NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4980 8.2893 120.3288 55.4122 33.3549 175.0234 2 N 4.3888 8.5888 117.8214 53.8963 38.2345 174.2353 3 K 4.2923 8.5588 119.6757 54.6767 31.7244 176.4238 4 N 4.3770 8.2947 120.3005 52.4987 39.2349 174.8756 5 E 3.7515 8.8949 122.6677 56.8679 29.7844 177.0613 6 Q 4.0113 8.6543 127.1060 55.9148 27.4983 173.6591 7 N 4.1347 8.4643 116.0160 56.3548 41.6483 174.1927 8 G 4.1298 9.1424 116.0838 45.7003 0.0000 172.1519 9 D 4.5743 7.7872 118.4042 53.4552 41.8321 176.7864 10 E 3.9889 8.7425 123.0917 59.8774 29.6585 178.5055 11 T 4.1015 7.4133 118.6324 62.0733 67.0918 173.3996 12 K 4.0900 8.0989 124.0485 56.1227 31.6746 176.7902 13 M 4.4241 8.0790 123.7819 54.3799 33.6439 176.1385 14 Q 4.2295 8.6180 124.3095 55.5529 30.1347 174.5385 15 S 5.5695 8.4985 121.7734 56.2661 64.8771 173.2847 16 L 4.7120 8.1349 124.9633 53.1502 45.3629 174.7309 17 V 4.4150 8.4391 126.2683 61.7557 32.7896 174.8748 18 G 4.0445 8.8877 114.2571 45.4591 0.0000 170.2267 19 Y 5.1344 8.7595 117.6062 56.3088 40.2215 175.8955 20 V 4.1882 9.0110 124.8969 62.6971 31.7910 176.2281 21 V 4.0468 8.3395 121.6889 62.1826 33.4446 176.8701 22 L 4.9499 7.6960 118.5189 52.7516 45.9392 175.8018 23 K 4.7964 8.6268 122.6874 54.9892 34.8995 175.2340 24 D 5.1196 8.8772 128.3273 54.4715 42.1360 175.6570 25 N 4.6433 8.8841 119.2828 56.6746 40.1074 176.2635 26 E 4.4689 7.9312 115.1450 57.1974 30.9225 175.6254 27 R 5.1954 7.6396 117.3778 54.9679 35.0651 173.6733 28 A 4.9321 8.8955 121.8336 50.5229 23.6145 175.1650 29 I 4.5708 8.8175 121.6696 59.7953 39.1139 175.0038 30 L 5.2248 8.9775 127.3445 52.9117 45.6541 175.7216 31 I 4.8209 8.6009 123.2844 60.2016 38.4422 176.3430 32 T 4.1917 8.7699 117.4529 62.3720 69.4728 174.4061 33 D 4.8176 7.8479 122.3643 53.6104 43.3309 175.1745 34 T 4.6722 8.3722 107.5832 61.3655 69.6093 173.9650 35 K 4.1783 7.9360 124.1536 55.6038 32.7943 175.8292 36 A 3.8502 8.0362 129.1301 50.1894 19.8170 175.0056 37 P 4.4884 0.0000 0.0000 62.3195 32.3659 176.2601 38 G 4.0701 9.5794 110.2114 44.0267 0.0000 174.8188 39 K 3.9217 8.8287 118.9798 60.0203 31.8556 178.3724 40 E 4.1957 8.2286 117.7293 59.1985 29.3179 178.8518 41 D 4.4198 8.0493 119.0805 57.3625 40.6718 177.7536 42 Y 4.2224 7.7180 113.8916 59.4079 38.0708 175.9233 43 N 4.8515 7.9671 115.9895 52.9257 39.7875 175.1014 44 L 4.3308 7.2251 118.7191 54.0943 42.6351 177.4413 45 S 4.4168 8.9411 116.7056 58.0181 64.6806 175.3421 46 E 4.0516 8.9059 125.0415 59.9682 29.2383 180.1771 47 G 3.6551 8.0932 104.7563 47.9529 0.0000 175.5145 48 Q 3.9895 7.9127 119.8672 58.6726 28.7495 178.4451 49 L 4.1088 8.2081 121.5261 58.3765 42.1185 178.8895 50 M 4.1232 8.3930 119.1384 58.5814 31.6940 178.5000 51 N 4.5108 8.2685 115.5783 55.4544 38.7172 177.3200 52 K 3.9836 7.5730 120.2716 59.0296 32.6650 178.4221 53 F 4.6601 8.2384 117.1196 57.2933 39.3175 177.7009 54 K 3.9960 8.1252 122.1712 58.8537 32.0380 177.6782 55 N 4.5890 8.1558 115.0802 56.1054 38.7970 175.2705 56 N 5.1279 8.5997 114.8757 52.9256 41.1737 173.7147 57 I 4.7516 8.0337 118.9605 59.7834 39.6995 174.8346 58 V 4.5651 8.8781 128.6715 61.2380 34.9394 173.9519 59 I 4.7024 8.3446 128.8725 60.3244 38.5995 175.1915 60 V 4.5435 8.7551 121.7359 59.9696 33.9377 175.7459 61 G 4.0867 9.1261 112.6648 45.3808 0.0000 