NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 D 4.5775 8.3649 120.1893 53.7910 42.2257 175.6030 3 K 3.9840 8.5969 124.9984 57.7501 32.3166 175.8932 4 I 4.1560 9.1217 122.5438 61.3534 38.5979 175.2475 5 I 4.4390 8.4670 126.6824 59.8939 40.0060 174.4661 6 H 5.1938 8.6218 122.4899 54.2034 30.3829 174.2336 7 L 4.6531 8.8627 124.8815 54.3807 43.2850 176.0865 8 T 4.8264 8.6972 108.8340 59.2841 71.9762 174.5176 9 D 4.4031 9.1123 122.2476 57.4339 40.5678 178.5372 10 D 4.5460 8.0038 118.6903 56.4036 41.5260 178.5121 11 S 4.1380 8.1330 114.8481 61.5427 62.6294 176.2231 12 F 4.0363 8.0506 123.9491 61.6034 38.9539 176.6244 13 D 4.4097 8.2595 117.1925 57.4640 40.7131 178.3348 14 T 3.9319 7.6219 114.5152 66.5216 69.0609 176.4729 15 D 4.4001 8.7172 120.3784 56.5883 40.9927 176.9375 16 V 3.8208 7.7515 115.6433 64.1234 32.7619 177.3076 17 L 3.8383 7.1849 117.7906 57.1121 41.7123 178.9162 18 K 4.3643 7.4584 114.2711 55.6629 33.2652 176.4543 19 A 3.9927 7.3207 122.1999 52.4725 18.7843 176.2635 20 D 4.5462 8.4843 119.6294 53.8905 42.4166 177.6460 21 G 3.8104 8.6567 114.3570 44.3272 0.0000 172.0716 22 A 4.6346 8.1238 119.6559 51.8231 19.9557 176.8493 23 I 4.8678 9.0826 121.8831 59.3729 41.9520 173.4355 24 L 5.0015 9.3644 132.4969 54.0731 43.5566 175.0149 25 V 4.8433 9.2525 127.2827 61.3030 33.9074 173.6543 26 D 5.5779 9.0979 127.7710 52.6301 43.9657 174.4456 27 F 5.2552 9.1849 125.6675 56.2119 40.8597 175.1437 28 W 5.6754 8.8653 119.2313 55.3783 32.3039 173.3428 29 A 4.5271 8.5630 119.9639 49.9664 21.5860 175.9677 30 E 3.9493 8.0739 119.2001 56.7825 30.2209 177.2362 31 W 3.8972 9.3301 119.9276 57.5045 27.7680 173.6814 32 C 4.6353 8.0106 120.1433 55.2007 43.7118 173.7131 33 G 3.7548 8.5289 114.5600 47.5666 0.0000 172.1806 34 P 4.2601 0.0000 0.0000 65.2045 31.7688 179.1756 35 C 4.2816 8.3325 114.3555 60.2720 39.9827 176.2029 36 K 3.8151 7.9007 118.3444 59.6755 31.6403 179.0830 37 M 4.2209 7.9371 118.3805 58.2986 32.2863 178.3001 38 I 4.0362 7.7824 110.8785 61.5836 38.2315 177.5241 39 A 3.8282 7.7553 123.8698 54.9705 18.1948 177.9858 40 P 4.2370 0.0000 0.0000 65.7910 31.4181 178.5813 41 I 3.7908 7.5565 119.5167 64.0806 37.0400 178.0398 42 L 4.0133 8.2834 120.4066 57.7495 40.9596 179.2150 43 D 4.3094 8.0005 118.7807 57.3808 40.6782 178.6430 44 E 3.8379 7.9255 119.2766 59.1733 29.4039 179.4224 45 I 3.8552 7.9205 119.9513 64.2811 36.9579 178.0801 46 A 4.0045 8.0926 120.8837 54.9900 18.3085 178.9740 47 D 4.5391 7.6651 116.6075 57.0122 41.2614 178.9393 48 E 3.9652 8.3005 117.4457 58.9663 29.7275 177.4974 49 Y 4.5059 8.3025 115.8552 57.2546 38.7624 175.1762 50 Q 4.1154 7.9331 121.4918 57.8335 29.4517 178.2868 51 G 4.0938 8.8792 111.7124 45.5740 0.0000 174.0222 52 K 4.3733 7.8669 118.6790 56.7521 33.7919 175.8339 53 L 5.0732 8.2156 118.9952 53.4400 45.1717 175.8179 54 T 4.5941 8.4037 121.3082 61.8141 71.4513 173.5296 55 V 4.6244 8.3768 125.7878 61.5773 33.0568 173.9389 56 A 5.2041 9.2145 130.7792 50.1074 21.7247 175.0801 57 K 4.9852 9.3441 121.3969 54.5035 35.4792 175.3051 58 L 4.8607 9.0334 125.9934 53.0052 44.9609 175.2638 59 N 3.7632 8.8103 126.3245 52.6826 38.4643 174.6986 60 I 4.4650 8.0473 120.6455 63.4496 37.5709 177.6456 61 D 4.3482 7.9259 121.9466 57.3348 40.9003 177.9312 62 Q 4.2248 7.8078 118.0274 57.7228 29.2029 177.2927 63 N 5.6282 7.9067 115.9996 51.1213 39.9633 172.6494 64 P 4.7785 0.0000 0.0000 61.7462 32.4050 177.3835 65 G 3.8630 7.8826 107.5107 47.0806 0.0000 175.2504 66 T 3.8534 8.3393 114.8065 64.7209 67.8002 176.2984 67 A 4.4135 8.3117 123.9470 54.9853 18.5509 177.7337 68 P 4.2740 0.0000 0.0000 65.3734 31.5724 177.9289 69 K 3.7218 7.3615 115.9135 58.5769 32.0845 176.3958 70 Y 4.6111 7.4258 115.9914 55.6470 40.3892 175.0251 71 G 3.9607 8.7168 116.8854 45.7130 0.0000 173.7978 72 I 4.0698 7.1831 119.0889 60.4317 36.8635 176.3450 73 R 4.2037 7.8194 126.8274 51.6930 28.6680 175.7779 74 G 4.2362 7.7257 106.9744 43.9541 0.0000 170.8651 75 I 4.7966 7.7871 