NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 R 4.2788 8.2544 119.7046 55.8100 32.3540 175.5993 2 D 4.4725 7.7237 118.2166 52.4856 38.9609 173.7366 3 S 4.8000 7.1177 117.9272 56.3086 65.2259 173.1892 4 G 4.3617 6.9942 104.1117 43.9010 0.0000 172.0825 5 T 5.2622 7.8622 116.4785 61.8954 72.9097 173.7298 6 V 4.6232 8.4830 122.0593 60.1865 35.3219 173.4192 7 W 5.1432 8.9497 121.9190 55.2065 31.8302 175.0156 8 G 4.4063 9.1901 110.1524 45.0466 0.0000 170.5328 9 A 5.3058 8.4494 119.8480 49.4194 22.2300 175.8427 10 L 4.0961 8.5386 124.6706 56.8202 42.4755 177.6220 11 G 3.9150 9.1911 115.0633 45.2215 0.0000 172.1836 12 H 4.8383 8.1026 119.6193 54.0775 33.0918 174.2822 13 G 4.1071 7.9882 108.2031 46.3667 0.0000 172.2661 14 I 4.6069 7.1051 126.5972 60.8860 40.7053 172.1986 15 D 5.2836 7.9194 128.3112 52.3178 43.8784 174.5772 16 L 4.4412 8.3742 126.7408 54.4534 42.2448 175.6093 17 D 5.7454 8.4734 124.5561 52.6428 41.8718 176.6688 18 I 4.0029 8.7790 125.3391 59.8446 37.6598 174.2194 19 P 4.2219 0.0000 0.0000 64.2517 32.0948 176.4723 20 N 4.1773 8.8674 118.9558 54.0265 35.7746 173.2209 21 F 4.9411 7.5131 117.9183 56.5830 43.2339 173.8116 22 Q 3.6297 7.5489 126.1605 54.3894 30.3619 175.1685 23 M 4.2562 7.3164 127.4505 55.3483 29.8986 174.8128 24 T 4.6040 7.2172 113.4368 59.1826 72.0824 175.5291 25 D 4.4131 8.6870 119.9641 57.8949 40.9197 178.0924 26 D 4.4851 8.1363 118.3796 56.7987 41.1264 175.8658 27 I 4.4226 7.8351 120.8454 60.9910 36.9756 175.0586 28 D 4.9331 9.5710 126.5541 54.9914 44.0102 175.2540 29 E 5.2665 8.3468 119.5558 54.4199 32.8569 174.6125 30 V 4.7401 9.5509 128.5272 61.2778 33.9244 174.0449 31 R 4.9311 8.3582 125.3631 54.4885 32.0341 175.5710 32 W 4.7067 9.2937 123.5033 54.9888 29.7162 173.9305 33 E 5.0426 9.0441 123.7464 54.5653 32.2103 175.0226 34 R 4.3753 8.3946 122.7251 54.7210 33.3379 176.0987 35 G 3.7890 9.0982 117.3798 46.9240 0.0000 174.4070 36 S 4.8073 8.7799 114.0226 56.9730 63.4960 173.4378 37 T 4.6315 7.7912 115.1642 63.6605 72.8874 173.2190 38 L 5.0370 8.2496 122.8070 53.5387 43.9929 176.2858 39 V 4.1385 8.2737 120.1688 64.0738 34.5132 175.3439 40 A 5.4247 7.5946 119.1379 52.3331 22.2121 175.0370 41 E 5.1527 9.0728 122.6445 55.1919 32.8150 174.8955 42 F 5.1307 9.6792 128.5641 56.4769 41.4762 174.4729 43 K 4.8574 7.8004 124.8718 54.2120 34.5836 176.8793 44 R 3.8076 8.7541 125.6557 58.7855 30.6362 176.5744 45 K 4.1784 7.7895 117.2914 58.1261 32.5150 176.9511 46 M 2.5500 8.0549 118.6225 58.0104 33.6021 175.0270 47 K 3.7499 8.3879 110.9477 57.2642 29.0308 171.9012 48 P 4.7408 0.0000 0.0000 62.1040 34.3147 177.0351 49 F 4.6908 9.0890 121.3333 56.6517 41.4704 173.8879 50 L 4.3854 7.9942 126.8346 52.9586 41.7520 176.2683 51 K 3.5972 8.1074 127.2102 59.0211 32.7185 176.3671 52 S 4.5552 7.9525 111.8861 57.5936 64.6477 177.2900 53 G 3.7402 8.8513 112.0714 47.7235 0.0000 174.1797 54 A 3.9952 7.7011 121.5820 52.8734 18.5048 176.4035 55 F 5.4984 7.7407 113.9801 56.0552 43.5331 174.7630 56 E 4.5035 8.7794 120.0890 55.2570 33.9653 174.5670 57 I 4.3127 8.5183 126.0496 60.4435 37.7099 175.2108 58 L 4.1679 8.5916 130.1624 54.6341 42.4028 178.7301 59 A 4.0099 8.6795 122.4103 54.6886 17.2778 177.7056 60 N 4.7418 8.1323 113.2920 52.9726 38.0028 175.4978 61 G 4.3800 7.5484 103.9264 47.8497 0.0000 173.9025 62 D 5.1980 7.5129 118.9970 52.7104 44.2042 174.3429 63 L 4.1979 7.4903 122.6142 52.7986 44.0336 174.7793 64 K 4.7284 8.5545 128.5360 54.1356 33.6861 174.9165 65 I 4.4516 8.2045 129.2451 60.7371 37.7606 176.2814 66 K 4.0532 8.5378 128.6473 58.8667 32.7636 176.9595 67 N 4.8146 7.6280 117.7516 51.3520 41.7644 174.3857 68 L 4.4287 8.6472 125.0073 55.9102 