NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 13 D 4.6367 8.2227 120.5476 53.9929 42.8516 177.4750 14 E 3.5437 8.4991 121.5845 58.9245 29.4145 176.1312 15 A 4.0356 8.0435 119.2717 55.1518 19.0331 178.9546 16 G 4.0048 7.7595 104.0058 47.4101 0.0000 175.5646 17 I 3.8723 7.1467 121.2078 63.0043 37.5048 177.3362 18 T 3.8874 6.9533 116.1611 63.3412 69.1716 174.3292 19 G 3.4709 7.6148 113.1389 44.7519 0.0000 171.2759 20 T 4.6550 7.6842 117.4504 61.6104 70.2944 174.4195 21 W 4.9970 9.1393 125.7729 55.0320 33.5391 173.9936 22 Y 5.5508 9.4956 119.6997 56.5307 41.7260 175.0011 23 N 5.7869 9.0259 121.0859 50.2489 40.0864 175.6690 24 Q 4.1239 8.6441 115.8736 58.5893 28.7070 177.0650 25 L 4.2093 8.1027 116.9876 55.2559 42.1622 177.4437 26 G 4.0329 8.2438 107.1742 44.9763 0.0000 173.9478 27 S 4.6146 8.4644 116.0116 58.6918 64.5392 173.2095 28 T 4.9391 8.8923 119.2476 61.7083 71.4801 172.9459 29 F 4.8896 9.1792 128.7281 56.4879 42.2326 173.5069 30 I 4.6399 8.3147 128.1173 59.3024 39.4392 175.4126 31 V 4.6274 8.2257 125.8124 60.1313 35.3071 174.1384 32 T 4.7438 8.9832 119.3019 61.7258 71.1952 172.8211 33 A 4.8785 8.6438 129.1303 50.4913 20.1549 177.3640 34 G 3.9283 9.3023 112.0976 44.2057 0.0000 174.7787 35 A 4.1819 8.4710 122.7870 54.7951 18.5570 178.9791 36 D 4.3464 7.9364 114.3803 54.6151 40.0695 176.6369 37 G 3.1661 7.5836 107.5380 44.6480 0.0000 173.2319 38 A 4.5380 8.3057 122.7254 51.6127 19.9951 176.7122 39 L 5.2421 8.9257 121.1585 53.3266 45.1266 175.9502 40 T 4.9010 8.6482 119.1372 61.5432 73.1983 174.3020 41 G 3.9188 7.5100 111.1999 46.3664 0.0000 171.3874 42 T 5.2264 7.7664 110.4767 60.1052 72.7470 172.7549 43 Y 5.0593 9.4126 124.1855 55.8352 42.4513 173.7167 44 E 5.2886 9.0841 127.1742 54.5604 32.4721 174.5716 45 S 4.9454 9.3150 122.1122 57.5945 63.2823 173.8649 46 A 4.2558 8.9133 130.5644 53.7061 18.5463 177.1221 47 V 4.3752 7.2639 107.6177 60.1491 35.4438 176.1888 48 G 3.6014 8.4218 108.9987 44.8074 0.0000 173.6679 49 N 4.5556 8.0162 114.8783 51.6339 37.1252 174.0953 50 A 4.9117 7.3903 121.7846 50.6750 22.6780 175.8430 51 E 4.6747 9.2366 118.1039 55.9973 33.0738 177.1303 52 S 3.6752 8.3960 115.1970 58.3351 61.6796 169.8266 53 R 4.9882 8.3273 116.4746 55.5363 31.8027 175.6291 54 Y 4.8177 9.0132 119.5241 55.7944 41.8407 175.3728 55 V 4.3112 8.6301 123.0587 63.0602 32.6556 175.0408 56 L 5.5009 8.9565 126.8278 53.3515 43.9605 175.1864 57 T 5.0477 8.3258 113.9043 61.2919 71.4849 173.0365 58 G 4.3225 8.7481 112.2687 46.2963 0.0000 171.9661 59 R 5.5630 8.9290 117.5215 54.8332 34.7005 174.2584 60 Y 5.2891 8.7312 118.8596 55.1906 41.9662 174.7001 61 D 4.3184 9.1318 120.8308 54.1497 40.6340 176.9431 62 S 4.3063 8.1482 120.9744 59.2371 63.9241 174.6054 63 A 4.6377 7.8095 123.6098 49.9184 18.5050 173.5388 64 P 5.0352 0.0000 0.0000 60.4367 32.9557 177.2207 65 A 4.1911 8.4032 122.0285 52.8074 18.7409 177.7967 66 T 4.6950 8.3059 110.9629 61.9098 69.4222 174.6503 67 D 4.8182 8.3300 118.2627 54.2803 39.8090 176.8575 68 G 3.9519 8.4363 106.5864 46.1730 0.0000 174.6404 69 S 4.3283 7.6884 115.5383 57.9867 63.3972 174.1349 70 G 4.0285 8.2671 109.9416 45.8910 0.0000 172.8209 71 T 4.8262 9.0317 116.8167 61.4140 70.3664 174.6520 72 A 4.7973 8.6920 129.4304 52.2034 19.9091 175.8993 73 L 5.0695 9.1380 120.7787 55.4656 44.5917 174.1237 74 G 4.6876 9.3572 105.7188 45.4863 0.0000 171.9986 75 W 5.8224 8.5152 117.0154 55.6463 32.3743 173.4029 76 T 5.1703 9.3706 117.1527 61.8042 71.9315 173.2818 77 V 4.6725 8.8105 124.7999 60.9376 34.3936 173.9106 78 A 4.5745 8.3509 129.6926 