NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3017 8.3044 120.3353 54.7058 33.3964 174.8813 2 E 3.6879 8.6730 126.1683 55.6075 30.0806 174.8202 3 K 4.2794 9.1774 128.8348 56.5743 34.0076 175.3827 4 K 4.8445 8.3904 124.1982 55.2452 37.3234 174.7691 5 T 5.2995 9.3680 119.0226 61.9716 70.9751 173.8517 6 I 5.0378 8.6332 118.5566 59.0666 41.4524 174.2689 7 V 4.5535 8.5024 124.1562 61.7943 33.3439 174.3824 8 L 5.2082 8.9543 129.4320 53.4932 45.3823 175.3611 9 G 4.1327 8.5612 111.3008 45.7610 0.0000 171.6318 10 V 5.5339 8.3396 119.4599 60.1724 33.9901 174.4332 11 I 4.8502 8.5758 127.9285 60.4444 40.0492 175.8088 12 G 4.2051 9.1333 115.1392 47.1444 0.0000 175.1000 13 S 4.6071 9.3058 120.5994 58.2325 63.2628 173.1103 14 D 3.9712 7.0183 121.3063 53.4304 41.2339 176.3121 15 C 4.5556 8.3378 119.7585 57.9474 30.3281 173.4669 16 H 4.2091 8.7093 118.9309 56.2826 28.9071 175.0168 17 A 4.6447 8.4572 125.0438 52.1711 21.5001 178.4068 18 V 3.7305 7.9557 115.4805 66.0500 31.6269 178.2243 19 G 3.6607 8.0850 105.0750 47.6012 0.0000 175.0018 20 N 4.2935 8.0871 118.7667 56.5405 39.1102 176.8578 21 K 3.9420 7.8717 119.3678 59.7215 32.0917 179.4640 22 I 3.8142 7.8575 119.9577 64.2263 36.9145 178.5182 23 L 4.1392 8.4636 120.4033 57.7752 41.4220 178.7484 24 D 4.3523 8.3496 118.0945 57.7392 41.1416 177.4395 25 H 4.0121 8.3761 118.2057 59.7079 29.7615 176.9261 26 A 4.0187 8.5090 122.4139 55.2361 18.3778 179.6744 27 F 4.0202 8.7735 116.7155 60.8214 38.9339 178.1405 28 T 4.3027 8.4911 117.2962 66.3434 68.0844 176.5332 29 N 4.4120 8.5188 117.1512 55.5358 38.5915 176.3330 30 A 4.3851 7.4811 119.8304 51.9294 19.1413 177.7835 31 G 3.9180 7.8743 105.6134 44.7134 0.0000 174.3081 32 F 4.5509 8.1961 118.5772 57.1337 40.7807 174.7359 33 N 4.5318 9.7128 122.1120 52.9957 39.3683 173.9684 34 V 4.4030 8.3203 127.2904 61.8082 32.7613 175.8143 35 V 3.9783 9.2535 130.4836 61.8384 31.7823 173.8318 36 N 5.2246 8.5068 127.0973 52.1807 39.0520 174.2310 37 I 3.8672 8.7987 120.6065 60.4652 38.7573 177.7457 38 G 3.7385 8.1694 112.9822 45.0655 0.0000 173.6609 39 V 4.0273 8.0765 112.3116 61.0727 32.6245 175.1461 40 L 4.1241 7.7445 117.3257 55.1774 39.4986 175.5808 41 S 4.6189 8.0304 114.7932 56.0586 64.2647 173.2321 42 P 4.8617 0.0000 0.0000 62.1945 31.9942 177.1080 43 Q 4.1141 9.0594 118.2809 59.7940 28.5718 179.7668 44 E 4.1302 8.3894 118.3952 59.5563 29.4875 179.0612 45 N 4.4505 8.3856 116.5936 55.9047 38.6170 177.5354 46 F 4.0661 8.4392 119.5000 60.5189 39.0293 177.7995 47 I 3.7733 7.8598 118.9874 64.1941 36.9738 178.0380 48 K 3.8676 8.1669 120.2757 59.6625 31.9895 178.6407 49 A 3.9433 7.9425 120.1592 54.9406 18.2013 179.3870 50 A 3.9564 8.1314 119.3147 55.3904 18.3348 180.0325 51 I 3.6493 7.8316 118.1305 64.7168 37.0458 178.5106 52 E 4.0360 8.2320 118.3344 58.7693 29.3488 178.5642 53 T 4.4011 7.7151 106.3847 60.0595 69.8840 174.1811 54 K 3.7684 7.8387 119.5368 57.1415 30.2896 175.5230 55 A 4.1468 7.9885 120.1591 52.9079 19.1252 178.2460 56 D 4.7225 9.1386 120.9481 56.5511 42.3262 176.2684 57 A 4.8745 7.6309 117.7635 50.8084 22.9648 175.1437 58 I 4.7252 8.5994 120.5770 59.5687 40.1091 174.8627 59 L 4.8790 8.9271 128.5915 53.1488 43.5619 176.0320 60 V 4.3123 8.8534 126.2889 61.7107 32.8348 174.5710 61 S 5.0847 9.1961 124.2775 57.2260 64.3603 172.9764 62 S 4.5159 9.1981 121.2265 57.2034 64.5543 173.9176 63 L 4.3734 9.3487 128.4129 55.9833 42.7097 177.4829 64 Y 4.4007 8.4257 114.2269 