NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.3994 8.2649 122.4574 51.8200 21.2772 177.3674 3 E 4.1945 8.1300 114.7603 56.3003 31.0059 174.4706 4 T 5.2479 8.7498 118.7284 61.7607 72.3426 172.7800 5 K 4.3954 9.2949 128.2447 54.7383 34.1458 174.7904 6 I 5.0826 8.3202 127.7908 59.5035 40.1888 175.1033 7 V 4.4285 8.8759 126.4871 61.0543 34.7319 174.1581 8 V 5.3784 7.9544 126.9782 60.4803 34.0635 174.5063 9 G 4.3436 8.4955 113.4775 45.8325 0.0000 171.8979 10 P 4.8538 0.0000 0.0000 64.1374 31.9830 177.2095 11 Q 4.1546 7.9140 118.4358 55.1429 29.2481 174.1839 12 P 4.3480 0.0000 0.0000 62.3685 32.0447 175.4973 13 F 4.9879 7.6429 114.4208 54.7403 40.9656 175.0537 14 S 4.5117 8.2864 113.9846 55.7162 64.9440 174.2072 15 V 3.3634 8.6208 129.0812 66.2539 31.0936 178.0783 16 G 3.7477 8.0453 103.3318 47.5861 0.0000 174.7985 17 E 4.2450 7.6892 120.0277 58.6840 30.0828 178.1768 18 E 4.2764 8.0946 118.2607 58.3217 29.6860 178.1348 19 Y 3.9928 8.4361 120.3410 60.2315 38.7238 176.0000 20 P 4.2203 0.0000 0.0000 65.5470 31.6134 177.9074 21 W 4.1646 8.1951 126.0975 60.4800 30.5558 177.4379 22 L 3.6496 7.8194 118.1848 57.6797 41.5513 177.8267 23 A 4.1775 7.3054 117.8447 51.8123 18.7667 177.6702 24 E 3.8649 7.3083 121.0427 59.3785 30.1370 178.1123 25 R 3.9548 7.5098 118.3606 56.0882 30.5156 177.4370 26 D 4.3893 8.6346 123.0938 57.0597 41.0362 177.3945 27 E 4.1143 8.0224 115.1915 57.9274 30.3177 177.2384 28 D 4.6055 7.6960 122.9301 53.2324 39.1937 176.9196 29 G 3.8486 7.8797 106.2972 47.3218 0.0000 171.2839 30 A 4.7542 8.2984 123.2087 49.9599 21.9156 175.1215 31 V 4.6975 8.4478 122.3696 61.1021 34.1029 174.7309 32 V 4.4664 8.7808 128.3666 61.1409 34.0515 174.3226 33 T 5.0938 8.5354 116.4832 59.8420 72.1922 172.8065 34 F 4.8161 9.0539 124.7221 56.7840 42.8223 173.3968 35 T 5.0043 7.7997 121.9406 61.5567 71.2866 173.4214 36 G 4.2582 9.0892 113.4297 44.3690 0.0000 172.3593 37 K 5.2005 8.4624 122.8364 53.9767 35.5328 176.1826 38 V 3.6394 8.6297 122.8858 63.5220 32.6786 175.6171 39 R 4.7618 8.5137 127.2097 54.5757 29.4942 174.4851 *47 V 3.8755 7.8767 120.8155 62.4698 32.5968 174.2901 48 N 5.1349 8.4907 123.3769 51.0424 41.7090 174.2635 49 A 3.0139 7.7210 123.4597 51.4810 19.9168 176.2093 50 L 4.9359 8.3313 120.7863 53.2542 44.8220 175.7142 51 T 4.9520 9.0627 119.4452 61.7880 71.5736 173.1532 52 L 5.1173 8.7965 126.9716 53.3591 42.8305 175.7647 53 E 4.6909 9.6513 126.7969 56.6264 31.0868 175.0114 54 H 5.3079 8.8957 118.8826 55.1107 32.1710 172.7462 55 Y 4.6436 8.6530 121.3173 55.6029 37.9459 174.1065 56 P 4.2368 0.0000 0.0000 65.1695 31.7227 178.2235 57 G 3.7242 8.1174 104.4662 46.7778 0.0000 173.9072 58 M 4.2082 7.4161 118.6729 55.9479 33.8006 177.5220 59 T 3.5855 7.4642 109.6822 64.7848 68.8578 176.2355 60 E 3.9927 8.0010 121.1464 58.7689 29.4725 179.0894 61 K 3.9061 7.8951 119.0771 59.3378 32.3561 178.6071 62 A 3.9413 8.3732 121.4949 55.1040 18.2926 179.6440 63 L 3.9333 8.0405 117.2747 57.9565 41.7537 179.6210 64 A 4.0482 8.4238 121.1184 55.2346 18.2773 179.5801 65 E 4.1441 8.4418 117.3593 59.3906 29.4028 179.6941 66 I 3.8672 7.8307 120.1090 64.3260 37.1495 178.5588 67 V 3.6532 7.9598 119.0889 66.2128 31.1638 177.6154 68 D 4.3851 8.4296 117.7089 57.4819 40.9717 178.3319 69 E 4.0598 8.3811 119.4274 59.2054 29.6848 178.5130 70 A 3.9490 8.5579 121.2591 55.4987 18.2243 179.8810 71 R 4.0689 8.1481 115.3466 59.0147 30.1640 178.3916 72 N 4.5035 7.8019 115.0293 54.9487 38.7930 176.8298 73 R 3.7569 7.4018 117.9926 56.0690 30.8977 176.3820 74 W 5.0028 7.4699 116.4120 54.0044 33.0669 173.6748 