NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 T 4.3906 8.0176 110.9451 60.8411 70.5817 174.7877 6 P 4.0512 0.0000 0.0000 65.2352 31.4218 177.4958 7 F 4.1545 9.1195 121.8544 60.9841 39.7164 177.6005 8 D 4.3306 8.5463 118.3098 57.3753 40.4858 178.9000 9 A 3.9517 7.5207 120.6416 55.0762 18.2320 179.3837 10 L 3.7849 7.4093 117.3955 57.9773 42.2011 178.5756 11 W 4.0206 8.1653 127.5218 60.6354 30.8561 177.6972 12 Q 4.1190 8.3142 117.9524 58.7067 27.9552 178.8085 13 R 3.9571 7.8215 115.2788 57.4978 29.8015 178.1760 *15 L 3.8676 7.8402 120.7302 54.6198 43.5400 178.9332 16 A 3.9851 7.7335 120.2849 55.2325 18.2483 178.7026 17 R 3.6446 6.7110 112.2443 57.1558 29.8850 177.7703 18 G 3.9372 8.1347 107.0408 44.6223 0.0000 173.9410 19 W 4.6919 7.4580 119.3028 56.9609 30.0385 175.4640 20 T 4.5191 8.4057 113.7137 59.6285 70.2872 172.5139 21 P 5.0087 0.0000 0.0000 62.6917 32.1979 176.0788 22 V 4.6046 8.5976 122.3644 60.0917 34.6252 174.7166 23 S 4.8440 8.4585 116.5056 56.0962 65.8312 174.4608 24 E 3.9738 8.8363 121.8755 59.6985 29.0456 179.2783 25 S 4.2750 8.1522 112.2980 60.4448 63.3135 175.3281 26 R 4.5713 7.7785 119.6685 55.2921 30.8290 177.0611 27 L 4.0179 7.6191 121.8068 58.5941 42.0561 178.4312 28 D 4.3975 8.2534 117.9697 57.6838 40.5402 178.5838 29 D 4.3660 8.0589 117.5521 57.0723 41.3100 178.1560 30 W 4.2215 8.4485 128.8926 60.4118 30.6476 177.8253 31 L 3.5779 8.7698 119.6654 58.0571 40.8836 179.7651 32 T 3.8566 7.9089 108.2938 63.7369 68.5574 175.4060 33 Q 4.5023 7.1857 118.1905 54.9633 30.3569 176.6554 34 A 4.4779 7.3874 123.1135 50.2630 20.2024 174.4730 35 P 4.3250 0.0000 0.0000 64.5907 32.9822 176.5041 36 D 5.2027 8.0217 120.6715 52.5888 42.7631 175.5840 37 G 4.7782 9.2070 110.5393 45.3345 0.0000 169.9660 38 V 5.1432 9.3257 118.6729 61.2397 35.4199 173.8178 39 V 4.4860 8.6937 127.2293 61.0485 34.1021 174.0575 40 L 4.6347 8.6910 129.0630 53.6891 43.2766 175.5161 41 L 4.6891 8.6217 124.9089 53.0729 43.4897 176.0717 42 S 5.0492 8.5303 118.7697 56.8579 66.5940 172.7182 43 S 4.9561 8.4312 116.2283 56.2074 67.0242 173.5132 44 D 4.3696 8.5015 120.1627 53.8589 41.1059 175.1489 45 P 4.6027 0.0000 0.0000 65.4897 31.8321 178.9435 46 K 4.0305 8.0407 117.5671 59.5658 32.2012 178.2720 47 R 3.9429 8.1867 117.1312 59.0011 30.1658 176.2216 48 T 4.4486 7.8696 114.0545 59.3560 68.1840 171.8900 49 P 4.6046 0.0000 0.0000 63.2856 31.2813 177.3600 50 E 4.2294 8.3050 120.7010 58.7974 29.7849 178.8048 51 V 3.7929 7.0973 117.6787 65.3350 31.6633 177.0988 52 S 4.4173 8.0078 114.5395 61.1983 63.3760 175.6113 53 D 4.5454 8.3480 120.5823 56.6527 40.4256 177.8625 54 N 4.2829 8.2310 116.5348 56.6359 39.0859 174.1232 55 P 4.5816 0.0000 0.0000 65.7790 31.2753 178.7076 56 V 3.3632 7.3066 113.0355 64.4262 32.0860 177.5567 *58 I 3.9810 7.9158 120.7380 61.0232 38.9372 177.9659 59 G 3.9264 8.3295 105.9474 48.0708 0.0000 175.3166 60 E 4.3442 8.1233 121.3557 59.1892 29.7745 178.9236 61 L 4.1037 8.3224 119.8292 58.5183 41.7991 178.9899 62 L 3.6363 7.8757 118.8517 57.8095 41.4264 178.6652 63 H 4.7708 7.8138 110.6063 56.9008 28.5110 176.1931 64 E 4.3825 7.9574 120.3748 57.0288 31.2998 176.5077 65 F 5.0612 8.6733 117.6897 55.1963 39.6194 173.7956 66 P 4.5623 0.0000 0.0000 65.3316 31.8505 178.0782 67 D 4.3502 8.3610 116.8843 56.2078 40.8481 175.6988 68 Y 4.3868 7.5957 115.6878 56.2814 41.0459 175.9665 69 T 4.3341 7.7219 117.1908 60.1477 66.2783 174.9722 70 W 4.9355 7.6533 121.4904 58.0091 30.4264 177.3017 71 Q 4.7051 9.1918 124.0617 54.4755 