4.06 0.00 2.08 2.13 0.00 3.72 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.22 0.00 36 D 8.02 4.41 0.00 2.79 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 37 G 8.11 3.98 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 0.00 0.00 0.00 38 N 8.75 4.45 0.00 2.91 2.75 0.00 0.00 6.57 8.14 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 39 P 0.00 4.80 0.00 2.17 1.99 0.00 3.67 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 1.96 1.91 0.00 40 I 8.87 4.23 1.78 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 1.05 0.58 -0.26 0.00 0.00 41 T 7.50 4.93 4.18 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 1.15 0.00 0.00 42 W 8.12 5.58 0.00 3.60 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 43 S 8.69 4.61 0.00 3.86 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 44 S 7.80 4.95 0.00 4.08 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 45 G 8.50 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 0.00 0.00 0.00 46 G 8.19 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 47 V 7.82 3.46 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 0.72 0.00 0.00 0.60 0.00 0.00 48 I 7.99 3.71 1.71 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 1.67 0.66 0.84 0.00 0.00 49 G 8.25 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 50 Y 7.54 4.36 0.00 3.27 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 51 K 8.67 4.49 0.00 1.72 1.73 0.00 1.84 0.00 0.00 1.76 0.00 0.00 3.02 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.37 1.42 7.81 52 G 8.37 4.10 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 0.00 0.00 0.00 53 S 8.58 4.32 0.00 4.02 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 0.00 54 R 7.93 3.80 0.00 1.78 1.31 0.00 3.23 0.00 0.00 2.96 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.60 0.00 55 K 7.84 3.95 0.00 2.08 1.95 0.00 1.73 0.00 0.00 1.73 0.00 0.00 3.06 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.52 1.61 7.81 56 G 7.63 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 57 T 7.45 3.81 4.19 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 1.05 0.00 0.00 58 P 0.00 4.22 0.00 2.34 2.33 0.00 3.79 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.07 0.00 59 Y 7.81 4.30 0.00 3.04 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 60 A 8.23 4.05 1.55 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 61 A 7.76 3.89 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 62 Q 8.34 3.89 0.00 2.25 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.72 0.00 0.00 0.00 0.00 0.00 2.33 2.41 0.00 63 L 7.73 3.79 0.00 1.62 1.52 0.73 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.48 0.00 0.00 0.00 0.00 0.00 0.00 64 A 9.04 4.09 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 65 A 8.87 3.95 1.38 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 0.00 0.00 0.00 66 L 8.17 3.99 0.00 1.81 1.71 0.92 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 67 D 8.17 4.22 0.00 2.68 2.77 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.36 4.00 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 69 A 7.92 4.05 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 70 K 8.57 4.20 0.00 1.87 1.86 0.00 1.66 0.00 0.00 1.63 0.00 0.00 2.91 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.76 7.81 71 K 8.34 3.95 0.00 1.80 1.89 0.00 1.54 0.00 0.00 1.55 0.00 0.00 2.87 0.00 0.00 3.40 0.00 0.00 0.00 0.00 1.43 1.76 7.81 72 A 7.69 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 73 M 8.84 3.97 0.00 1.86 2.32 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.94 0.00 74 A 7.86 4.06 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 75 Y 8.11 4.12 0.00 3.01 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 76 G 8.44 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 0.00 0.00 0.00 77 M 7.48 4.69 0.00 1.94 2.08 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.71 0.00 78 Q 9.47 4.74 0.00 2.02 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.75 0.00 0.00 0.00 0.00 0.00 2.29 2.53 0.00 79 S 8.02 5.54 0.00 3.83 3.95 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 0.00 0.00 0.00 80 V 8.28 4.96 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 0.89 0.00 0.00 0.92 0.00 0.00 81 D 8.21 5.13 0.00 2.41 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 82 V 7.88 3.78 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 1.00 0.00 0.00 0.92 0.00 0.00 83 I 8.79 4.87 1.47 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.32 0.81 0.00 0.00 84 V 9.18 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 