57.4525 38.5554 175.6339 65 G 4.0472 7.9614 109.3426 46.0565 0.0000 175.0084 66 Q 4.3438 7.3344 116.8400 56.0028 28.7181 177.5618 67 G 4.0645 8.1244 109.8296 46.7486 0.0000 175.4657 68 E 3.9111 7.6843 121.1474 59.1289 29.3497 178.6051 69 I 3.9256 7.6305 119.4204 64.4845 37.3141 177.9527 70 D 4.5440 8.1170 117.9783 57.0434 40.7466 177.9752 71 C 4.5010 8.5252 117.0976 60.0697 28.3630 173.6770 72 K 3.9281 7.0724 121.6503 57.7779 32.2669 176.6747 73 G 4.0356 9.0307 114.4212 45.4840 0.0000 175.1247 74 L 4.0342 7.7057 121.4846 57.6395 41.9134 178.6442 75 R 3.7196 7.7891 118.0636 59.5647 29.8011 177.9888 76 Q 3.9082 7.9285 118.5732 59.2663 29.1866 178.3004 77 K 3.9983 8.0697 119.3785 59.3825 31.9991 179.2937 78 C 4.1692 8.2246 117.5992 62.7474 27.9117 175.7113 79 D 4.3433 8.3462 120.7968 57.5649 40.2327 178.8167 80 E 3.9681 8.3344 117.7547 58.9782 29.5156 178.5327 81 A 4.3051 7.8100 118.8324 52.5436 18.6926 178.0691 82 G 3.9074 8.0365 105.4299 45.3325 0.0000 173.9878 83 L 4.7152 8.1547 118.8073 53.8764 42.4981 176.6150 84 E 4.4448 7.5282 117.4746 57.2367 29.9340 178.5469 85 G 4.0285 8.8350 109.8968 45.4703 0.0000 173.6871 86 I 3.7174 7.4138 119.9588 60.8792 38.6028 175.3872 87 L 4.4936 8.0696 126.9009 54.9196 42.8732 175.9809 88 L 5.1315 9.7589 123.6955 53.3878 44.7987 175.1280 89 Y 5.8238 9.2579 122.3495 56.3413 41.5763 175.4645 90 V 5.2854 8.3129 121.0208 59.5640 35.0981 174.4940 91 G 4.3738 8.7226 109.7173 44.1080 0.0000 172.9712 92 G 4.6323 8.6638 106.1838 44.7867 0.0000 176.2539 93 N 5.3588 9.5225 117.6986 51.0113 38.3159 174.3286 94 I 3.9452 7.8082 114.6720 61.7966 38.8362 176.9314 95 V 4.7667 7.4820 112.8479 58.9570 34.6114 175.2906 96 V 3.6216 8.2132 121.2399 64.3868 30.8367 176.6579 97 G 3.9598 8.6553 113.0535 44.4018 0.0000 171.7596 98 K 4.0923 8.2986 119.8845 56.5552 32.3804 175.8876 99 Q 4.6002 8.3714 123.8894 53.8121 33.1018 174.2124 100 H 4.2505 8.7658 119.4102 56.2354 30.0648 175.7328 101 W 4.2713 8.9922 135.0000 60.2515 30.4466 175.6572 102 P 4.0042 0.0000 0.0000 65.7337 30.7007 178.2374 103 D 4.2724 7.8707 117.3156 57.3111 40.7704 179.0167 104 V 3.4656 7.2766 118.2468 65.7443 31.4641 177.4801 105 E 3.4625 7.2306 119.2582 58.9503 29.2873 178.7783 106 K 3.8599 7.6021 119.7734 59.1910 31.9046 178.6076 107 R 3.7624 7.7809 119.0202 59.7138 30.0007 178.4815 108 F 4.1260 8.2250 117.0605 60.0600 38.9146 178.1730 109 K 4.7197 8.4037 120.0316 59.1572 31.6133 179.1063 110 D 4.3607 8.2498 118.4866 57.2833 40.7776 178.1167 111 M 4.2913 7.4937 117.4354 56.0996 32.1042 177.1050 112 G 3.9891 8.0152 107.2962 45.1766 0.0000 173.3209 113 Y 4.2528 8.1736 118.5064 57.4990 38.7898 176.2873 114 D 4.5286 9.0624 125.0771 57.0611 41.7269 177.2660 115 R 4.4650 8.0509 115.9844 54.1191 34.4535 174.3856 116 V 4.7479 7.9945 122.2859 61.2510 34.0534 173.9824 117 Y 4.8836 9.1615 125.4194 56.0746 40.8652 175.8403 118 A 3.0231 7.9737 125.9532 49.8640 19.4954 175.3490 119 P 4.7599 0.0000 0.0000 63.6889 31.6743 176.9691 120 G 3.7879 8.6874 108.8547 46.5583 0.0000 173.4413 121 T 4.0303 7.7113 116.3228 62.0884 69.1750 173.1231 122 P 4.4276 0.0000 0.0000 61.5560 32.3632 175.5059 123 P 4.2733 0.0000 0.0000 66.0992 31.1800 178.8967 124 E 3.8195 8.0524 116.6660 59.0564 29.3388 179.4605 125 V 3.6677 7.6303 118.1855 66.0936 31.6296 178.4791 126 G 3.7013 7.8702 104.8066 47.7078 0.0000 175.5779 127 I 3.5545 7.7755 122.1217 63.9969 36.9879 178.3495 128 A 4.0532 8.1707 