NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 12 G 3.9951 8.2133 108.0281 46.1913 0.0000 175.9631 13 E 4.9575 9.4266 118.4778 54.6805 32.1432 174.1418 14 L 4.5878 9.6197 123.0989 54.1318 46.5643 173.6118 15 I 5.0704 8.3787 126.4599 60.0779 38.9351 174.4619 16 H 5.0414 9.4220 121.9294 54.5192 32.7940 171.6127 17 M 5.0570 8.5488 117.6894 53.6100 34.1622 176.0214 18 V 4.3848 8.7505 122.6108 61.4569 34.9466 173.9718 19 T 4.9364 8.6403 124.3384 61.9012 70.4167 173.6838 20 L 4.8104 8.7370 126.6311 52.9277 44.4589 174.8841 21 D 5.5024 8.9188 123.1167 52.0593 43.4972 175.3770 22 K 4.4800 9.1662 126.6108 56.6738 33.1786 176.3687 23 T 3.9343 8.3755 117.3834 66.1890 68.5482 174.6596 24 G 3.9128 8.9713 113.5063 45.7478 0.0000 172.8134 25 K 4.7004 8.0307 118.0128 53.8858 35.4632 176.6030 26 K 4.0984 8.4837 119.5296 59.0791 33.1140 176.4353 27 S 4.3169 7.1769 111.6852 57.4861 65.3531 174.8794 28 F 4.1966 8.4297 118.7026 58.8219 38.9791 177.4433 29 G 4.5429 8.5819 108.5671 46.4754 0.0000 172.1864 30 I 5.0825 7.6719 111.2871 58.8315 40.4933 174.2395 31 C 5.0725 9.0698 122.2370 57.9538 31.0671 173.1155 32 I 5.1654 8.3825 115.6293 59.5037 40.6385 174.7196 33 V 4.6110 8.5525 114.4168 60.0455 36.5034 173.8639 34 R 4.8372 8.8119 123.4603 55.9982 31.2787 175.6000 35 G 4.2611 9.6060 112.4187 45.5020 0.0000 170.6761 36 E 5.5309 8.3819 118.7375 56.0009 33.0877 175.6122 37 V 4.4982 8.4230 117.1776 60.2747 36.7212 173.9211 38 K 4.6337 8.9301 122.7362 55.8360 32.0194 176.7724 39 D 4.7212 8.5306 123.1869 52.7919 39.6440 175.6318 40 S 4.5687 7.2545 113.6155 57.1963 65.0189 174.8882 41 P 4.3152 0.0000 0.0000 65.2703 30.9192 176.9332 42 N 5.0275 7.7793 112.8175 52.5723 39.2348 173.6626 43 T 4.8568 7.6728 107.0044 60.3512 72.6785 172.5950 44 K 4.9773 8.5144 120.1670 55.0479 36.7205 175.6136 45 T 4.6724 8.8988 115.8566 60.7798 70.8580 172.4690 46 T 5.1671 8.7502 124.9948 62.3755 70.6660 173.8889 47 G 4.0781 9.4488 113.6207 46.2629 0.0000 170.1141 48 I 4.9326 8.0928 120.2802 60.1684 38.8586 175.3018 49 F 5.2724 9.4121 125.6962 55.4566 43.1337 174.5640 50 I 4.4597 8.8081 123.1169 61.2652 37.2869 176.5421 51 K 4.3377 9.2324 129.5068 57.6619 33.2427 176.3945 52 G 4.2726 7.6426 104.4434 45.3909 0.0000 172.2137 53 I 5.1121 8.1663 121.3585 59.0595 40.8097 175.4132 54 V 3.9672 8.7703 127.9188 61.4596 32.4841 173.7996 55 P 4.1950 0.0000 0.0000 64.2673 31.5093 175.6832 56 D 4.5201 9.0795 119.1340 55.1659 39.9522 174.0223 57 S 4.6630 7.6589 113.2385 56.6810 65.8816 173.0806 58 P 4.2827 0.0000 0.0000 65.7882 30.7563 178.7572 59 A 4.0394 8.0763 118.6008 55.3619 18.0455 178.9931 60 H 4.3856 8.1656 116.1663 59.5686 29.9590 177.4198 61 L 3.9867 8.2692 119.7497 57.5974 41.8033 178.5463 62 C 4.1604 8.3512 119.4378 61.8311 31.3088 175.8772 63 G 4.0344 7.7314 104.4637 45.8436 0.0000 173.9072 64 R 4.5202 7.4784 115.9851 55.6106 30.5505 175.7285 65 L 4.9487 7.7407 118.0763 52.7197 44.4843 175.8806 66 K 4.6910 9.3007 122.3278 53.9611 35.1578 176.0304 67 V 3.9146 8.2242 122.0916 64.5300 31.9066 176.1344 68 G 4.1661 9.1108 115.7041 45.3397 0.0000 173.7977 69 D 4.7286 8.2117 119.8511 54.4742 42.2535 175.3497 70 R 4.4126 8.5835 121.8824 54.7976 32.4189 174.9681 71 I 4.5337 8.1686 127.0353 60.1483 37.8634 175.5646 72 L 4.3664 9.0378 128.8071 56.9070 43.1408 177.0625 73 S 5.0176 7.6092 110.8485 56.9993 66.7886 173.3809 74 L 4.9151 8.6491 122.6899 54.2527 43.9456 176.3000 75 N 4.1558 10.1079 125.4828 54.2813 36.6429 175.6987 76 G 3.9068 8.4136 106.1718 45.0952 0.0000 173.9662 77 K 4.1856 7.8744 122.3553 54.8806 32.8696 175.2540 78 D 4.7500 8.6637 126.4561 54.7062 41.7162 175.8220 79 V 4.6422 8.3420 117.8121 60.2001 32.5165 177.5109 80 R 3.8789 8.3412 122.5050 59.0294 29.9485 