NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3507 8.3049 118.1945 54.9107 31.6317 174.7987 2 T 3.6850 8.4392 121.8502 61.5503 67.5266 172.7031 3 R 4.1231 8.1423 124.4121 55.9462 30.7453 177.4346 4 V 3.9006 8.2369 114.7127 61.3174 31.0656 173.5717 5 K 3.7216 7.7931 125.2675 56.4291 29.8765 175.7577 6 R 4.0726 8.7240 123.0512 59.1876 31.6781 180.5357 7 G 4.1296 8.0891 103.2355 46.8744 0.0000 175.3252 8 Y 4.3691 8.9859 128.9688 59.8112 39.3395 176.7542 9 I 3.5736 8.3687 121.4375 64.4365 37.0514 177.6778 10 A 4.1840 7.7477 117.7258 53.4452 18.4360 178.5631 11 R 4.0474 7.6037 117.7025 58.7187 30.1842 178.2149 12 R 3.8734 7.3231 117.1516 58.0812 29.9559 178.3907 13 R 4.1757 7.7941 116.0457 57.5715 30.5620 177.4559 14 R 4.4783 7.6298 117.3926 57.4168 31.8438 178.0826 15 K 4.1900 7.8013 118.6858 59.8219 32.0513 179.3150 16 K 3.7769 7.7461 118.5883 59.7133 32.1505 178.8243 17 I 3.7052 7.5436 119.3070 63.1087 37.4246 177.8160 18 R 4.3505 8.3417 119.8012 58.7616 30.0177 178.4769 19 F 4.0086 8.7631 116.2819 60.6816 39.0212 176.5061 20 F 4.0776 8.0159 118.9548 60.7316 39.4305 175.2934 21 A 4.7786 7.9568 124.6497 51.0000 16.9712 177.0265 22 S 4.7040 7.3976 120.4640 57.3179 64.6135 175.7554 23 S 4.3960 7.5196 109.7531 59.1548 63.7775 174.0957 24 F 4.9784 7.7354 119.1262 56.7973 40.1009 176.2056 25 R 4.0135 8.7375 124.0392 59.3704 30.4415 178.2099 26 G 3.9216 7.8247 105.0916 45.3064 0.0000 173.0394 27 A 4.2458 8.4177 119.5214 53.1753 17.8556 178.1567 28 H 4.9561 8.7261 114.6738 57.1208 28.3668 176.7267 29 S 5.0389 8.0412 111.5984 58.0716 63.6026 174.2238 30 R 4.7240 7.7388 117.3320 55.0410 31.6860 175.0648 31 L 4.3204 7.6428 115.4814 53.3353 45.8380 174.4735 32 T 3.8716 8.4678 120.2874 65.3087 67.3016 176.4506 33 R 3.9504 7.8520 119.6847 59.2642 29.9297 178.7501 34 T 3.7896 7.8718 109.0112 64.4897 68.2046 175.6304 35 I 4.0571 8.1211 121.9699 61.8202 37.7415 177.3044 36 A 4.0360 7.8675 123.3759 55.1837 18.2283 179.0334 37 Q 4.1719 7.9129 110.8545 57.4840 29.6211 177.3037 38 Q 4.0229 7.3280 117.0571 58.4589 29.5375 177.1222 39 K 3.7487 8.8825 121.7301 59.4436 32.1860 178.5219 40 I 3.6639 7.3431 112.4852 64.2414 37.1185 178.4512 41 R 3.9079 7.7651 118.8849 58.7868 29.8301 177.8028 42 A 4.4608 7.6045 117.0524 52.5652 18.6744 177.8543 43 L 4.4205 7.6547 119.5544 55.6763 43.6604 177.7561 44 V 4.0833 7.6032 117.4134 65.0297 32.2442 177.6749 45 S 4.1307 8.3652 112.9258 61.3265 61.9648 175.9991 46 A 4.7883 7.9388 124.4653 54.9690 18.0709 178.5081 47 H 4.3654 8.0381 114.2062 57.9186 30.1393 176.4756 48 R 4.8873 7.8218 119.9692 58.0906 31.1719 177.7636 49 D 4.4101 8.8946 120.1153 56.5687 38.8082 178.9635 50 R 3.9919 7.6406 117.2988 58.7582 29.2892 177.7762 51 D 4.6224 7.8270 118.2968 54.7182 40.0898 178.5362 52 R 3.7680 8.5005 120.0902 58.6612 29.8991 178.2053 53 Q 3.6724 8.2135 119.4697 59.1232 29.3119 178.2796 54 K 4.0899 7.6476 120.3608 59.3551 32.3089 178.9065 55 R 4.0201 7.8408 118.6218 59.2631 29.7052 177.4681 56 D 4.2776 9.0744 119.2067 57.3374 40.9909 178.0895 57 F 3.6973 7.8201 115.9810 58.8553 38.0282 178.0631 58 R 4.0283 7.3524 118.3394 59.1730 29.8250 178.8424 59 R 4.3086 7.6374 114.9961 58.6714 29.8674 178.3548 60 L 3.7401 6.8794 120.0909 57.1975 41.5916 179.0197 61 W 4.5748 7.8267 118.8340 60.4464 29.1082 178.8028 62 I 3.4293 7.3890 119.5119 64.6305 36.4619 178.7271 63 T 3.8210 7.9211 116.6014 66.2827 67.9834 177.1845 64 R 3.8768 8.2841 119.8736 59.4114 30.4404 178.8615 65 I 3.8403 7.6422 119.5087 64.0445 37.0551 177.7304 66 N 4.1847 8.2543 118.0820 56.8147 38.5336 176.4022 67 A 4.1671 7.8753 119.3356 53.5790 18.6432 178.1552 68 A 5.2627 7.9459 119.2751 51.8746 19.7537 178.3569 69 I 4.0655 7.3967 