121.7244 55.3115 18.2040 179.3976 129 D 4.4231 8.2963 117.4848 57.5813 40.9089 178.8932 130 L 4.5836 8.4788 122.3599 57.5564 42.0631 179.1747 131 K 4.1734 8.5025 118.7276 59.2592 32.0316 179.2722 132 K 4.2483 8.3020 121.3592 59.2715 31.9686 178.7330 133 D 4.5416 8.5845 118.3421 56.5799 40.7941 177.6788 134 L 4.4715 7.7124 116.9477 53.3474 42.9300 175.9307 135 N 4.3642 8.1012 115.3276 54.4529 35.9414 174.4599 136 I 4.7109 8.5830 104.7934 60.5065 39.3990 175.5655 137 E 4.1475 8.4785 126.3215 57.7196 29.2819 176.9411 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 4.30 0.00 1.82 1.93 0.00 0.00 0.00 0.00 0.00 -0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.31 0.00 2 E 8.67 3.69 0.00 2.00 1.81 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 2.27 2.33 0.00 3 K 9.18 4.28 0.00 1.75 1.65 0.00 1.76 0.00 0.00 1.71 0.00 0.00 2.93 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.41 1.56 7.81 4 K 8.39 4.84 0.00 1.91 1.94 0.00 1.85 0.00 0.00 1.84 0.00 0.00 2.82 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.39 1.49 7.81 5 T 9.37 5.30 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 1.28 0.00 0.00 6 I 8.63 5.04 1.62 0.00 0.00 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.76 0.66 0.00 0.00 7 V 8.50 4.55 2.15 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 1.05 0.00 0.00 0.95 0.00 0.00 8 L 8.95 5.21 0.00 1.55 1.35 0.84 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 9 G 8.56 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 10 V 8.34 5.53 2.06 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 1.02 0.00 0.00 0.96 0.00 0.00 11 I 8.58 4.85 1.92 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.54 0.98 0.00 0.00 12 G 9.13 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 0.00 0.00 0.00 0.00 13 S 9.31 4.61 0.00 4.16 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 14 D 7.02 3.97 0.00 1.58 2.10 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 15 C 8.34 4.56 0.00 3.05 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 16 H 8.71 4.21 0.00 3.10 3.30 0.00 5.79 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 17 A 8.46 4.64 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 18 V 7.96 3.73 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 1.04 0.00 0.00 0.94 0.00 0.00 19 G 8.08 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 20 N 8.09 4.29 0.00 2.76 3.03 0.00 0.00 7.23 7.04 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 21 K 7.87 3.94 0.00 2.11 1.85 0.00 1.69 0.00 0.00 1.64 0.00 0.00 3.03 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.46 1.53 7.81 22 I 7.86 3.81 1.89 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.99 0.93 0.00 0.00 23 L 8.46 4.14 0.00 1.88 1.75 0.94 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 24 D 8.35 4.35 0.00 2.83 2.87 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 25 H 8.38 4.01 0.00 3.41 3.54 0.00 5.84 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 A 8.51 4.02 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 27 F 8.77 4.02 0.00 3.24 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 28 T 8.49 4.30 4.44 0.00 0.00 0.00 0.00 0.00 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 29 N 8.52 4.41 0.00 2.80 2.84 0.00 0.00 7.03 7.08 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 30 A 7.48 4.39 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 31 G 7.87 