112.7900 57.8877 40.8620 172.8510 76 P 4.7587 0.0000 0.0000 63.3353 32.2660 175.2489 77 T 4.8176 8.3307 118.0222 61.5473 72.5064 172.8651 78 L 5.1706 9.0364 124.0455 53.0097 45.4108 175.3733 79 L 5.0095 9.0513 123.4010 52.7925 44.8687 175.0977 80 L 4.9197 9.0465 126.4828 53.6078 43.9344 174.8101 81 F 4.8941 9.3191 126.4822 56.0622 41.1380 175.4285 82 K 4.6366 8.3994 122.1391 54.8611 35.0273 175.9448 83 N 4.5463 9.4653 122.6182 54.1799 35.5105 176.1133 84 G 4.0972 8.8511 106.6795 46.0986 0.0000 173.6323 85 E 4.7392 7.6899 120.5928 53.6352 31.7610 175.0299 86 V 2.9773 8.5797 125.4079 63.5295 31.8290 174.9414 87 A 4.4452 8.8987 129.5923 53.9883 19.7896 176.9681 88 A 4.7394 7.5027 114.4901 51.0956 22.9181 175.1394 89 T 5.0760 8.5320 113.1548 60.1900 71.1362 173.0295 90 K 4.2200 9.0187 128.4907 54.5622 34.9172 174.9536 91 V 4.3046 8.4538 127.2647 62.3958 33.3178 176.4107 92 G 3.9995 8.4003 110.9861 44.9396 0.0000 173.2266 93 A 4.1872 8.1219 121.8977 52.0575 18.9573 177.0047 94 L 4.7135 7.8673 119.9083 53.2676 43.5569 176.1698 95 S 4.5058 8.9432 115.9613 57.1713 65.4847 175.2583 96 K 3.9611 8.5738 122.2834 59.9189 31.8951 178.8281 97 G 3.6927 8.0857 105.2362 47.9176 0.0000 175.4844 98 Q 4.0869 7.9966 120.0627 58.6818 28.6415 178.4491 99 L 4.1007 8.1427 121.4573 57.8451 42.0198 179.2439 100 K 4.0786 8.1047 118.8027 59.6297 31.8519 179.0476 101 C 4.1966 8.2612 117.0557 62.6593 27.7803 175.9823 102 F 4.2282 7.9678 120.8754 61.2929 39.2917 176.7429 103 L 3.7167 8.2456 118.7733 58.0968 41.2831 179.3182 104 D 4.4211 8.3213 117.3493 57.1748 40.8565 178.1019 105 A 4.3782 7.4121 118.4139 52.5606 18.9902 177.1662 106 N 4.8025 7.9381 112.9756 52.5665 40.5771 174.7700 107 L 4.3299 7.6888 118.7531 54.2812 41.8069 176.3808 108 A 4.0355 7.8258 125.7233 52.8103 18.5856 177.8426 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 D 8.36 4.58 0.00 2.64 2.62 0.00 0.00 0.00 0.00 0.00 0.00 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 8.60 3.98 0.00 1.84 1.84 0.00 1.68 0.00 0.00 1.88 0.00 0.00 3.14 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.65 1.55 7.81 4 I 9.12 4.16 1.84 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 1.16 0.60 0.76 0.00 0.00 5 I 8.47 4.44 1.81 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 1.18 1.19 0.87 0.00 0.00 6 H 8.62 5.19 0.00 3.05 3.29 0.00 5.69 0.00 0.00 0.00 0.00 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 L 8.86 4.65 0.00 1.61 1.79 1.02 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 8 T 8.70 4.83 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 1.24 0.00 0.00 9 D 9.11 4.40 0.00 2.70 2.78 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 10 D 8.00 4.55 0.00 2.78 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 11 S 8.13 4.14 0.00 4.25 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 0.00 12 F 8.05 4.04 0.00 3.37 3.16 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 13 D 8.26 4.41 0.00 2.86 2.69 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 14 T 7.62 3.93 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 15 D 8.72 4.40 0.00 2.56 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 16 V 7.75 3.82 0.70 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 -0.23 0.00 0.00 0.19 0.00 0.00 17 L 7.18 3.84 0.00 1.85 1.73 1.16 0.89 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 18 K 7.46 4.36 0.00 1.80 1.79 0.00 1.71 0.00 0.00 1.69 0.00 0.00 3.15 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.37 1.41 7.81 19 A 7.32 3.99 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 D 8.48 4.55 0.00 2.63 2.55 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 21 G 8.66 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 22 A 8.12 4.63 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 23 I 9.08 4.87 1.85 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 1.66 0.95 0.00 0.00 24 L 9.36 5.00 0.00 1.78 1.54 1.13 0.69 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 