75 P 4.5459 0.0000 0.0000 62.2152 29.9250 175.1909 76 L 4.8739 8.2028 123.9196 52.2710 44.0650 177.9178 77 G 4.3100 8.3500 109.9186 45.3618 0.0000 176.5541 78 R 4.7374 8.9068 124.3839 55.5528 31.1364 174.8357 79 V 4.7965 8.4213 120.5062 61.6345 35.6628 174.0437 80 T 5.2874 9.0530 122.7616 61.8512 72.6135 173.0176 81 V 4.8386 9.1890 125.5769 61.1932 34.8445 174.0887 82 I 5.0883 9.0849 128.5527 59.7531 40.8234 173.9871 83 H 5.1480 9.2035 126.0357 54.4411 32.7888 173.1115 84 R 5.5672 9.2890 125.3611 55.5265 31.3351 175.1257 85 I 4.6024 8.2053 113.2587 59.9259 42.0271 174.5912 86 G 3.8691 8.4393 106.7550 44.2001 0.0000 170.9839 87 E 4.8079 8.4284 119.7369 55.5129 30.5293 176.7389 88 L 5.1916 9.0485 125.8059 52.9585 46.8516 175.2187 89 W 5.0329 9.6297 119.5417 53.8571 33.3051 173.5876 90 P 4.5166 0.0000 0.0000 64.8640 31.1668 176.0774 91 G 4.0995 8.8815 111.1706 45.4198 0.0000 173.8141 92 D 4.5513 8.3975 119.9440 54.1308 42.1551 175.7174 93 E 4.4176 8.4830 122.0358 56.4321 29.7376 176.1499 94 I 4.3942 9.1439 125.3819 61.8909 40.3981 175.6545 95 V 5.0651 7.7406 119.8265 59.9652 35.1823 174.0620 96 F 5.2472 9.2033 125.0803 56.4601 42.8746 173.3939 97 V 4.5019 8.6302 125.6016 60.8302 34.6964 174.2009 98 G 4.2855 8.9395 114.8371 44.4344 0.0000 171.9588 99 V 4.9542 8.9822 118.3803 59.7231 36.1958 174.7433 100 T 5.0802 7.9822 113.0393 60.4757 72.7045 172.2816 101 S 4.7598 8.3857 115.3857 57.7539 66.0906 176.0225 102 A 4.0340 8.8110 125.0807 54.2779 18.5924 177.8752 103 H 4.9667 8.4073 114.6100 53.5888 34.2220 174.4716 104 R 3.8599 8.1212 123.2822 59.3859 29.1780 179.1800 105 S 4.3107 8.2885 114.4858 61.5614 62.9448 176.6501 106 S 4.0090 8.1081 118.1251 60.9834 62.7186 176.3384 107 A 3.7403 7.6805 123.0858 55.1029 18.1382 179.7500 108 F 4.1508 8.3624 116.6974 60.7823 38.9104 177.8493 109 E 4.3429 8.5652 119.4720 58.8512 29.1458 179.3409 110 A 2.7036 7.1043 120.9721 54.2648 18.2958 179.8955 111 G 3.4111 7.7464 104.2857 47.9924 0.0000 175.8860 112 Q 3.9556 7.9983 120.7881 58.5172 28.7072 178.7800 113 F 2.9494 7.7686 121.7636 60.9116 39.1872 177.1086 114 I 3.3462 7.7061 119.6065 64.5739 36.8305 178.3913 115 M 3.9078 7.8161 119.3224 58.4112 31.8955 178.5823 116 D 4.3916 8.2685 119.3952 57.7375 40.9800 178.5353 117 Y 4.1559 8.0320 117.4741 60.6190 37.8240 177.8967 118 L 3.9448 8.1352 121.9239 58.1147 42.0118 179.0120 119 K 4.2206 8.1799 116.9013 58.1315 32.1349 178.1318 120 T 4.5483 7.2877 106.5735 61.3926 70.0940 174.6575 121 R 4.3846 8.1655 118.0698 55.7436 32.5667 175.4806 122 A 4.1945 7.7471 121.5604 50.8989 19.3229 176.3731 123 P 3.9175 0.0000 0.0000 61.5237 30.4126 174.3591 124 F 5.1160 7.0455 124.4288 55.9601 43.1430 174.0390 125 W 5.1626 9.4930 121.7428 55.0493 33.3059 174.4088 126 K 5.1104 9.1465 124.4758 55.6619 33.3873 175.8526 127 R 4.9263 9.3760 121.2094 54.2201 32.5820 173.8690 128 E 4.7290 8.9926 122.9858 54.6879 31.8105 174.9243 129 A 4.7862 8.7516 130.3089 50.2382 17.9689 176.9427 130 T 4.4033 8.4051 112.4050 59.7917 70.5537 175.1924 131 P 4.2057 0.0000 0.0000 65.2049 31.2947 177.1408 132 E 4.2771 8.5832 116.0485 55.3012 29.8650 174.3208 133 G 4.0378 7.3450 103.8087 43.4522 0.0000 172.7686 134 D 4.8512 8.3088 119.4711 54.1310 42.2570 175.9829 135 R 4.6183 8.6926 122.2713 54.1689 33.7121 174.1336 136 W 4.8736 8.7595 126.2262 56.4058 29.8611 176.3304 137 V 3.9012 8.6870 125.3887 62.9509 31.7211 175.5647 138 E 4.3186 8.8060 126.5489 55.5762 30.3577 176.6333 139 A 4.2349 8.4836 125.6302 52.2134 19.4590 176.9077 140 R 4.5889 8.2661 119.7879 54.4630 31.9176 177.5476 