118.0818 62.8827 38.1646 176.6561 70 R 4.6855 7.8633 119.5877 54.7010 29.6475 174.8815 71 E 4.8871 7.6079 118.3973 57.2831 36.8524 178.2695 72 R 4.0115 7.9279 117.9959 56.6263 29.0817 176.2106 73 G 4.7843 8.7113 111.9054 48.1818 0.0000 174.8288 74 V 4.2022 8.0060 121.8296 62.0979 29.6757 175.8537 75 Y 4.5157 8.3840 117.6985 58.1578 39.7757 177.5432 76 Y 3.6686 7.6672 122.5153 58.6061 37.4534 176.2951 77 N 5.2902 9.2141 112.2261 51.2034 43.8146 174.6082 78 Y 4.4206 8.9663 117.7598 58.1874 38.5335 177.8065 79 S 3.5583 7.8403 116.9972 61.6707 63.2543 176.3208 80 K 3.9449 7.4764 123.0840 58.5969 31.5082 179.0637 81 F 4.7105 7.9742 121.7969 61.1309 39.4011 177.1564 82 I 3.9177 8.1474 119.5541 64.6116 36.8235 177.9646 83 H 4.1484 8.7900 119.6002 59.1192 29.6224 177.0001 84 D 4.3113 8.2874 121.0137 57.5569 40.8515 178.8388 85 L 3.9924 7.6838 119.1818 57.7714 41.3426 178.9933 86 Y 4.1049 8.0538 118.8829 60.8000 38.9250 177.9311 87 K 3.8228 8.3822 119.3895 57.5440 32.4567 178.6086 88 R 3.9231 8.6987 119.0845 56.0417 29.8515 177.1122 89 Q 5.5920 8.2365 123.6717 57.3710 30.8697 175.2220 90 L 4.5144 7.1806 120.4444 54.3536 41.9430 177.1350 91 L 4.4684 8.4053 122.2489 54.8816 41.9306 177.2990 92 L 4.5517 7.1755 119.2250 55.6251 43.1942 174.9444 93 N 4.0230 8.5366 111.3775 54.9632 36.5649 173.9398 94 R 4.3778 7.1493 118.3093 54.7172 33.2420 177.1094 95 K 3.8777 8.1914 117.2580 59.6162 31.5582 179.1055 96 I 3.4390 6.8071 119.5102 63.5972 36.9704 177.2712 97 L 4.3660 7.3389 117.0590 55.1816 41.2528 177.8701 98 A 4.3992 7.4816 120.1897 52.6597 18.3848 178.8582 99 Q 4.3128 7.7732 116.8811 57.7779 28.3253 177.7755 100 I 4.0753 7.6610 121.8733 63.5041 37.0165 177.6130 101 A 4.0351 7.5811 122.1479 55.4617 18.3900 179.1236 102 I 3.6649 7.7098 110.1252 63.0528 38.0163 175.8852 103 L 4.2468 7.2852 122.0348 53.8700 43.5418 176.8845 104 N 4.0958 8.6515 116.6052 53.6639 35.7487 173.2332 105 P 4.7844 0.0000 0.0000 64.0241 32.3010 177.5815 106 N 4.5740 8.1271 119.1473 56.5930 39.3591 176.9236 107 C 4.3336 8.1558 115.8459 62.5103 28.5036 175.0941 108 I 4.0484 7.7362 117.1922 62.7113 38.0760 176.2533 109 Y 4.5231 7.7121 119.5939 60.7763 38.5390 177.1739 110 M 4.0830 7.9661 120.3964 58.3686 32.1979 178.6641 111 I 4.2881 7.8493 113.8682 63.5708 37.6674 177.3020 112 Y 4.2402 7.7526 120.0405 60.0249 37.4721 176.6690 113 N 4.4115 8.0528 115.7156 53.6241 39.2653 176.2667 114 E 4.2929 7.5841 119.8077 57.7195 30.1081 178.0409 115 I 3.7040 7.3419 113.4578 63.5539 37.4893 178.3519 116 I 3.6473 7.2871 120.5044 63.9323 37.1184 177.8919 117 K 4.0426 7.1517 118.8128 59.2017 31.8927 179.3887 118 K 4.0805 7.3882 116.4526 58.7869 32.1805 176.7390 119 E 4.1618 7.6874 122.4458 56.1801 29.8452 174.9954 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 4.35 0.00 2.14 2.19 0.00 0.00 0.00 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.57 0.00 2 T 8.44 3.69 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 3 R 8.14 4.12 0.00 1.99 2.12 0.00 2.96 0.00 0.00 3.44 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.72 0.00 4 V 8.24 3.90 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 0.94 0.00 0.00 5 K 7.79 3.72 0.00 1.93 1.94 0.00 1.75 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.38 1.55 7.81 6 R 8.72 4.07 0.00 1.88 1.99 0.00 3.27 0.00 0.00 3.34 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.65 0.00 7 G 8.09 4.13 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 0.00 0.00 0.00 8 Y 8.99 4.37 0.00 2.99 3.01 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 9 I 8.37 3.57 1.97 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 1.63 0.81 0.88 0.00 0.00 10 A 7.75 4.18 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 