177.9469 81 N 4.9222 7.9138 111.9143 52.9770 39.3245 174.7719 82 S 4.4643 7.8243 115.3087 58.0467 63.8558 174.2626 83 T 4.4605 8.0721 113.1787 61.1754 70.9424 175.7314 84 E 3.9524 8.5605 121.1410 59.7543 29.5148 179.3147 85 Q 3.9675 8.1598 118.8107 59.1782 29.0413 178.0675 86 A 3.9797 7.9415 121.5492 55.1734 18.3212 179.8458 87 V 3.5167 7.5983 116.8478 66.0796 31.5305 178.3068 88 I 3.6959 7.8657 119.5807 64.4621 37.0553 178.0184 89 D 4.3752 8.4163 119.9956 57.4427 40.4623 178.8641 90 L 3.9829 7.6223 117.9682 57.9658 41.9270 179.4019 91 I 3.7961 7.9678 119.7780 64.3787 36.8591 178.6614 92 K 4.2360 8.2862 118.0598 58.8555 31.9504 178.7178 93 E 4.1478 7.8873 117.3510 57.1780 29.8764 177.1307 94 A 4.1824 7.1755 122.2340 51.9098 19.0289 177.0463 95 D 4.5908 8.6079 121.7206 56.7156 41.8693 177.3051 96 F 5.2216 7.6689 109.4853 56.3730 41.3926 173.0452 97 K 5.4159 7.3894 117.7270 55.3463 35.7549 175.5594 98 I 4.5882 8.4324 114.4024 59.2315 41.2907 173.7028 99 E 4.7830 9.3005 125.2349 54.9061 31.3173 174.7164 100 L 4.9742 9.0297 125.4559 52.8223 44.6609 175.2558 101 E 4.6768 8.7996 125.2094 55.1485 30.9238 174.5609 102 I 4.8846 8.7128 128.7157 59.4526 40.5339 174.5431 103 Q 5.0346 8.7701 127.4635 54.7784 31.1079 174.1815 104 T 5.0464 9.2505 123.2590 61.0049 71.7352 172.4429 *105 F 5.2649 8.5528 123.4293 55.6368 40.1641 173.8353 106 D 4.3378 9.0168 122.1406 53.1887 38.9545 175.0835 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 12 G 8.21 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 13 E 9.43 4.96 0.00 1.95 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 2.29 2.39 0.00 14 L 9.62 4.59 0.00 1.83 1.43 0.92 1.38 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 15 I 8.38 5.07 1.87 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 1.38 0.73 0.95 0.00 0.00 16 H 9.42 5.04 0.00 3.16 3.33 0.00 5.42 0.00 0.00 0.00 0.00 6.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 M 8.55 5.06 0.00 1.86 1.99 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.42 0.00 18 V 8.75 4.38 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 0.97 0.00 0.00 0.89 0.00 0.00 19 T 8.64 4.94 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 1.19 0.00 0.00 20 L 8.74 4.81 0.00 1.52 1.82 0.96 1.04 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 21 D 8.92 5.50 0.00 2.78 2.65 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 22 K 9.17 4.48 0.00 1.58 1.29 0.00 0.86 0.00 0.00 0.61 0.00 0.00 2.70 0.00 0.00 2.65 0.00 0.00 0.00 0.00 1.02 1.16 7.81 23 T 8.38 3.93 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 1.16 0.00 0.00 24 G 8.97 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 25 K 8.03 4.70 0.00 1.76 1.61 0.00 1.70 0.00 0.00 1.74 0.00 0.00 2.93 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.34 1.46 7.81 26 K 8.48 4.10 0.00 1.83 1.91 0.00 1.60 0.00 0.00 1.75 0.00 0.00 2.95 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.36 1.39 7.81 27 S 7.18 4.32 0.00 3.94 3.82 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 28 F 8.43 4.20 0.00 3.23 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 29 G 8.58 4.54 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 0.00 30 I 7.67 5.08 1.90 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 1.41 0.82 0.95 0.00 0.00 31 C 9.07 5.07 0.00 2.88 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 32 I 8.38 5.17 1.96 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 1.36 0.69 0.92 0.00 0.00 33 V 8.55 4.61 2.11 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 0.64 0.00 0.00 0.98 0.00 0.00 34 R 8.81 4.84 0.00 1.96 1.86 0.00 3.25 0.00 0.00 3.25 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.81 0.00 35 G 9.61 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 