141 E 4.0263 8.8308 123.1929 59.2472 29.5672 179.1106 142 S 4.1354 8.0779 114.0552 61.4279 62.9665 176.1161 143 D 4.3877 8.0731 122.6127 57.1322 40.5474 178.6582 144 Q 4.0039 7.9488 118.1719 59.1230 28.6713 178.6886 145 Q 4.0098 8.3949 118.9975 58.9049 28.5210 178.6569 146 A 3.9971 8.0555 120.6407 55.1624 18.7797 179.2737 147 A 4.5654 8.4774 119.5678 55.3499 18.2912 180.0033 148 K 4.1957 8.1168 116.1847 59.0637 32.1421 179.3955 149 R 3.9858 7.5551 115.8790 58.4157 29.3383 176.6272 150 W 4.6230 7.9437 123.3732 57.0440 29.1668 175.8296 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 A 8.26 4.40 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 3 E 8.13 4.19 0.00 2.31 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 0.00 2.49 2.51 0.00 4 T 8.75 5.25 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 1.27 0.00 0.00 5 K 9.29 4.40 0.00 1.11 1.50 0.00 0.91 0.00 0.00 1.40 0.00 0.00 2.71 0.00 0.00 2.66 0.00 0.00 0.00 0.00 1.20 1.12 7.81 6 I 8.32 5.08 1.87 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 1.24 1.08 0.93 0.00 0.00 7 V 8.88 4.43 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 1.03 0.00 0.00 0.88 0.00 0.00 8 V 7.95 5.38 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 0.93 0.00 0.00 1.11 0.00 0.00 9 G 8.50 4.34 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 0.00 10 P 0.00 4.85 0.00 2.23 2.24 0.00 3.43 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.99 0.00 11 Q 7.91 4.15 0.00 2.23 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.00 7.07 0.00 0.00 0.00 0.00 0.00 2.47 2.47 0.00 12 P 0.00 4.35 0.00 1.95 1.84 0.00 3.61 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.03 0.00 13 F 7.64 4.99 0.00 2.83 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 14 S 8.29 4.51 0.00 3.83 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 15 V 8.62 3.36 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 1.14 0.00 0.00 1.00 0.00 0.00 16 G 8.05 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 17 E 7.69 4.24 0.00 2.12 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 2.33 2.34 0.00 18 E 8.09 4.28 0.00 1.60 1.88 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 2.29 1.88 0.00 19 Y 8.44 3.99 0.00 3.26 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 20 P 0.00 4.22 0.00 2.14 2.20 0.00 3.78 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.29 0.00 21 W 8.20 4.16 0.00 3.42 3.27 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 22 L 7.82 3.65 0.00 1.98 1.77 1.03 0.97 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 23 A 7.31 4.18 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 E 7.31 3.86 0.00 1.93 1.72 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 2.24 2.21 0.00 25 R 7.51 3.95 0.00 1.92 1.91 0.00 3.07 0.00 0.00 3.15 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.39 0.00 26 D 8.63 4.39 0.00 2.63 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 27 E 8.02 4.11 0.00 2.04 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 0.00 2.21 2.23 0.00 28 D 7.70 4.61 0.00 2.86 2.52 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 29 G 7.88 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 0.00 0.00 0.00 30 A 8.30 4.75 1.12 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 31 V 8.45 4.70 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 0.80 0.00 0.00 0.86 0.00 0.00 32 V 8.78 4.47 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 0.87 0.00 0.00 0.02 0.00 0.00 33 T 8.54 5.09 4.33 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 0.00 0.00 0.00 1.52 