11 R 7.60 4.05 0.00 2.10 1.82 0.00 3.27 0.00 0.00 3.27 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.98 0.00 12 R 7.32 3.87 0.00 1.61 1.72 0.00 2.98 0.00 0.00 2.86 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.75 0.00 13 R 7.79 4.18 0.00 1.73 1.94 0.00 3.12 0.00 0.00 3.19 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.87 0.00 14 R 7.63 4.48 0.00 1.82 1.94 0.00 3.13 0.00 0.00 3.39 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.63 0.00 15 K 7.80 4.19 0.00 2.15 2.30 0.00 1.36 0.00 0.00 1.72 0.00 0.00 2.62 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.51 1.72 7.81 16 K 7.75 3.78 0.00 1.98 2.05 0.00 1.26 0.00 0.00 1.67 0.00 0.00 2.96 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.41 1.47 7.81 17 I 7.54 3.71 2.07 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 1.51 0.62 0.92 0.00 0.00 18 R 8.34 4.35 0.00 2.22 2.05 0.00 3.20 0.00 0.00 3.23 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 2.02 0.00 19 F 8.76 4.01 0.00 2.97 3.21 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 20 F 8.02 4.08 0.00 3.03 3.15 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 0.00 0.00 0.00 0.00 21 A 7.96 4.78 1.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.40 4.70 0.00 3.68 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 23 S 7.52 4.40 0.00 3.73 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 24 F 7.74 4.98 0.00 3.14 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 25 R 8.74 4.01 0.00 1.85 2.02 0.00 3.40 0.00 0.00 3.25 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.60 0.00 26 G 7.82 3.92 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 0.00 0.00 0.00 0.00 0.00 0.00 27 A 8.42 4.25 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 28 H 8.73 4.96 0.00 3.06 3.19 0.00 5.77 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 S 8.04 5.04 0.00 4.21 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 0.00 30 R 7.74 4.72 0.00 1.78 1.92 0.00 3.42 0.00 0.00 3.18 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.55 0.00 31 L 7.64 4.32 0.00 1.61 1.43 0.97 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 32 T 8.47 3.87 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 1.21 0.00 0.00 33 R 7.85 3.95 0.00 1.87 1.92 0.00 3.18 0.00 0.00 3.37 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.66 0.00 34 T 7.87 3.79 4.09 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 0.00 0.00 0.00 1.14 0.00 0.00 35 I 8.12 4.06 2.05 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 1.62 2.44 1.00 0.00 0.00 36 A 7.87 4.04 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 37 Q 7.91 4.17 0.00 2.16 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.79 0.00 0.00 0.00 0.00 0.00 2.59 2.31 0.00 38 Q 7.33 4.02 0.00 2.18 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.83 0.00 0.00 0.00 0.00 0.00 1.16 1.47 0.00 39 K 8.88 3.75 0.00 1.49 1.65 0.00 1.54 0.00 0.00 1.45 0.00 0.00 2.50 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.21 0.89 7.81 40 I 7.34 3.66 1.83 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 1.57 0.59 0.97 0.00 0.00 41 R 7.77 3.91 0.00 2.00 2.00 0.00 3.26 0.00 0.00 3.29 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.87 0.00 42 A 7.60 4.46 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.65 4.42 0.00 1.73 1.76 0.88 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 44 V 7.60 4.08 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 0.98 0.00 0.00 0.95 0.00 0.00 45 S 8.37 4.13 0.00 3.92 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 46 A 7.94 4.79 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 H 8.04 4.37 0.00 3.17 3.55 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 