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 32 F 8.20 4.55 0.00 3.44 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 33 N 9.71 4.53 0.00 2.81 2.91 0.00 0.00 6.93 6.44 0.00 0.00 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 V 8.32 4.40 2.22 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 0.80 0.00 0.00 1.10 0.00 0.00 35 V 9.25 3.98 2.13 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 0.82 0.00 0.00 0.93 0.00 0.00 36 N 8.51 5.22 0.00 2.74 2.70 0.00 0.00 7.21 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 37 I 8.80 3.87 1.62 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 0.86 0.26 0.74 0.00 0.00 38 G 8.17 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 39 V 8.08 4.03 2.21 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 0.76 0.00 0.00 0.89 0.00 0.00 40 L 7.74 4.12 0.00 1.77 1.71 0.90 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 41 S 8.03 4.62 0.00 3.97 3.50 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 42 P 0.00 4.86 0.00 2.49 2.24 0.00 3.91 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.02 0.00 43 Q 9.06 4.11 0.00 2.17 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.89 0.00 0.00 0.00 0.00 0.00 2.47 2.55 0.00 44 E 8.39 4.13 0.00 2.09 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 0.00 2.43 2.51 0.00 45 N 8.39 4.45 0.00 2.86 2.72 0.00 0.00 6.89 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 46 F 8.44 4.07 0.00 3.29 3.09 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 47 I 7.86 3.77 1.93 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 1.55 0.98 0.93 0.00 0.00 48 K 8.17 3.87 0.00 2.09 1.81 0.00 1.63 0.00 0.00 1.65 0.00 0.00 3.09 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.64 1.48 7.81 49 A 7.94 3.94 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 50 A 8.13 3.96 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.83 3.65 1.88 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 1.53 1.44 0.92 0.00 0.00 52 E 8.23 4.04 0.00 1.93 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 2.35 2.53 0.00 53 T 7.72 4.40 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 1.22 0.00 0.00 54 K 7.84 3.77 0.00 1.86 1.91 0.00 1.72 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.39 1.37 7.81 55 A 7.99 4.15 1.24 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 56 D 9.14 4.72 0.00 2.78 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 57 A 7.63 4.87 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 I 8.60 4.73 1.87 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 1.29 0.83 1.02 0.00 0.00 59 L 8.93 4.88 0.00 1.39 1.48 0.45 -0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 60 V 8.85 4.31 2.18 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 0.77 0.00 0.00 0.59 0.00 0.00 61 S 9.20 5.08 0.00 3.93 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 62 S 9.20 4.52 0.00 3.90 3.67 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 0.00 0.00 0.00 0.00 63 L 9.35 4.37 0.00 1.67 1.48 0.92 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 64 Y 8.43 4.40 0.00 3.10 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 65 G 7.96 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 0.00 0.00 0.00 66 Q 7.33 4.34 0.00 1.19 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.85 0.00 0.00 0.00 0.00 0.00 2.15 1.81 0.00 67 G 8.12 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 0.00 0.00 0.00 68 E 7.68 3.91 0.00 2.02 