49.7872 20.0938 177.4815 79 W 4.2345 8.6693 125.8893 56.7145 29.0323 176.4237 80 K 5.2369 8.0736 118.6154 54.7003 33.8636 174.3555 81 N 4.9499 9.1514 123.0005 52.0240 39.7657 174.3026 82 N 4.3590 8.6860 113.9052 56.2151 38.9242 175.7154 83 Y 4.4273 7.5784 115.6859 59.5458 38.9013 175.9090 84 R 4.7485 8.7157 116.7378 54.6883 34.4675 173.8246 85 N 5.2291 8.5591 117.0128 52.3614 40.6076 173.5490 86 A 4.3638 9.0972 128.4517 51.5094 19.6293 176.4920 87 H 4.1583 8.5327 114.3067 56.3870 26.9186 173.2540 88 S 5.2096 7.4121 111.5067 57.8040 67.0161 174.4313 89 A 4.9986 9.1235 121.2952 50.7943 22.6966 175.1666 90 T 4.8731 8.6817 118.8944 61.7381 71.4841 173.4516 91 T 4.8842 8.3466 115.9174 59.6313 71.6800 172.8816 92 W 4.8714 8.6027 125.3531 54.8235 31.4528 174.8456 93 S 4.9128 8.7368 119.6833 56.7459 64.7925 173.1969 94 G 4.1710 8.3747 112.5941 46.5847 0.0000 171.6707 95 Q 5.2234 8.3879 117.8257 54.8002 32.6908 173.5963 96 Y 4.7735 9.2548 123.3922 56.7444 40.7707 174.1752 97 V 4.2110 8.4940 126.3449 61.1051 34.4342 175.8501 98 G 3.5164 8.0963 117.8634 44.5282 0.0000 171.4104 99 G 3.7798 8.7178 105.1554 44.0963 0.0000 172.6149 100 A 4.0857 8.6112 120.4257 55.1533 18.7988 178.9669 101 E 4.4992 7.7659 114.4477 54.9944 28.5060 176.1502 102 A 4.4691 7.5935 120.6752 52.5560 19.8298 178.5862 103 R 5.2580 9.3781 119.8832 54.9463 35.6326 174.4313 104 I 4.8814 8.8932 122.7145 59.9053 39.7663 174.3218 105 N 5.3740 8.9781 126.2743 52.1505 40.0405 174.7838 106 T 5.3259 9.2034 113.4451 60.0820 73.0222 172.7521 107 Q 4.9878 9.1422 121.5360 53.8974 32.3145 174.7285 108 W 5.3144 8.3849 118.6489 54.6025 32.3472 173.9213 109 L 5.0980 8.6781 120.5923 53.0086 44.5284 175.2513 110 L 4.9444 9.3299 127.3797 53.9250 43.7699 174.9010 111 T 5.0674 8.7648 124.0516 62.0434 70.7903 174.0510 112 S 5.1190 8.7301 122.5063 56.3889 65.3103 174.4340 113 G 3.8606 8.8228 111.8354 46.7533 0.0000 173.0605 114 T 4.8124 8.3239 114.2393 59.5254 72.5767 173.3253 115 T 4.0879 8.0698 111.7240 61.1652 69.6876 175.3704 116 E 3.9786 8.7465 121.3221 59.4149 29.6964 179.6051 117 A 4.0793 8.0890 120.5969 54.4892 18.8883 177.5825 118 N 4.7277 7.9788 111.0931 52.8971 39.4200 176.5974 119 A 4.1085 8.0884 123.9325 54.1673 18.6279 180.4113 120 W 4.3688 8.3642 112.3194 58.6055 28.1792 176.6915 121 K 4.1348 6.5185 117.8283 56.1016 32.2083 177.2563 122 S 4.2364 7.7005 115.4077 60.6177 63.7044 173.2504 123 T 5.0150 7.5356 117.2542 61.7615 70.8875 173.5101 124 L 4.7110 9.0522 127.4713 53.5904 43.8856 176.1769 125 V 4.3948 7.9560 120.5918 60.2419 34.3793 175.0840 126 G 3.1154 6.3495 108.7079 45.5391 0.0000 170.6765 127 H 5.3445 8.0133 114.2899 54.1339 31.5496 172.5889 128 D 5.3460 9.2213 121.7591 52.8339 44.5526 174.8545 129 T 5.1719 8.8337 119.0035 61.9228 71.3867 173.1064 130 F 5.6731 9.6401 125.7908 56.1480 41.7539 174.9691 131 T 5.5636 9.5086 112.4283 59.9455 72.1693 174.9706 132 K 3.6594 8.8811 120.3201 57.8805 32.3781 177.4371 133 V 4.2527 7.7093 110.8786 59.8076 34.3961 175.5046 134 K 3.9931 8.3032 120.6156 56.7410 32.5962 175.7522 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 13 D 8.22 4.64 0.00 2.65 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 14 E 8.50 3.54 0.00 2.20 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 0.00 2.35 2.58 0.00 15 A 8.04 4.04 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 16 G 7.76 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 0.00 0.00 0.00 17 I 7.15 3.87 1.32 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 0.62 -0.36 0.51 0.00 0.00 18 T 