173.9470 62 L 4.6834 8.9865 126.3982 54.2582 42.0046 178.9577 63 S 4.1474 7.9581 115.4036 61.2900 62.9205 175.4633 64 E 4.0348 8.0737 118.8908 57.6669 29.6162 176.2665 65 I 4.2092 7.4266 119.9922 59.8765 37.6344 174.9267 66 D 4.9989 8.5059 126.6371 53.7422 41.8369 175.9665 67 N 5.1163 7.7381 113.3856 51.9102 37.7444 175.3819 68 T 4.4997 8.0789 106.0455 63.5613 68.9165 175.2631 69 D 4.5552 7.9489 122.3917 56.4613 41.0324 176.7625 70 D 4.5498 8.0190 116.8384 53.3740 40.1478 175.9533 71 L 4.1270 7.6310 123.0730 54.4880 42.1739 175.7078 72 K 4.5240 8.4437 126.2450 54.6957 33.5948 176.2949 73 R 4.3333 8.4935 120.3814 56.5896 30.7707 176.4634 74 G 4.0228 10.0998 109.4597 45.5857 0.0000 172.5813 75 E 4.8608 7.8661 118.6940 54.5011 34.2463 173.6825 76 K 5.1172 8.6188 119.8544 55.3442 35.7124 175.9088 77 I 4.8195 8.9189 119.2553 59.1698 42.1750 173.7684 78 K 4.5909 8.8196 123.4893 54.8435 34.2267 174.9894 79 V 4.5377 8.5079 121.6315 59.5484 32.9987 175.3376 80 W 5.3019 8.8024 124.0918 55.1459 31.2432 175.0788 81 F 5.3316 8.6976 119.8184 56.0698 41.0273 174.3811 82 H 4.8174 8.7106 113.7506 57.7122 37.0721 173.5806 83 T 4.5487 8.0713 117.6839 62.8711 69.3057 173.9693 84 R 4.9006 8.5420 122.0871 54.2509 33.3807 174.6812 85 K 4.3374 9.2074 122.1852 54.8633 34.4816 175.4170 86 E 4.6271 8.8254 128.6413 55.6918 28.4036 176.3921 87 S 4.4143 8.2944 118.9659 56.8898 64.8434 172.3862 88 N 4.0198 8.2260 121.0802 52.6232 36.2006 171.3712 89 P 4.4546 0.0000 0.0000 61.2298 32.5808 174.9454 90 P 4.8794 0.0000 0.0000 62.8166 33.0939 175.0433 91 S 5.1485 9.2066 115.1240 56.6496 66.6802 172.6064 92 A 4.7335 8.6700 123.1731 50.4191 22.2555 175.1393 93 T 4.6216 8.9033 120.5039 62.7328 69.6878 173.8226 94 I 4.9115 8.1267 120.7776 59.4676 38.9490 175.9075 95 Q 4.4319 8.2692 122.9177 56.0098 29.9242 175.4566 96 K 4.8277 7.5523 118.4192 55.5022 35.7161 173.6656 97 Y 5.2263 9.0525 123.4010 55.4768 42.5510 173.1361 98 E 4.5677 8.9434 120.6420 53.9248 32.2248 174.6945 99 L 4.0329 8.2163 129.5423 55.1713 42.9882 175.8454 100 L 4.8079 7.7003 125.2245 53.2635 43.5406 175.1636 101 L 4.6144 7.9381 118.5440 54.1174 44.9549 176.4622 102 E 4.2417 8.8199 124.0716 59.7831 29.8679 178.2227 103 H 4.3172 8.3149 117.4394 58.7184 30.1940 174.8785 104 H 4.8764 7.5772 115.5279 54.8289 32.6515 172.2736 105 H 4.2798 8.8969 126.7678 59.3343 30.0167 175.6097 106 H 4.2994 7.5938 117.3419 55.2724 26.4723 173.6136 107 H 4.1514 8.1332 122.8604 56.1927 30.6074 174.9952 108 H 4.4783 8.2977 121.8838 56.1999 28.6318 175.2164 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 8.29 4.50 0.00 2.05 2.09 0.00 0.00 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.56 0.00 2 N 8.59 4.39 0.00 2.91 2.95 0.00 0.00 6.11 6.28 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 3 K 8.56 4.29 0.00 1.81 1.87 0.00 1.86 0.00 0.00 1.82 0.00 0.00 3.08 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.47 1.49 7.81 4 N 8.29 4.38 0.00 2.70 2.75 0.00 0.00 7.10 7.66 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 5 E 8.89 3.75 0.00 1.94 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 2.32 2.36 0.00 6 Q 8.65 4.01 0.00 2.10 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.69 6.75 0.00 0.00 0.00 0.00 0.00 2.32 2.27 0.00 7 N 8.46 4.13 0.00 2.78 2.76 0.00 0.00 7.83 7.