0.00 0.00 34 F 9.05 4.82 0.00 3.09 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 35 T 7.80 5.00 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 1.47 0.00 0.00 36 G 9.09 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 0.00 0.00 0.00 0.00 37 K 8.46 5.20 0.00 1.62 1.75 0.00 1.72 0.00 0.00 1.59 0.00 0.00 2.86 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.31 1.37 7.81 38 V 8.63 3.64 2.29 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 0.93 0.00 0.00 0.92 0.00 0.00 39 R 8.51 4.76 0.00 1.75 1.91 0.00 3.49 0.00 0.00 3.41 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.59 0.00 *47 V 7.88 3.88 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 1.05 0.00 0.00 1.00 0.00 0.00 48 N 8.49 5.13 0.00 2.61 2.62 0.00 0.00 7.12 7.35 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 49 A 7.72 3.01 -0.01 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 0.00 0.00 50 L 8.33 4.94 0.00 1.57 1.48 0.91 0.51 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 51 T 9.06 4.95 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 1.23 0.00 0.00 52 L 8.80 5.12 0.00 1.67 1.82 1.01 0.57 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 53 E 9.65 4.69 0.00 2.40 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 2.70 2.51 0.00 54 H 8.90 5.31 0.00 2.88 3.29 0.00 5.58 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 Y 8.65 4.64 0.00 3.26 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 56 P 0.00 4.24 0.00 2.11 2.12 0.00 3.86 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 2.01 1.79 0.00 57 G 8.12 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 0.00 0.00 0.00 58 M 7.42 4.21 0.00 1.11 0.65 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 2.21 2.23 0.00 59 T 7.46 3.59 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 0.32 0.00 0.00 60 E 8.00 3.99 0.00 2.01 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 2.43 2.38 0.00 61 K 7.90 3.91 0.00 1.75 1.83 0.00 1.67 0.00 0.00 1.75 0.00 0.00 3.10 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.46 1.47 7.81 62 A 8.37 3.94 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 63 L 8.04 3.93 0.00 1.90 1.76 1.05 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 64 A 8.42 4.05 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 65 E 8.44 4.14 0.00 2.04 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 2.34 2.55 0.00 66 I 7.83 3.87 2.05 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 0.92 0.83 0.00 0.00 67 V 7.96 3.65 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 1.15 0.00 0.00 1.03 0.00 0.00 68 D 8.43 4.39 0.00 2.85 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 69 E 8.38 4.06 0.00 2.19 2.32 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 2.23 2.30 0.00 70 A 8.56 3.95 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 0.00 0.00 0.00 0.00 0.00 71 R 8.15 4.07 0.00 1.98 2.02 0.00 3.19 0.00 0.00 3.24 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.91 0.00 72 N 7.80 4.50 0.00 2.78 2.77 0.00 0.00 6.97 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 73 R 7.40 3.76 0.00 0.69 0.66 0.00 2.21 0.00 0.00 2.25 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 1.32 0.00 74 W 7.47 5.00 0.00 3.32 2.89 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 0.00 0.00 0.00 0.00 75 P 0.00 4.55 0.00 2.20 2.12 0.00 3.94 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.02 0.00 76 L 8.20 4.87 0.00 1.56 1.60 0.95 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 77 G 8.35 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 0.00 