6.95 3.89 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 1.15 0.00 0.00 19 G 7.61 3.47 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 0.00 0.00 0.00 0.00 20 T 7.68 4.66 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 0.67 0.00 0.00 21 W 9.14 5.00 0.00 3.33 3.32 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 22 Y 9.50 5.55 0.00 3.06 2.86 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 23 N 9.03 5.79 0.00 2.41 1.71 0.00 0.00 6.61 7.36 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 24 Q 8.64 4.12 0.00 2.21 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.05 7.00 0.00 0.00 0.00 0.00 0.00 2.36 2.37 0.00 25 L 8.10 4.21 0.00 1.89 1.81 1.01 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 26 G 8.24 4.03 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 0.00 0.00 0.00 0.00 0.00 0.00 27 S 8.46 4.61 0.00 4.10 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 28 T 8.89 4.94 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 1.03 0.00 0.00 29 F 9.18 4.89 0.00 2.54 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 30 I 8.31 4.64 1.70 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.52 0.73 0.00 0.00 31 V 8.23 4.63 0.77 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 0.35 0.00 0.00 0.63 0.00 0.00 32 T 8.98 4.74 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 1.15 0.00 0.00 33 A 8.64 4.88 0.77 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 0.00 0.00 34 G 9.30 3.93 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 0.00 0.00 0.00 35 A 8.47 4.18 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 36 D 7.94 4.35 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 37 G 7.58 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 0.00 0.00 0.00 38 A 8.31 4.54 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 39 L 8.93 5.24 0.00 1.76 1.54 1.16 0.68 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 40 T 8.65 4.90 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 1.18 0.00 0.00 41 G 7.51 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 42 T 7.77 5.23 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 1.21 0.00 0.00 43 Y 9.41 5.06 0.00 2.99 2.86 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 44 E 9.08 5.29 0.00 2.08 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 2.28 2.53 0.00 45 S 9.31 4.95 0.00 4.17 3.77 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 46 A 8.91 4.26 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 47 V 7.26 4.38 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 0.73 0.00 0.00 0.87 0.00 0.00 48 G 8.42 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 49 N 8.02 4.56 0.00 2.58 2.62 0.00 0.00 6.59 7.96 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 50 A 7.39 4.91 1.02 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 51 E 9.24 4.67 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 2.25 1.89 0.00 52 S 8.40 3.68 0.00 3.44 3.72 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 53 R 8.33 4.99 0.00 1.74 1.87 0.00 3.20 0.00 0.00 3.23 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.67 0.00 54 Y 9.01 4.82 0.00 2.83 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 55 V 8.63 4.31 2.12 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 0.81 0.00 0.00 0.95 0.00 0.00 56 L 8.96 5.50 0.00 2.03 1.79 0.88 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 57 T 8.33 5.05 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 1.26 0.00 0.00 58 G 8.75 4.32 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 0.00 59 R 8.93 5.56 0.00 1.75 1.79 0.00 3.28 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 1.59 1.73 0.00 60 Y 8.73 5.29 0.00 2.95 2.86 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 61 D 9.13 4.32 0.00 2.80 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 62 S 8.15 4.31 0.00 3.96 3.38 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 63 A 7.81 4.64 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 64 P 0.00 5.04 0.00 2.28 2.18 0.00 3.45 0.00 0.00 5.