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 G 9.14 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 9 D 7.79 4.57 0.00 2.58 2.50 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 0.00 0.00 0.00 10 E 8.74 3.99 0.00 1.91 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 2.28 2.29 0.00 11 T 7.41 4.10 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 1.12 0.00 0.00 12 K 8.10 4.09 0.00 1.73 1.78 0.00 1.72 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.41 1.51 7.81 13 M 8.08 4.42 0.00 1.97 1.82 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.47 0.00 14 Q 8.62 4.23 0.00 1.96 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.98 0.00 0.00 0.00 0.00 0.00 1.87 2.14 0.00 15 S 8.50 5.57 0.00 3.61 3.63 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 16 L 8.13 4.71 0.00 1.91 1.71 0.98 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 17 V 8.44 4.41 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.64 0.00 0.00 0.82 0.00 0.00 18 G 8.89 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 19 Y 8.76 5.13 0.00 2.81 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 20 V 9.01 4.19 2.26 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 1.00 0.00 0.00 0.94 0.00 0.00 21 V 8.34 4.05 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 0.54 0.00 0.00 0.84 0.00 0.00 22 L 7.70 4.95 0.00 1.53 1.50 0.91 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 23 K 8.63 4.80 0.00 1.73 1.65 0.00 1.86 0.00 0.00 1.74 0.00 0.00 2.90 0.00 0.00 3.27 0.00 0.00 0.00 0.00 1.34 1.50 7.81 24 D 8.88 5.12 0.00 2.84 2.45 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 25 N 8.88 4.64 0.00 2.68 2.82 0.00 0.00 6.81 7.66 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 26 E 7.93 4.47 0.00 1.96 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 2.35 2.33 0.00 27 R 7.64 5.20 0.00 1.71 1.75 0.00 3.07 0.00 0.00 3.33 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.63 0.00 28 A 8.90 4.93 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 29 I 8.82 4.57 1.85 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 1.08 0.88 0.00 0.00 30 L 8.98 5.22 0.00 1.59 1.58 0.94 0.53 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 31 I 8.60 4.82 1.94 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.47 1.09 0.00 0.00 32 T 8.77 4.19 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 1.20 0.00 0.00 33 D 7.85 4.82 0.00 2.70 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 34 T 8.37 4.67 4.36 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 1.24 0.00 0.00 35 K 7.94 4.18 0.00 1.83 1.87 0.00 1.86 0.00 0.00 1.88 0.00 0.00 3.08 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.51 1.42 7.81 36 A 8.04 3.85 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 P 0.00 4.49 0.00 1.42 1.66 0.00 3.45 0.00 0.00 3.