0.96 0.00 0.00 0.96 0.00 0.00 85 R 8.71 4.83 0.00 1.94 1.75 0.00 3.33 0.00 0.00 3.24 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.65 0.00 86 G 9.53 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 0.00 0.00 0.00 0.00 87 T 8.07 4.51 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 1.24 0.00 0.00 88 G 8.23 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 89 A 8.01 3.89 1.11 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 0.00 0.00 90 G 8.50 3.69 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 0.00 0.00 0.00 91 R 7.00 4.33 0.00 1.97 1.79 0.00 3.19 0.00 0.00 3.26 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.57 0.00 92 E 8.03 4.05 0.00 1.97 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 2.29 2.43 0.00 93 Q 8.40 4.28 0.00 2.09 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.57 0.00 0.00 0.00 0.00 0.00 2.31 2.53 0.00 94 A 7.80 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 95 I 7.84 3.63 1.87 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 1.64 1.11 0.91 0.00 0.00 96 R 7.83 4.76 0.00 1.93 2.01 0.00 3.13 0.00 0.00 3.29 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.64 0.00 97 A 8.29 4.14 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 98 L 7.82 3.87 0.00 1.75 1.79 0.93 0.95 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 99 Q 8.03 4.16 0.00 2.29 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 7.08 0.00 0.00 0.00 0.00 0.00 2.38 2.64 0.00 100 A 7.86 4.40 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 0.00 101 S 8.25 4.57 0.00 3.97 4.10 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 0.00 102 G 8.44 4.12 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 0.00 0.00 0.00 103 L 7.26 3.96 0.00 1.82 1.65 0.93 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 104 Q 9.44 3.97 0.00 2.07 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 7.03 0.00 0.00 0.00 0.00 0.00 2.35 2.45 0.00 105 V 8.45 4.22 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 0.00 106 K 8.81 4.21 0.00 1.81 1.89 0.00 1.78 0.00 0.00 1.60 0.00 0.00 2.97 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.64 1.42 7.81 107 S 7.24 4.64 0.00 3.79 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 0.00 108 I 8.24 5.29 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 1.19 1.58 0.89 0.00 0.00 109 V 8.15 4.47 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 0.89 0.00 0.00 0.90 0.00 0.00 110 D 8.66 5.12 0.00 2.70 2.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 D 9.23 4.97 0.00 2.62 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 0.00 112 T 8.08 4.01 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 1.24 0.00 0.00 113 P 0.00 4.43 0.00 2.15 2.04 0.00 3.80 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 1.96 1.94 0.00 114 V 7.72 4.19 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 0.69 0.00 0.00 0.95 0.00 0.00 115 P 0.00 4.35 0.00 2.26 2.05 0.00 3.71 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 1.97 1.95 0.00 116 H 8.27 4.78 0.00 3.15 3.27 0.00 5.81 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 0.00 117 N 7.91 4.21 0.00 2.90 2.91 0.00 0.00 7.04 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 0.00 118 G 8.71 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 0.00 0.00 0.00 119 C 8.93 4.46 0.00 2.95 2.85 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 0.00 120 R 8.59 3.83 0.00 1.77 1.87 0.00 3.25 0.00 0.00 3.29 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.65 0.00 121 P 0.00 4.51 0.00 2.31 2.05 0.00 3.82 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 2.03 1.99 0.00 122 K 8.59 4.35 0.00 2.03 2.04 0.00 1.86 0.00 0.00 1.88 0.00 0.00 2.91 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.64 1.82 7.81 123 K 8.67 4.09 0.00 1.81 1.82 0.00 1.74 0.00 0.00 1.72 0.00 0.00 2.80 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.47 1.47 7.81 124 K 7.89 3.68 0.00 1.52 1.51 0.00 1.55 0.00 0.00 1.50 0.00 0.00 2.58 0.00 0.00 2.72 0.00 0.00 0.00 0.00 0.30 0.92 7.81 125 F 8.51 4.97 0.00 2.89 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 0.00 126 R 8.00 4.19 0.00 1.94 1.78 0.00 3.29 0.00 0.00 3.23 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.69 0.00 127 K 8.78 3.58 0.00 1.93 1.92 0.00 1.76 0.00 0.00 1.71 0.00 0.00 2.97 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.33 1.36 7.81 128 A 8.43 4.16 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 0.00 129 S 8.56 4.18 0.00 4.17 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 0.00