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.22 0.00 65 A 8.40 4.19 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 66 T 8.31 4.70 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 1.24 0.00 0.00 67 D 8.33 4.82 0.00 2.79 2.76 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 0.00 0.00 0.00 0.00 68 G 8.44 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 0.00 0.00 0.00 69 S 7.69 4.33 0.00 3.90 3.84 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 70 G 8.27 4.03 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 0.00 0.00 0.00 0.00 0.00 0.00 71 T 9.03 4.83 4.57 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 1.47 0.00 0.00 72 A 8.69 4.80 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 73 L 9.14 5.07 0.00 2.09 1.95 0.98 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 74 G 9.36 4.69 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 75 W 8.52 5.82 0.00 3.54 3.28 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 0.00 76 T 9.37 5.17 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 1.17 0.00 0.00 77 V 8.81 4.67 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 -0.40 0.00 0.00 0.83 0.00 0.00 78 A 8.35 4.57 1.20 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 0.00 0.00 0.00 79 W 8.67 4.23 0.00 3.33 2.95 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 K 8.07 5.24 0.00 1.93 1.76 0.00 1.79 0.00 0.00 1.81 0.00 0.00 3.08 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.38 1.46 7.81 81 N 9.15 4.95 0.00 2.75 2.54 0.00 0.00 6.61 7.27 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 82 N 8.69 4.36 0.00 2.31 2.58 0.00 0.00 6.74 7.46 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 83 Y 7.58 4.43 0.00 3.29 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 84 R 8.72 4.75 0.00 2.07 1.90 0.00 3.18 0.00 0.00 3.25 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.72 0.00 85 N 8.56 5.23 0.00 2.65 2.61 0.00 0.00 6.93 7.96 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 86 A 9.10 4.36 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 87 H 8.53 4.16 0.00 3.33 3.31 0.00 5.65 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 S 7.41 5.21 0.00 4.03 3.96 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 0.00 0.00 0.00 0.00 89 A 9.12 5.00 1.16 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 90 T 8.68 4.87 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 -0.52 0.00 0.00 91 T 8.35 4.88 4.15 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 1.15 0.00 0.00 92 W 8.60 4.87 0.00 1.78 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 0.00 0.00 0.00 93 S 8.74 4.91 0.00 3.77 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 94 G 8.37 4.17 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 0.00 0.00 0.00 95 Q 8.39 5.22 0.00 2.17 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.08 6.84 0.00 0.00 0.00 0.00 0.00 2.28 2.34 0.00 96 Y 9.25 4.77 0.00 2.98 2.88 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 0.00 0.00 0.00 97 V 8.49 4.21 1.98 