0.00 0.00 0.00 78 R 8.91 4.74 0.00 1.52 1.27 0.00 2.21 0.00 0.00 2.25 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.98 0.00 79 V 8.42 4.80 2.14 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 1.14 0.00 0.00 0.97 0.00 0.00 80 T 9.05 5.29 4.53 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 81 V 9.19 4.84 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 0.98 0.00 0.00 0.91 0.00 0.00 82 I 9.08 5.09 1.44 0.00 0.00 0.54 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 0.72 0.97 0.00 0.00 83 H 9.20 5.15 0.00 3.05 2.97 0.00 5.58 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 R 9.29 5.57 0.00 1.74 1.89 0.00 3.08 0.00 0.00 3.31 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.65 0.00 85 I 8.21 4.60 1.94 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.02 0.91 0.00 0.00 86 G 8.44 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 87 E 8.43 4.81 0.00 1.98 1.91 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 2.21 2.11 0.00 88 L 9.05 5.19 0.00 1.49 1.49 0.91 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 89 W 9.63 5.03 0.00 3.16 3.15 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 0.00 90 P 0.00 4.52 0.00 2.13 2.08 0.00 3.94 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.15 0.00 91 G 8.88 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 92 D 8.40 4.55 0.00 2.69 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 93 E 8.48 4.42 0.00 1.27 1.71 0.00 0.00 0.00 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 2.17 0.00 94 I 9.14 4.39 1.84 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 0.97 1.39 0.95 0.00 0.00 95 V 7.74 5.07 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 0.99 0.00 0.00 0.96 0.00 0.00 96 F 9.20 5.25 0.00 2.18 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 0.00 0.00 0.00 0.00 97 V 8.63 4.50 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 0.67 0.00 0.00 0.87 0.00 0.00 98 G 8.94 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 0.00 0.00 0.00 0.00 99 V 8.98 4.95 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 0.65 0.00 0.00 0.87 0.00 0.00 100 T 7.98 5.08 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 1.10 0.00 0.00 101 S 8.39 4.76 0.00 3.85 3.62 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 0.00 102 A 8.81 4.03 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 0.00 103 H 8.41 4.97 0.00 3.15 3.14 0.00 5.60 0.00 0.00 0.00 0.00 6.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 R 8.12 3.86 0.00 2.15 2.13 0.00 3.19 0.00 0.00 3.41 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.83 0.00 105 S 8.29 4.31 0.00 4.21 4.34 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 0.00 106 S 8.11 4.01 0.00 4.07 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 0.00 107 A 7.68 3.74 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 F 8.36 4.15 0.00 3.14 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 0.00 109 E 8.57 4.34 0.00 1.63 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 2.61 2.37 0.00 110 A 7.10 2.70 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 7.75 3.41 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 0.00 112 Q 8.00 3.96 0.00 2.53 2.