48 R 7.82 4.89 0.00 2.07 1.93 0.00 3.49 0.00 0.00 3.36 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.81 0.00 49 D 8.89 4.41 0.00 2.90 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 50 R 7.64 3.99 0.00 1.96 2.18 0.00 3.14 0.00 0.00 3.29 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.60 0.00 51 D 7.83 4.62 0.00 2.95 2.92 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 0.00 0.00 0.00 52 R 8.50 3.77 0.00 1.82 2.02 0.00 3.30 0.00 0.00 3.09 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.78 0.00 53 Q 8.21 3.67 0.00 2.24 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.03 6.98 0.00 0.00 0.00 0.00 0.00 2.24 2.43 0.00 54 K 7.65 4.09 0.00 1.73 1.81 0.00 1.73 0.00 0.00 1.63 0.00 0.00 2.97 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.55 1.58 7.81 55 R 7.84 4.02 0.00 1.93 2.04 0.00 3.25 0.00 0.00 3.26 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.69 0.00 56 D 9.07 4.28 0.00 2.83 3.01 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 57 F 7.82 3.70 0.00 2.24 1.45 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.35 4.03 0.00 2.04 2.11 0.00 3.18 0.00 0.00 3.33 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.95 0.00 59 R 7.64 4.31 0.00 1.95 2.11 0.00 2.88 0.00 0.00 3.26 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.53 0.00 60 L 6.88 3.74 0.00 1.38 1.39 -0.20 0.56 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 61 W 7.83 4.57 0.00 3.50 3.24 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 62 I 7.39 3.43 1.93 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.95 0.50 0.00 0.00 63 T 7.92 3.82 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 1.14 0.00 0.00 64 R 8.28 3.88 0.00 1.90 2.01 0.00 3.27 0.00 0.00 3.21 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.91 0.00 65 I 7.64 3.84 1.63 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.66 0.78 0.00 0.00 66 N 8.25 4.18 0.00 2.78 2.91 0.00 0.00 7.09 9.21 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 67 A 7.88 4.17 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 68 A 7.95 5.26 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 69 I 7.40 4.07 2.05 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.20 1.06 0.00 0.00 70 R 7.86 4.69 0.00 1.82 1.95 0.00 3.25 0.00 0.00 3.29 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.83 0.00 71 E 7.61 4.89 0.00 2.07 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 0.00 2.24 2.23 0.00 72 R 7.93 4.01 0.00 1.56 0.98 0.00 3.15 0.00 0.00 2.68 7.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.64 0.00 73 G 8.71 4.78 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 0.00 0.00 0.00 74 V 8.01 4.20 2.38 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 1.15 0.00 0.00 1.21 0.00 0.00 75 Y 8.38 4.52 0.00 3.22 3.08 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 0.00 0.00 0.00 0.00 76 Y 7.67 3.67 0.00 2.70 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 77 N 9.21 5.29 0.00 3.19 2.91 0.00 0.00 6.57 7.48 0.00 0.00 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 Y 8.97 4.42 0.00 3.13 3.15 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 0.00 0.00 0.00 0.00 79 S 7.84 3.56 0.00 3.97 4.06 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 0.00 0.00 0.00 0.00 80 K 7.48 3.94 0.00 1.82 1.67 0.00 1.02 0.00 0.00 1.14 0.00 0.00 2.70 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.07 0.62 7.81 81 F 7.97 4.71 0.00 3.19 3.22 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 82 I 8.15 3.92 1.85 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 1.41 0.44 0.87 0.00 0.00 83 H 8.79 4.15 0.00 3.19 3.37 0.00 5.59 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 84 D 8.29 4.31 0.00 2.67 2.53 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 85 L 7.68 3.99 0.00 1.91 1.77 0.92 1.32 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 86 Y 8.05 4.10 0.00 2.93 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 87 K 8.38 3.82 0.00 1.69 1.85 0.00 1.91 0.00 0.00 1.64 0.00 0.00 2.96 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.39 1.37 7.81 88 R 8.70 3.92 0.00 1.97 1.78 0.00 3.57 0.00 0.00 3.22 8.