32.4473 173.5517 72 V 4.6653 8.6444 125.3485 61.1311 33.8726 174.0272 73 A 4.8840 8.9422 129.0533 49.7663 22.3844 174.8240 74 I 4.8096 8.3468 112.9993 58.9320 40.9756 174.1027 75 A 5.4056 8.4703 126.3125 50.1248 21.6883 176.7771 76 D 4.8088 8.5880 121.2488 52.3081 42.1803 177.2874 77 L 3.7400 7.7295 118.2651 58.1457 41.5270 179.6757 78 E 3.9405 7.9275 117.5544 59.6748 29.5684 179.3860 79 Q 4.0614 9.1746 118.4836 58.9230 28.6125 178.8892 80 S 4.2012 8.5940 116.8020 61.7190 62.7564 176.6382 81 E 4.0760 8.1809 121.2179 59.1592 29.2728 179.1648 82 A 3.9921 7.8889 120.5576 55.3538 18.3272 179.6885 83 I 3.9131 8.1581 117.3869 64.4080 37.5010 178.6219 84 G 3.9301 8.4890 106.7109 48.1886 0.0000 175.2653 85 D 4.1593 8.2743 122.1718 57.0575 40.6056 179.1072 86 R 3.9830 7.7729 117.4614 58.1288 30.1171 177.4317 87 F 4.5738 7.9547 115.0007 56.3143 39.6541 176.1431 88 G 3.7850 7.5542 104.9432 45.7609 0.0000 174.0776 89 A 4.3243 7.6100 122.5276 51.5056 17.6531 177.6005 90 F 4.6119 8.6053 120.9488 57.8268 39.6564 176.7817 91 R 4.4746 7.8582 121.3011 54.7100 30.5172 173.6613 92 F 5.2680 8.3046 121.9671 55.1092 40.8773 173.9626 93 P 4.6552 0.0000 0.0000 62.8400 32.5154 175.2653 94 A 5.1996 8.4470 123.6774 50.6346 23.4313 175.3668 95 T 4.7984 8.4748 115.2304 61.8481 72.6473 173.4644 96 L 4.6758 8.8135 127.8641 54.2376 43.3849 176.1622 97 V 4.7862 8.6308 123.7280 61.0837 34.1935 174.2043 98 F 5.4209 9.6094 126.0364 56.0551 42.6435 174.1370 99 T 4.7772 9.1475 119.9162 62.0908 72.1413 174.5561 100 G 4.0362 9.4940 115.0718 46.7349 0.0000 174.2097 101 G 3.9599 8.7608 104.2717 45.5342 0.0000 173.5365 102 N 5.0701 8.2813 117.9686 50.9860 40.8010 173.4246 103 Y 4.0932 8.7754 124.2018 57.6189 39.0783 175.2666 104 R 3.9626 9.0495 127.2098 55.4784 31.3703 177.1294 105 G 3.4048 5.3800 103.4978 44.7715 0.0000 170.5029 106 V 4.8296 7.4887 118.3868 59.8891 34.5022 175.1465 107 L 4.5215 8.9372 125.4797 53.6721 42.5276 175.3972 108 N 5.3558 8.7886 121.0549 52.0433 40.6648 175.2337 109 G 3.8017 8.5468 107.4111 44.6304 0.0000 172.0764 110 I 4.5065 7.7469 117.3114 59.4080 40.2739 174.3929 111 H 5.0201 8.5296 123.1612 52.9359 32.9384 171.3605 112 P 4.4733 0.0000 0.0000 62.4208 32.0831 177.3762 113 W 3.8785 9.1487 129.7959 60.9310 30.5000 178.2825 114 A 4.2600 8.2848 119.9584 54.9851 17.6970 178.5609 115 E 4.2123 7.9471 117.5057 57.1763 30.1005 178.1224 116 L 3.9355 7.3501 120.4981 58.0354 42.1865 177.9518 117 I 3.5226 6.9561 116.7736 64.2282 37.9324 176.9981 118 N 4.5927 7.7021 117.0195 55.6114 37.0112 177.6528 119 L 3.9883 7.3930 118.9109 54.9146 40.9383 178.8100 *121 R 4.3892 8.1644 121.6171 56.4589 31.5716 176.9473 122 G 3.8475 7.8973 103.8912 46.5340 0.0000 173.7008 123 L 4.3380 7.2097 116.3323 56.1720 43.1125 177.8470 124 V 4.1161 7.4820 108.2237 60.9557 31.7248 175.6273 125 E 4.2707 7.8493 127.0223 56.7205 29.7181 174.5493 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 5 T 8.02 4.39 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 1.24 0.00 0.00 6 P 0.00 4.05 0.00 2.45 2.39 0.00 3.77 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.14 0.00 7 F 9.12 4.15 0.00 3.10 3.14 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 0.00 0.00 0.00 0.00 8 D 8.55 4.33 0.00 2.80 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 9 A 7.52 3.95 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.41 3.78 0.00 1.61 1.63 0.91 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 11 W 8.17 4.02 0.00 2.85 