25 V 9.25 4.84 2.47 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 0.74 0.00 0.00 1.02 0.00 0.00 26 D 9.10 5.58 0.00 2.80 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 27 F 9.18 5.26 0.00 2.99 3.06 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 28 W 8.87 5.68 0.00 3.54 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 29 A 8.56 4.53 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 30 E 8.07 3.95 0.00 1.77 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 2.23 2.11 0.00 31 W 9.33 3.90 0.00 3.53 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 32 C 8.01 4.64 0.00 3.01 3.46 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 33 G 8.53 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 0.00 0.00 0.00 34 P 0.00 4.26 0.00 2.21 2.18 0.00 3.67 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.24 0.00 35 C 8.33 4.28 0.00 3.25 3.31 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 36 K 7.90 3.82 0.00 1.90 1.88 0.00 1.70 0.00 0.00 1.67 0.00 0.00 3.03 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.78 1.69 7.81 37 M 7.94 4.22 0.00 1.99 2.32 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 2.65 2.87 0.00 38 I 7.78 4.04 1.85 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 1.61 1.14 0.94 0.00 0.00 39 A 7.76 3.83 1.25 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 0.00 0.00 40 P 0.00 4.24 0.00 2.25 2.28 0.00 3.68 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 2.15 2.03 0.00 41 I 7.56 3.79 1.99 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 1.64 0.78 0.91 0.00 0.00 42 L 8.28 4.01 0.00 1.76 1.65 0.87 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 43 D 8.00 4.31 0.00 2.92 2.69 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 44 E 7.93 3.84 0.00 2.14 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 0.00 2.33 2.54 0.00 45 I 7.92 3.86 1.99 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.80 0.70 0.00 0.00 46 A 8.09 4.00 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 0.00 0.00 0.00 0.00 0.00 47 D 7.67 4.54 0.00 2.68 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 48 E 8.30 3.97 0.00 2.14 1.99 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 2.36 2.64 0.00 49 Y 8.30 4.51 0.00 3.16 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 50 Q 7.93 4.12 0.00 2.19 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.62 0.00 0.00 0.00 0.00 0.00 2.36 2.38 0.00 51 G 8.88 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 52 K 7.87 4.37 0.00 1.74 2.01 0.00 1.66 0.00 0.00 1.65 0.00 0.00 2.93 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.43 1.48 7.81 53 L 8.22 5.07 0.00 1.67 1.56 0.94 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 54 T 8.40 4.59 4.22 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 1.18 0.00 0.00 55 V 8.38 4.62 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 0.93 0.00 0.00 0.93 0.00 0.00 56 A 9.21 5.20 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 57 K 9.34 4.99 0.00 1.72 1.84 0.00 1.55 0.00 0.00 1.36 0.00 0.00 2.23 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.24 1.33 7.81 58 L 9.03 4.86 0.00 1.56 0.99 0.89 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 59 N 8.81 3.76 0.00 2.20 2.46 0.00 0.00 7.26 7.94 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 60 I 8.05 4.47 1.89 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 1.39 0.79 1.06 0.00 0.00 61 D 7.93 4.35 0.00 2.72 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 62 Q 7.81 4.22 0.00 1.94 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 7.15 0.00 0.00 0.00 0.00 0.00 2.29 2.37 0.00 63 N 7.91 5.63 0.00 2.78 2.77 0.00 0.00 6.91 7.93 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 64 P 0.00 4.78 0.00 2.15 2.12 0.00 3.46 0.00 0.00 4.