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 1.24 0.00 38 G 9.58 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 0.00 0.00 0.00 39 K 8.83 3.92 0.00 1.90 1.88 0.00 1.62 0.00 0.00 1.80 0.00 0.00 3.00 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.53 1.65 7.81 40 E 8.23 4.20 0.00 2.09 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 0.00 2.43 2.43 0.00 41 D 8.05 4.42 0.00 2.94 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 42 Y 7.72 4.22 0.00 3.14 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 43 N 7.97 4.85 0.00 2.87 2.87 0.00 0.00 7.02 7.39 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 44 L 7.23 4.33 0.00 1.76 1.62 0.98 0.89 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 45 S 8.94 4.42 0.00 3.87 3.78 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 46 E 8.91 4.05 0.00 2.05 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.47 0.00 47 G 8.09 3.66 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 48 Q 7.91 3.99 0.00 2.26 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.86 0.00 0.00 0.00 0.00 0.00 2.45 2.42 0.00 49 L 8.21 4.11 0.00 1.74 1.85 0.85 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 50 M 8.39 4.12 0.00 2.09 2.27 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.85 2.59 0.00 51 N 8.27 4.51 0.00 2.80 2.86 0.00 0.00 7.02 7.88 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 52 K 7.57 3.98 0.00 1.79 1.81 0.00 1.63 0.00 0.00 1.43 0.00 0.00 2.62 0.00 0.00 2.80 0.00 0.00 0.00 0.00 0.55 1.14 7.81 53 F 8.24 4.66 0.00 3.05 2.99 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 54 K 8.13 4.00 0.00 1.98 1.86 0.00 1.59 0.00 0.00 2.35 0.00 0.00 3.09 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.43 1.45 7.81 55 N 8.16 4.59 0.00 2.79 2.89 0.00 0.00 6.67 7.99 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 56 N 8.60 5.13 0.00 2.66 2.78 0.00 0.00 6.55 6.99 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 57 I 8.03 4.75 2.10 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 1.23 0.92 1.04 0.00 0.00 58 V 8.88 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 0.81 0.00 0.00 0.86 0.00 0.00 59 I 8.34 4.70 1.84 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 1.21 0.45 0.93 0.00 0.00 60 V 8.76 4.54 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 0.68 0.00 0.00 1.00 0.00 0.00 61 G 9.13 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 0.00 0.00 0.00 0.00 62 L 8.99 4.68 0.00 1.76 1.62 0.97 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 63 S 7.96 4.15 0.00 3.96 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 64 E 8.07 4.03 0.00 2.09 2.03 0.00 0.00 0.00 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 2.27 0.00 65 I 7.43 4.21 1.73 0.00 0.00 0.03 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 0.52 0.64 0.00 0.00 66 D 8.51 5.00 0.00 2.59 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 67 N 7.74 5.12 0.00 2.92 2.97 0.00 0.00 6.47 7.52 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 68 T 8.08 4.50 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 1.30 0.00 0.00 69 D 7.95 4.56 0.00 2.77 2.79 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 70 D 8.02 4.55 0.00 2.76 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 L 7.63 4.13 0.00 1.94 2.00 1.01 0.53 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 72 K 8.44 4.52 0.00 1.76 1.72 0.00 1.77 0.00 0.00 1.75 0.00 0.00 3.03 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.37 1.55 7.81 73 R 8.49 4.33 0.00 1.99 1.97 0.00 3.09 0.00 0.00 3.27 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.65 0.00 74 G 10.10 4.02 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 E 7.87 4.86 0.00 2.09 1.85 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 