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 12 Q 8.31 4.12 0.00 2.24 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.77 0.00 0.00 0.00 0.00 0.00 2.63 2.57 0.00 13 R 7.82 3.96 0.00 1.85 1.79 0.00 3.11 0.00 0.00 3.16 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.65 0.00 *15 L 7.84 3.87 0.00 1.65 1.58 0.94 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 16 A 7.73 3.99 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 17 R 6.71 3.64 0.00 0.67 0.90 0.00 2.21 0.00 0.00 2.93 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.71 0.00 18 G 8.13 3.94 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 0.00 19 W 7.46 4.69 0.00 3.11 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 20 T 8.41 4.52 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 1.32 0.00 0.00 21 P 0.00 5.01 0.00 2.11 2.48 0.00 3.64 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 2.13 1.98 0.00 22 V 8.60 4.60 1.57 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 0.44 0.00 0.00 0.79 0.00 0.00 23 S 8.46 4.84 0.00 4.00 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 24 E 8.84 3.97 0.00 2.05 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 2.44 2.36 0.00 25 S 8.15 4.27 0.00 4.08 4.01 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 26 R 7.78 4.57 0.00 1.90 2.01 0.00 3.18 0.00 0.00 3.14 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.62 0.00 27 L 7.62 4.02 0.00 1.89 1.87 0.92 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 28 D 8.25 4.40 0.00 2.77 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 29 D 8.06 4.37 0.00 2.89 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 30 W 8.45 4.22 0.00 3.39 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 31 L 8.77 3.58 0.00 2.01 1.63 0.38 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 32 T 7.91 3.86 4.20 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 1.26 0.00 0.00 33 Q 7.19 4.50 0.00 2.11 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 7.19 0.00 0.00 0.00 0.00 0.00 2.19 2.37 0.00 34 A 7.39 4.48 0.28 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 0.00 0.00 35 P 0.00 4.33 0.00 2.06 2.27 0.00 3.48 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.93 0.00 36 D 8.02 5.20 0.00 2.49 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 0.00 0.00 0.00 37 G 9.21 4.78 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 38 V 9.33 5.14 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 0.69 0.00 0.00 0.55 0.00 0.00 39 V 8.69 4.49 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 0.81 0.00 0.00 0.82 0.00 0.00 40 L 8.69 4.63 0.00 1.50 1.48 0.58 -0.20 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 41 L 8.62 4.69 0.00 0.80 0.49 0.81 0.46 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 42 S 8.53 5.05 0.00 4.02 4.01 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 43 S 8.43 4.96 0.00 3.85 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 44 D 8.50 4.37 0.00 2.64 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 P 0.00 4.60 0.00 2.33 2.20 0.00 3.82 0.00 0.00 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.37 0.00 46 K 8.04 4.03 0.00 1.73 1.89 0.00 1.75 0.00 0.00 1.93 0.00 0.00 2.95 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.51 1.42 7.81 47 R 8.19 3.94 0.00 1.76 2.13 0.00 3.23 0.00 0.00 3.16 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.71 0.00 48 T 7.87 4.45 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 1.27 0.00 0.00 49 P 0.00 4.60 0.00 2.24 2.17 0.00 