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.88 0.00 65 G 7.88 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 66 T 8.34 3.85 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 1.14 0.00 0.00 67 A 8.31 4.41 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 68 P 0.00 4.27 0.00 2.02 2.10 0.00 3.77 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 2.19 2.10 0.00 69 K 7.36 3.72 0.00 1.53 1.33 0.00 1.57 0.00 0.00 1.59 0.00 0.00 2.76 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.34 1.60 7.81 70 Y 7.43 4.61 0.00 2.83 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 71 G 8.72 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 0.00 0.00 0.00 72 I 7.18 4.07 1.67 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.65 0.72 0.00 0.00 73 R 7.82 4.20 0.00 1.77 1.87 0.00 3.17 0.00 0.00 3.21 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.59 0.00 74 G 7.73 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 75 I 7.79 4.80 2.13 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 1.51 0.77 0.97 0.00 0.00 76 P 0.00 4.76 0.00 2.19 2.33 0.00 3.66 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 1.93 0.00 77 T 8.33 4.82 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 1.06 0.00 0.00 78 L 9.04 5.17 0.00 1.44 1.53 0.87 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 79 L 9.05 5.01 0.00 1.92 1.39 0.81 0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 80 L 9.05 4.92 0.00 1.83 1.69 0.92 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 81 F 9.32 4.89 0.00 3.11 2.90 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 82 K 8.40 4.64 0.00 1.62 1.71 0.00 1.89 0.00 0.00 1.62 0.00 0.00 2.81 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.34 1.37 7.81 83 N 9.47 4.55 0.00 2.90 2.98 0.00 0.00 7.40 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 84 G 8.85 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 85 E 7.69 4.74 0.00 2.17 1.84 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 2.22 2.27 0.00 86 V 8.58 2.98 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 0.56 0.00 0.00 0.25 0.00 0.00 87 A 8.90 4.45 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 88 A 7.50 4.74 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 89 T 8.53 5.08 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 1.20 0.00 0.00 90 K 9.02 4.22 0.00 0.79 0.91 0.00 1.27 0.00 0.00 1.05 0.00 0.00 2.78 0.00 0.00 2.67 0.00 0.00 0.00 0.00 0.67 1.04 7.81 91 V 8.45 4.30 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 0.79 0.00 0.00 0.86 0.00 0.00 92 G 8.40 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 93 A 8.12 4.19 1.25 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 0.00 0.00 94 L 7.87 4.71 0.00 1.80 1.55 0.83 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 95 S 8.94 4.51 0.00 4.07 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 96 K 8.57 3.96 0.00 1.82 1.88 0.00 1.77 0.00 0.00 1.88 0.00 0.00 3.11 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.54 1.49 7.81 97 G 8.09 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 98 Q 8.00 4.09 0.00 2.22 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.75 0.00 0.00 0.00 0.00 0.00 2.39 2.37 0.00 99 L 8.14 4.10 0.00 1.77 1.85 1.00 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 100 K 8.10 4.08 0.00 2.14 1.96 0.00 1.80 0.00 0.00 1.75 0.00 0.00 3.05 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.74 1.73 7.81 101 C 8.26 4.20 0.00 3.18 3.03 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 0.00 102 F 7.97 4.23 0.00 3.03 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 0.00 103 L 8.25 3.72 0.00 1.73 1.48 0.31 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 104 D 8.32 4.42 0.00 2.73 2.78 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 0.00 105 A 7.41 4.38 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 0.00 106 N 7.94 4.80 0.00 2.20 2.56 0.00 0.00 6.89 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 0.00 107 L 7.69 4.33 0.00 1.64 1.68 0.99 0.78 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 0.00 108 A 7.83 4.04 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