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 2.19 2.06 0.00 69 I 7.63 3.93 1.99 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 1.62 0.92 0.92 0.00 0.00 70 D 8.12 4.54 0.00 2.80 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 C 8.53 4.50 0.00 3.21 3.18 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 0.00 72 K 7.07 3.93 0.00 1.72 1.72 0.00 1.73 0.00 0.00 1.69 0.00 0.00 2.98 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.42 1.33 7.81 73 G 9.03 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 74 L 7.71 4.03 0.00 1.80 1.54 0.88 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 75 R 7.79 3.72 0.00 1.73 1.80 0.00 3.23 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.69 0.00 76 Q 7.93 3.91 0.00 2.12 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.68 0.00 0.00 0.00 0.00 0.00 2.41 2.43 0.00 77 K 8.07 4.00 0.00 1.98 1.85 0.00 1.88 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.46 1.47 7.81 78 C 8.22 4.17 0.00 3.08 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 79 D 8.35 4.34 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 80 E 8.33 3.97 0.00 1.99 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 2.34 2.32 0.00 81 A 7.81 4.31 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 82 G 8.04 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 0.00 0.00 0.00 83 L 8.15 4.72 0.00 1.69 1.65 0.93 0.95 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 84 E 7.53 4.44 0.00 2.07 1.86 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 2.39 2.52 0.00 85 G 8.84 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 86 I 7.41 3.72 1.94 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 1.27 0.97 0.95 0.00 0.00 87 L 8.07 4.49 0.00 1.77 1.42 0.94 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 88 L 9.76 5.13 0.00 1.45 1.48 0.56 0.59 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 89 Y 9.26 5.82 0.00 2.91 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 90 V 8.31 5.29 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 0.26 0.00 0.00 0.63 0.00 0.00 91 G 8.72 4.37 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 0.00 92 G 8.66 4.63 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 0.00 93 N 9.52 5.36 0.00 3.03 2.72 0.00 0.00 7.13 8.18 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 94 I 7.81 3.95 1.31 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 1.41 0.49 0.73 0.00 0.00 95 V 7.48 4.77 2.17 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 0.96 0.00 0.00 1.08 0.00 0.00 96 V 8.21 3.62 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 0.77 0.00 0.00 0.92 0.00 0.00 97 G 8.66 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 98 K 8.30 4.09 0.00 1.75 1.77 0.00 1.74 0.00 0.00 1.73 0.00 0.00 2.81 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.47 1.50 7.81 99 Q 8.37 4.60 0.00 2.12 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.80 0.00 0.00 0.00 0.00 0.00 2.30 2.59 0.00 100 H 8.77 4.25 0.00 3.19 3.38 0.00 5.70 0.00 0.00 0.00 0.00 6.