3.44 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.97 0.00 50 E 8.31 4.23 0.00 2.08 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 0.00 2.33 2.41 0.00 51 V 7.10 3.79 2.20 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 0.94 0.00 0.00 1.06 0.00 0.00 52 S 8.01 4.42 0.00 3.94 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 53 D 8.35 4.55 0.00 2.90 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 54 N 8.23 4.28 0.00 2.72 2.92 0.00 0.00 6.95 7.69 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 55 P 0.00 4.58 0.00 2.28 2.34 0.00 3.74 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 2.19 2.28 0.00 56 V 7.31 3.36 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 1.00 0.00 0.00 1.00 0.00 0.00 *58 I 7.92 3.98 1.94 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.54 0.58 0.00 0.00 59 G 8.33 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 60 E 8.12 4.34 0.00 2.32 2.26 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 2.70 2.59 0.00 61 L 8.32 4.10 0.00 1.62 1.75 0.69 0.34 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 62 L 7.88 3.64 0.00 1.91 1.58 0.69 -0.43 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 63 H 7.81 4.77 0.00 3.42 3.56 0.00 5.55 0.00 0.00 0.00 0.00 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 E 7.96 4.38 0.00 2.52 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 2.49 3.04 0.00 65 F 8.67 5.06 0.00 3.75 3.56 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.56 0.00 2.11 2.22 0.00 3.80 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.42 0.00 67 D 8.36 4.35 0.00 2.04 2.44 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 68 Y 7.60 4.39 0.00 1.50 1.75 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 69 T 7.72 4.33 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 1.15 0.00 0.00 70 W 7.65 4.94 0.00 3.31 3.08 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 0.00 0.00 0.00 0.00 71 Q 9.19 4.71 0.00 2.17 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.79 0.00 0.00 0.00 0.00 0.00 2.42 2.36 0.00 72 V 8.64 4.67 1.14 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 -0.49 0.00 0.00 0.47 0.00 0.00 73 A 8.94 4.88 -0.32 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 74 I 8.35 4.81 1.74 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.53 0.92 0.00 0.00 75 A 8.47 5.41 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 76 D 8.59 4.81 0.00 2.54 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 0.00 0.00 0.00 77 L 7.73 3.74 0.00 1.40 1.54 0.54 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.35 0.00 0.00 0.00 0.00 0.00 0.00 78 E 7.93 3.94 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 2.34 2.40 0.00 79 Q 9.17 4.06 0.00 2.13 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.79 0.00 0.00 0.00 0.00 0.00 2.47 2.55 0.00 80 S 8.59 4.20 0.00 4.06 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 81 E 8.18 4.08 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 2.36 2.61 0.00 82 A 7.89 3.99 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 83 I 8.16 3.91 1.98 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 1.55 0.73 0.97 0.00 0.00 84 G 8.49 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 85 D 8.27 4.16 0.00 2.93 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 86 R 7.77 3.98 0.00 1.76 2.14 0.00 3.22 0.00 0.00 3.20 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 1.35 0.00 87 F 7.95 4.57 0.00 2.92 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 