43.2033 176.6707 69 T 4.8375 9.0594 110.9234 60.6955 72.6229 174.8739 70 R 3.9127 8.9920 120.4623 59.6499 30.0542 178.9303 71 D 4.6426 8.1678 114.7681 57.0163 41.2112 176.7761 72 D 5.2138 8.0380 116.8669 55.1072 41.2544 176.2501 73 S 4.6223 8.5288 115.5266 56.9642 62.8710 174.0250 74 G 3.8735 7.8237 115.7992 46.1099 0.0000 169.5807 75 T 5.0250 7.9935 116.7116 62.7859 69.7117 174.3200 76 Y 4.7066 9.3571 124.5341 56.5111 41.0682 174.4854 77 N 5.3782 9.2036 119.4202 51.5217 42.5645 173.4149 78 V 4.3101 8.4087 123.7530 61.2045 34.0872 174.5117 79 T 4.5672 8.1100 124.2255 61.5562 70.4995 172.5302 80 V 4.0253 8.4462 127.5669 62.1986 32.8794 174.3991 81 Y 5.3577 9.1176 125.5050 56.2104 41.8495 175.5974 82 S 5.3818 9.1081 117.3558 56.6425 65.1067 175.2411 83 T 4.1849 8.4808 108.8952 64.2520 68.4362 175.0144 84 N 4.4834 8.1426 117.1107 53.6951 38.8108 175.2417 85 G 3.8003 8.2399 106.5725 46.5981 0.0000 173.6284 86 T 4.6707 7.1869 113.5655 61.0714 70.9619 174.1407 87 R 4.1813 8.4740 122.2544 56.4615 30.2039 175.6310 88 I 4.2601 8.3067 124.5496 61.9589 38.3749 175.3185 89 L 4.5587 7.2671 120.9393 53.2801 45.6820 173.9240 90 N 5.2148 8.8099 124.8661 52.0383 40.3993 173.2884 91 K 4.7552 8.6073 125.2164 54.5102 36.6478 175.4714 92 A 5.0340 8.1970 122.2873 50.7339 22.3018 175.2241 93 L 5.0363 9.1045 122.2752 53.0567 46.1375 175.6001 94 D 5.0541 9.1388 121.5683 52.9490 42.8317 175.6890 95 L 4.5799 9.2481 128.3386 53.6159 43.0446 174.7419 96 R 4.5355 8.4254 126.1561 54.8881 31.6441 175.5835 97 I 4.8475 8.0923 125.7475 59.3696 38.9544 175.6465 98 L 4.2610 9.2447 128.9654 54.5834 42.6866 177.5994 99 E 4.2486 8.7945 122.5350 56.5113 29.6886 175.9109 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 R 8.25 4.28 0.00 1.81 2.06 0.00 3.32 0.00 0.00 3.22 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.57 0.00 2 D 7.72 4.47 0.00 2.70 2.58 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.12 4.80 0.00 3.90 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 4 G 6.99 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 0.00 0.00 0.00 0.00 5 T 7.86 5.26 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 0.92 0.00 0.00 6 V 8.48 4.62 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 0.97 0.00 0.00 7 W 8.95 5.14 0.00 3.15 3.19 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 8 G 9.19 4.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.45 5.31 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 10 L 8.54 4.10 0.00 1.78 1.63 0.99 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 11 G 9.19 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 12 H 8.10 4.84 0.00 3.19 3.36 0.00 5.59 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 13 G 7.99 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 14 I 7.11 4.61 1.85 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 1.17 0.94 0.85 0.00 0.00 15 D 7.92 5.28 0.00 2.76 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 16 L 8.37 4.44 0.00 1.35 1.81 0.77 -0.14 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 17 D 8.47 5.75 0.00 2.62 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 18 I 8.78 4.00 2.14 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.72 0.63 0.00 0.00 19 P 0.00 4.22 0.00 2.04 2.01 0.00 3.79 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 2.13 0.00 20 N 8.87 4.18 0.00 2.82 2.83 0.00 0.00 6.77 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 21 F 7.51 4.94 0.00 2.80 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 22 Q 7.55 3.63 0.00 1.79 1.