2.29 2.22 0.00 76 K 8.62 5.12 0.00 1.89 1.58 0.00 1.61 0.00 0.00 1.83 0.00 0.00 2.75 0.00 0.00 2.61 0.00 0.00 0.00 0.00 1.19 1.02 7.81 77 I 8.92 4.82 1.68 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.94 0.75 0.00 0.00 78 K 8.82 4.59 0.00 1.50 1.47 0.00 1.38 0.00 0.00 1.43 0.00 0.00 2.34 0.00 0.00 2.86 0.00 0.00 0.00 0.00 0.44 0.98 7.81 79 V 8.51 4.54 2.23 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 0.76 0.00 0.00 1.17 0.00 0.00 80 W 8.80 5.30 0.00 3.60 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 81 F 8.70 5.33 0.00 3.17 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 82 H 8.71 4.82 0.00 3.18 3.36 0.00 5.94 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 T 8.07 4.55 4.30 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 1.24 0.00 0.00 84 R 8.54 4.90 0.00 1.76 1.76 0.00 2.91 0.00 0.00 3.25 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.59 0.00 85 K 9.21 4.34 0.00 1.75 1.67 0.00 1.61 0.00 0.00 1.63 0.00 0.00 2.83 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.29 1.36 7.81 86 E 8.83 4.63 0.00 1.98 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 2.26 2.30 0.00 87 S 8.29 4.41 0.00 3.95 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 N 8.23 4.02 0.00 2.83 2.83 0.00 0.00 7.05 7.69 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 89 P 0.00 4.45 0.00 2.07 1.96 0.00 3.72 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.07 0.00 90 P 0.00 4.88 0.00 2.03 2.13 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 2.02 1.93 0.00 91 S 9.21 5.15 0.00 3.82 3.91 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 92 A 8.67 4.73 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 93 T 8.90 4.62 4.38 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 1.22 0.00 0.00 94 I 8.13 4.91 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 1.31 0.56 1.11 0.00 0.00 95 Q 8.27 4.43 0.00 2.07 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.62 6.58 0.00 0.00 0.00 0.00 0.00 2.33 2.31 0.00 96 K 7.55 4.83 0.00 1.87 1.81 0.00 1.57 0.00 0.00 1.55 0.00 0.00 2.89 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.84 1.59 7.81 97 Y 9.05 5.23 0.00 2.89 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 98 E 8.94 4.57 0.00 1.68 1.37 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 2.00 2.16 0.00 99 L 8.22 4.03 0.00 1.26 1.10 0.76 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 100 L 7.70 4.81 0.00 1.55 1.47 0.75 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 101 L 7.94 4.61 0.00 1.70 1.72 0.94 0.95 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 0.00 102 E 8.82 4.24 0.00 2.04 2.03 0.00 0.00 0.00 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 2.54 0.00 103 H 8.31 4.32 0.00 3.10 3.36 0.00 5.88 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 H 7.58 4.88 0.00 3.10 3.16 0.00 6.00 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 H 8.90 4.28 0.00 3.08 3.26 0.00 5.98 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 H 7.59 4.30 0.00 3.01 3.22 0.00 5.76 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 H 8.13 4.15 0.00 3.06 3.16 0.00 5.72 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 0.00 108 H 8.30 4.48 0.00 3.09 3.16 0.00 5.98 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