88 G 7.55 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 89 A 7.61 4.32 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 90 F 8.61 4.61 0.00 3.03 2.96 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 91 R 7.86 4.47 0.00 1.76 1.89 0.00 3.33 0.00 0.00 3.27 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.78 0.00 92 F 8.30 5.27 0.00 2.92 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 93 P 0.00 4.66 0.00 2.08 1.97 0.00 3.59 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 2.16 2.16 0.00 94 A 8.45 5.20 1.18 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 0.00 0.00 95 T 8.47 4.80 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 1.01 0.00 0.00 96 L 8.81 4.68 0.00 1.72 1.51 0.13 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 97 V 8.63 4.79 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 0.90 0.00 0.00 0.71 0.00 0.00 98 F 9.61 5.42 0.00 3.11 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 99 T 9.15 4.78 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 1.38 0.00 0.00 100 G 9.49 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 0.00 101 G 8.76 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 0.00 102 N 8.28 5.07 0.00 2.95 2.75 0.00 0.00 6.65 7.17 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 0.00 103 Y 8.78 4.09 0.00 2.81 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 0.00 104 R 9.05 3.96 0.00 1.50 1.90 0.00 3.55 0.00 0.00 3.12 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.59 0.00 105 G 5.38 3.40 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 0.00 106 V 7.49 4.83 2.19 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 0.85 0.00 0.00 0.98 0.00 0.00 107 L 8.94 4.52 0.00 1.47 1.53 0.68 0.09 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 0.00 108 N 8.79 5.36 0.00 2.86 2.81 0.00 0.00 6.46 7.00 0.00 0.00 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 G 8.55 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 0.00 110 I 7.75 4.51 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 1.41 1.00 0.88 0.00 0.00 111 H 8.53 5.02 0.00 3.03 3.14 0.00 5.96 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 P 0.00 4.47 0.00 2.23 2.05 0.00 3.67 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 2.15 2.12 0.00 113 W 9.15 3.88 0.00 3.50 3.33 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 0.00 114 A 8.28 4.26 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 0.00 115 E 7.95 4.21 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 2.33 2.34 0.00 116 L 7.35 3.94 0.00 1.62 1.01 0.63 0.53 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 0.00 117 I 6.96 3.52 1.16 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.95 0.93 0.00 0.00 118 N 7.70 4.59 0.00 3.09 3.06 0.00 0.00 7.03 6.55 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 0.00 119 L 7.39 3.99 0.00 1.79 1.56 0.58 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 *121 R 8.16 4.39 0.00 2.20 2.16 0.00 3.26 0.00 0.00 3.51 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.83 0.00 122 G 7.90 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 0.00 123 L 7.21 4.34 0.00 1.51 1.51 0.72 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 124 V 7.48 4.12 1.94 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 0.37 0.00 0.00 0.83 0.00 0.00 125 E 7.85 4.27 0.00 1.97 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 0.00 2.30 2.34 0.00 * Residues marked with a * may have inaccurate shift predictions.