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 7.23 0.00 0.00 0.00 0.00 0.00 2.05 2.13 0.00 23 M 7.32 4.26 0.00 1.87 2.13 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.50 0.00 24 T 7.22 4.60 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 1.15 0.00 0.00 25 D 8.69 4.41 0.00 2.68 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 26 D 8.14 4.49 0.00 2.73 2.75 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 27 I 7.84 4.42 2.12 0.00 0.00 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 1.27 1.08 1.16 0.00 0.00 28 D 9.57 4.93 0.00 2.94 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 29 E 8.35 5.27 0.00 2.10 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 2.42 2.33 0.00 30 V 9.55 4.74 2.31 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 0.70 0.00 0.00 1.12 0.00 0.00 31 R 8.36 4.93 0.00 2.05 2.16 0.00 2.95 0.00 0.00 3.53 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.62 0.00 32 W 9.29 4.71 0.00 3.56 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 33 E 9.04 5.04 0.00 1.90 1.82 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 2.25 2.26 0.00 34 R 8.39 4.38 0.00 1.42 1.46 0.00 2.59 0.00 0.00 2.88 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.50 0.00 35 G 9.10 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 0.00 0.00 0.00 36 S 8.78 4.81 0.00 3.93 3.88 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 37 T 7.79 4.63 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 1.26 0.00 0.00 38 L 8.25 5.04 0.00 1.49 1.90 0.57 0.99 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 39 V 8.27 4.14 2.24 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 -0.09 0.00 0.00 0.79 0.00 0.00 40 A 7.59 5.42 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 41 E 9.07 5.15 0.00 2.10 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 2.38 2.39 0.00 42 F 9.68 5.13 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 43 K 7.80 4.86 0.00 1.56 1.53 0.00 1.72 0.00 0.00 1.71 0.00 0.00 2.73 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.55 1.38 7.81 44 R 8.75 3.81 0.00 2.08 2.08 0.00 3.36 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 1.84 1.71 0.00 45 K 7.79 4.18 0.00 1.72 1.76 0.00 1.90 0.00 0.00 1.59 0.00 0.00 2.94 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.40 1.38 7.81 46 M 8.05 2.55 0.00 1.99 1.97 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.48 0.00 47 K 8.39 3.75 0.00 1.89 1.82 0.00 1.78 0.00 0.00 1.75 0.00 0.00 3.05 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.36 1.40 7.81 48 P 0.00 4.74 0.00 2.19 2.13 0.00 3.72 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.04 0.00 49 F 9.09 4.69 0.00 3.17 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 50 L 7.99 4.39 0.00 1.46 1.53 0.94 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 51 K 8.11 3.60 0.00 1.93 1.98 0.00 1.85 0.00 0.00 1.99 0.00 0.00 3.11 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.62 1.65 7.81 52 S 7.95 4.56 0.00 3.92 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 53 G 8.85 3.74 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 0.00 0.00 0.00 54 A 7.70 4.00 0.78 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 55 F 7.74 5.50 0.00 2.86 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 56 E 8.78 4.50 0.00 1.87 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 2.23 2.24 0.00 57 I 8.52 4.31 1.92 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.00 0.98 0.00 0.00 58 L 8.59 4.17 0.00 1.82 1.63 0.89 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 59 A 8.68 4.01 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 60 N 8.13 4.74 0.00 2.88 2.99 0.00 0.00 6.18 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 61 G 7.55 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 