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 0.89 0.00 0.00 0.90 0.00 0.00 98 G 8.10 3.52 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 99 G 8.72 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 0.00 0.00 0.00 100 A 8.61 4.09 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 0.00 101 E 7.77 4.50 0.00 1.99 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 2.26 2.25 0.00 102 A 7.59 4.47 1.46 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 0.00 0.00 103 R 9.38 5.26 0.00 1.77 1.89 0.00 3.15 0.00 0.00 3.26 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.88 0.00 104 I 8.89 4.88 1.78 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 -0.36 1.01 0.00 0.00 105 N 8.98 5.37 0.00 2.73 2.82 0.00 0.00 6.14 7.16 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 0.00 106 T 9.20 5.33 4.46 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 1.46 0.00 0.00 107 Q 9.14 4.99 0.00 1.88 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.73 0.00 0.00 0.00 0.00 0.00 2.23 2.36 0.00 108 W 8.38 5.31 0.00 2.57 2.25 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 0.00 109 L 8.68 5.10 0.00 1.52 1.54 0.87 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 110 L 9.33 4.94 0.00 1.64 1.68 0.64 0.49 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 0.00 111 T 8.76 5.07 4.23 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 1.20 0.00 0.00 112 S 8.73 5.12 0.00 3.68 3.75 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 0.00 113 G 8.82 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 0.00 0.00 0.00 114 T 8.32 4.81 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 1.21 0.00 0.00 115 T 8.07 4.09 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 0.00 116 E 8.75 3.98 0.00 2.07 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 0.00 2.41 2.32 0.00 117 A 8.09 4.08 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 0.00 118 N 7.98 4.73 0.00 2.72 2.64 0.00 0.00 6.75 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 0.00 119 A 8.09 4.11 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 0.00 120 W 8.36 4.37 0.00 3.55 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 0.00 121 K 6.52 4.13 0.00 1.15 0.74 0.00 1.15 0.00 0.00 0.89 0.00 0.00 2.91 0.00 0.00 2.87 0.00 0.00 0.00 0.00 0.30 0.74 7.81 122 S 7.70 4.24 0.00 4.16 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 0.00 123 T 7.54 5.02 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 1.23 0.00 0.00 124 L 9.05 4.71 0.00 1.78 1.74 0.95 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 125 V 7.96 4.39 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 0.55 0.00 0.00 0.62 0.00 0.00 126 G 6.35 3.12 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 0.00 127 H 8.01 5.34 0.00 3.17 3.35 0.00 5.66 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 D 9.22 5.35 0.00 3.07 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 0.00 0.00 0.00 0.00 129 T 8.83 5.17 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 1.38 0.00 0.00 130 F 9.64 5.67 0.00 3.07 3.35 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 0.00 131 T 9.51 5.56 4.42 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 1.40 0.00 0.00 132 K 8.88 3.66 0.00 1.61 1.65 0.00 0.61 0.00 0.00 0.61 0.00 0.00 2.44 0.00 0.00 2.60 0.00 0.00 0.00 0.00 0.74 1.01 7.81 133 V 7.71 4.25 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 0.69 0.00 0.00 0.96 0.00 0.00 134 K 8.30 3.99 0.00 1.82 1.95 0.00 1.83 0.00 0.00 1.91 0.00 0.00 3.04 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.19 1.35 7.81