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.72 0.00 89 Q 8.24 5.59 0.00 2.21 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.74 0.00 0.00 0.00 0.00 0.00 2.04 2.09 0.00 90 L 7.18 4.51 0.00 1.76 1.66 0.92 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 91 L 8.41 4.47 0.00 1.64 1.70 0.92 1.04 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 92 L 7.18 4.55 0.00 1.78 1.71 0.95 0.99 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 93 N 8.54 4.02 0.00 2.89 2.92 0.00 0.00 6.83 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 94 R 7.15 4.38 0.00 1.91 1.98 0.00 2.93 0.00 0.00 3.17 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.50 0.00 95 K 8.19 3.88 0.00 1.00 1.80 0.00 1.59 0.00 0.00 1.62 0.00 0.00 3.24 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.63 1.75 7.81 96 I 6.81 3.44 1.57 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.18 0.87 0.00 0.00 97 L 7.34 4.37 0.00 1.79 1.67 0.93 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 98 A 7.48 4.40 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 99 Q 7.77 4.31 0.00 2.33 2.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.52 6.78 0.00 0.00 0.00 0.00 0.00 2.36 2.42 0.00 100 I 7.66 4.08 1.91 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 1.86 1.36 1.08 0.00 0.00 101 A 7.58 4.04 1.33 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 0.00 0.00 0.00 102 I 7.71 3.66 1.88 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 1.72 0.71 0.92 0.00 0.00 103 L 7.29 4.25 0.00 1.80 1.65 0.93 1.16 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 0.00 104 N 8.65 4.10 0.00 3.04 3.04 0.00 0.00 5.85 7.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 P 0.00 4.78 0.00 2.19 2.38 0.00 3.37 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.90 0.00 106 N 8.13 4.57 0.00 2.87 2.88 0.00 0.00 7.20 7.50 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 0.00 107 C 8.16 4.33 0.00 3.09 3.01 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 0.00 108 I 7.74 4.05 1.94 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 1.43 0.86 1.09 0.00 0.00 109 Y 7.71 4.52 0.00 3.37 3.23 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 0.00 110 M 7.97 4.08 0.00 2.03 2.26 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.98 0.00 111 I 7.85 4.29 1.99 0.00 0.00 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 1.71 2.12 1.07 0.00 0.00 112 Y 7.75 4.24 0.00 3.20 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 0.00 113 N 8.05 4.41 0.00 2.78 2.65 0.00 0.00 6.85 7.20 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 0.00 114 E 7.58 4.29 0.00 2.00 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 2.28 2.53 0.00 115 I 7.34 3.70 1.78 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.37 -0.07 0.00 0.00 116 I 7.29 3.65 1.66 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.45 0.79 0.00 0.00 117 K 7.15 4.04 0.00 1.80 1.80 0.00 1.64 0.00 0.00 1.63 0.00 0.00 3.15 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.39 1.59 7.81 118 K 7.39 4.08 0.00 1.69 1.80 0.00 1.59 0.00 0.00 1.57 0.00 0.00 2.91 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.62 1.50 7.81 119 E 7.69 4.16 0.00 1.78 1.90 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 2.03 2.12 0.00