0.00 0.00 0.00 0.00 62 D 7.51 5.20 0.00 3.28 2.57 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 63 L 7.49 4.20 0.00 0.27 0.50 0.15 -0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 64 K 8.55 4.73 0.00 1.88 1.62 0.00 1.69 0.00 0.00 1.68 0.00 0.00 2.78 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.41 1.33 7.81 65 I 8.20 4.45 1.80 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 1.22 0.84 0.84 0.00 0.00 66 K 8.54 4.05 0.00 1.62 1.63 0.00 1.66 0.00 0.00 1.63 0.00 0.00 2.87 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.34 1.33 7.81 67 N 7.63 4.81 0.00 2.47 2.62 0.00 0.00 6.87 7.83 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 68 L 8.65 4.43 0.00 1.88 1.64 1.09 0.32 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 69 T 9.06 4.84 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 1.26 0.00 0.00 70 R 8.99 3.91 0.00 1.88 2.06 0.00 3.33 0.00 0.00 3.28 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.60 0.00 71 D 8.17 4.64 0.00 2.66 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 72 D 8.04 5.21 0.00 2.91 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 73 S 8.53 4.62 0.00 3.82 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 74 G 7.82 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 75 T 7.99 5.03 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 1.33 0.00 0.00 76 Y 9.36 4.71 0.00 2.99 3.10 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 77 N 9.20 5.38 0.00 2.67 2.59 0.00 0.00 6.51 8.26 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 78 V 8.41 4.31 1.41 0.00 0.00 0.00 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 -0.00 0.00 0.00 79 T 8.11 4.57 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 1.01 0.00 0.00 80 V 8.45 4.03 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 1.12 0.00 0.00 0.10 0.00 0.00 81 Y 9.12 5.36 0.00 2.97 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 82 S 9.11 5.38 0.00 3.96 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 83 T 8.48 4.18 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 1.36 0.00 0.00 84 N 8.14 4.48 0.00 2.75 2.92 0.00 0.00 7.00 7.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 G 8.24 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.19 4.67 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 1.25 0.00 0.00 87 R 8.47 4.18 0.00 1.76 1.73 0.00 3.22 0.00 0.00 3.36 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.70 0.00 88 I 8.31 4.26 1.87 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 1.32 0.86 0.95 0.00 0.00 89 L 7.27 4.56 0.00 1.63 1.34 1.05 0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 90 N 8.81 5.21 0.00 2.57 2.58 0.00 0.00 6.97 6.57 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 91 K 8.61 4.76 0.00 1.48 1.55 0.00 1.79 0.00 0.00 1.61 0.00 0.00 2.81 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.21 1.37 7.81 92 A 8.20 5.03 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 93 L 9.10 5.04 0.00 1.68 1.56 0.96 0.85 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 94 D 9.14 5.05 0.00 2.66 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 95 L 9.25 4.58 0.00 1.76 1.65 0.46 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 96 R 8.43 4.54 0.00 1.18 1.48 0.00 3.08 0.00 0.00 2.85 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.62 0.00 97 I 8.09 4.85 1.91 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 1.27 0.89 0.98 0.00 0.00 98 L 9.24 4.26 0.00 1.89 1.67 1.01 0.88 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 99 E 8.79 4.25 0.00 1.96 1.87 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 2.27 2.38 0.00