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 W 8.99 4.27 0.00 3.41 3.07 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 0.00 102 P 0.00 4.00 0.00 2.10 2.05 0.00 3.05 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.18 0.00 103 D 7.87 4.27 0.00 2.91 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 V 7.28 3.47 1.28 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 0.74 0.00 0.00 0.92 0.00 0.00 105 E 7.23 3.46 0.00 1.25 1.55 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 2.17 2.17 0.00 106 K 7.60 3.86 0.00 1.74 1.82 0.00 1.66 0.00 0.00 1.54 0.00 0.00 2.87 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.38 1.55 7.81 107 R 7.78 3.76 0.00 1.95 2.09 0.00 2.98 0.00 0.00 3.07 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 1.43 0.00 108 F 8.23 4.13 0.00 3.03 2.97 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 0.00 109 K 8.40 4.72 0.00 1.89 1.87 0.00 1.63 0.00 0.00 1.73 0.00 0.00 3.04 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.62 1.34 7.81 110 D 8.25 4.36 0.00 2.79 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 0.00 111 M 7.49 4.29 0.00 2.16 2.29 0.00 0.00 0.00 0.00 0.00 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.47 0.00 112 G 8.02 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 0.00 0.00 0.00 113 Y 8.17 4.25 0.00 3.39 3.02 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 0.00 114 D 9.06 4.53 0.00 2.97 2.87 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 0.00 115 R 8.05 4.47 0.00 0.70 0.87 0.00 2.40 0.00 0.00 3.14 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.38 0.00 116 V 7.99 4.75 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 0.54 0.00 0.00 0.98 0.00 0.00 117 Y 9.16 4.88 0.00 2.91 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 0.00 118 A 7.97 3.02 -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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 P 0.00 4.76 0.00 1.94 1.94 0.00 3.42 0.00 0.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 2.00 0.00 120 G 8.69 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 0.00 121 T 7.71 4.03 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 1.05 0.00 0.00 122 P 0.00 4.43 0.00 2.13 1.92 0.00 3.57 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.06 0.00 123 P 0.00 4.27 0.00 2.09 2.14 0.00 3.57 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.21 0.00 124 E 8.05 3.82 0.00 2.00 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 2.36 2.35 0.00 125 V 7.63 3.67 2.17 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 1.11 0.00 0.00 0.92 0.00 0.00 126 G 7.87 3.70 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 0.00 0.00 0.00 127 I 7.78 3.55 1.74 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 0.50 -0.36 0.91 0.00 0.00 128 A 8.17 4.05 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 0.00 0.00 0.00 0.00 0.00 0.00 129 D 8.30 4.42 0.00 2.95 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 0.00 130 L 8.48 4.58 0.00 2.13 2.01 0.74 -0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 131 K 8.50 4.17 0.00 2.12 1.92 0.00 1.77 0.00 0.00 1.60 0.00 0.00 2.83 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.55 1.83 7.81 132 K 8.30 4.25 0.00 1.93 2.10 0.00 1.72 0.00 0.00 1.80 0.00 0.00 2.98 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.50 1.39 7.81 133 D 8.58 4.54 0.00 2.91 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 0.00 134 L 7.71 4.47 0.00 1.82 1.77 1.12 1.15 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 0.00 135 N 8.10 4.36 0.00 2.93 2.91 0.00 0.00 6.65 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 0.00 136 I 8.58 4.71 1.85 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 1.49 0.66 0.97 0.00 0.00 137 E 8.48 4.15 0.00 2.07 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 2.44 2.43 0.00