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.75 0.00 0.00 0.00 0.00 0.00 2.46 2.62 0.00 113 F 7.77 2.95 0.00 1.51 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 0.00 0.00 0.00 0.00 114 I 7.71 3.35 1.77 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 1.55 0.74 0.83 0.00 0.00 115 M 7.82 3.91 0.00 1.70 1.78 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 2.53 0.00 116 D 8.27 4.39 0.00 2.92 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 0.00 117 Y 8.03 4.16 0.00 2.44 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 L 8.14 3.94 0.00 1.80 1.82 0.94 0.35 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 0.00 119 K 8.18 4.22 0.00 1.85 1.86 0.00 1.69 0.00 0.00 1.77 0.00 0.00 3.06 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.47 1.59 7.81 120 T 7.29 4.55 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 1.25 0.00 0.00 121 R 8.17 4.38 0.00 1.76 1.87 0.00 2.80 0.00 0.00 3.03 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.33 0.00 122 A 7.75 4.19 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 0.00 123 P 0.00 3.92 0.00 2.14 2.24 0.00 3.32 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 1.71 1.83 0.00 124 F 7.05 5.12 0.00 2.57 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 0.00 125 W 9.49 5.16 0.00 3.54 3.13 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 0.00 126 K 9.15 5.11 0.00 1.86 1.80 0.00 1.67 0.00 0.00 1.91 0.00 0.00 2.92 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.56 1.53 7.81 127 R 9.38 4.93 0.00 1.15 0.88 0.00 2.21 0.00 0.00 2.25 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 1.23 0.00 128 E 8.99 4.73 0.00 1.95 1.76 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 2.12 2.14 0.00 129 A 8.75 4.79 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 0.00 130 T 8.41 4.40 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 1.20 0.00 0.00 131 P 0.00 4.21 0.00 2.06 2.17 0.00 3.65 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.09 0.00 132 E 8.58 4.28 0.00 1.88 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 2.25 2.28 0.00 133 G 7.35 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 0.00 134 D 8.31 4.85 0.00 2.41 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 0.00 0.00 0.00 0.00 135 R 8.69 4.62 0.00 1.77 1.65 0.00 3.13 0.00 0.00 3.20 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.60 0.00 136 W 8.76 4.87 0.00 3.26 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 0.00 137 V 8.69 3.90 2.32 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 0.81 0.00 0.00 0.98 0.00 0.00 138 E 8.81 4.32 0.00 2.05 1.91 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 2.38 2.36 0.00 139 A 8.48 4.23 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 0.00 140 R 8.27 4.59 0.00 2.09 1.88 0.00 3.17 0.00 0.00 3.29 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.63 0.00 141 E 8.83 4.03 0.00 2.09 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 2.39 2.44 0.00 142 S 8.08 4.14 0.00 4.10 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 0.00 143 D 8.07 4.39 0.00 2.90 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 0.00 144 Q 7.95 4.00 0.00 2.24 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.91 0.00 0.00 0.00 0.00 0.00 2.47 2.41 0.00 145 Q 8.39 4.01 0.00 2.06 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.80 0.00 0.00 0.00 0.00 0.00 2.66 2.53 0.00 146 A 8.06 4.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 A 8.48 4.57 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 K 8.12 4.20 0.00 1.86 1.93 0.00 1.73 0.00 0.00 1.78 0.00 0.00 3.08 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.53 1.68 7.81 149 R 7.56 3.99 0.00 1.68 1.90 0.00 2.68 0.00 0.00 3.01 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.63 0.00 150 W 7.94 4.62 0.00 3.76 3.34 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 * Residues marked with a * may have inaccurate shift predictions.