36 E 8.38 5.53 0.00 1.99 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 2.14 2.26 0.00 37 V 8.42 4.50 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 0.63 0.00 0.00 0.93 0.00 0.00 38 K 8.93 4.63 0.00 1.75 2.01 0.00 1.75 0.00 0.00 0.61 0.00 0.00 2.84 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.44 1.38 7.81 39 D 8.53 4.72 0.00 2.79 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 40 S 7.25 4.57 0.00 3.96 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 41 P 0.00 4.32 0.00 2.20 2.23 0.00 3.71 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.00 0.00 42 N 7.78 5.03 0.00 2.74 2.81 0.00 0.00 6.79 7.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 T 7.67 4.86 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 1.21 0.00 0.00 44 K 8.51 4.98 0.00 1.61 1.71 0.00 1.69 0.00 0.00 1.75 0.00 0.00 2.66 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.33 1.41 7.81 45 T 8.90 4.67 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 46 T 8.75 5.17 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 1.35 0.00 0.00 47 G 9.45 4.08 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 0.00 0.00 0.00 48 I 8.09 4.93 1.76 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 1.38 0.87 0.89 0.00 0.00 49 F 9.41 5.27 0.00 2.92 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 50 I 8.81 4.46 1.92 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 1.12 0.65 0.95 0.00 0.00 51 K 9.23 4.34 0.00 1.73 1.85 0.00 1.73 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.40 1.44 7.81 52 G 7.64 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 0.00 0.00 0.00 0.00 53 I 8.17 5.11 1.88 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 1.27 0.75 0.95 0.00 0.00 54 V 8.77 3.97 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 0.96 0.00 0.00 0.97 0.00 0.00 55 P 0.00 4.20 0.00 2.20 1.97 0.00 3.90 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.94 0.00 56 D 9.08 4.52 0.00 2.87 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 57 S 7.66 4.66 0.00 4.27 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 58 P 0.00 4.28 0.00 2.44 2.40 0.00 3.79 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 2.19 2.17 0.00 59 A 8.08 4.04 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 60 H 8.17 4.39 0.00 3.39 3.56 0.00 5.88 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 61 L 8.27 3.99 0.00 1.62 1.72 0.98 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 62 C 8.35 4.16 0.00 3.04 3.26 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 63 G 7.73 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 64 R 7.48 4.52 0.00 1.92 2.02 0.00 3.28 0.00 0.00 3.23 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.74 0.00 65 L 7.74 4.95 0.00 1.62 1.57 0.93 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 66 K 9.30 4.69 0.00 2.09 1.69 0.00 1.59 0.00 0.00 1.60 0.00 0.00 2.98 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.36 1.39 7.81 67 V 8.22 3.91 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 0.81 0.00 0.00 0.95 0.00 0.00 68 G 9.11 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 0.00 0.00 0.00 0.00 69 D 8.21 4.73 0.00 2.73 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 70 R 8.58 4.41 0.00 1.19 1.50 0.00 2.66 0.00 0.00 2.95 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.95 0.00 71 I 8.17 4.53 1.76 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.63 0.82 0.00 0.00 72 L 9.04 4.37 0.00 1.49 1.63 0.93 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 73 S 7.61 5.02 0.00 3.84 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 L 8.65 4.92 0.00 1.49 1.44 0.83 0.59 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 75 N 10.11 4.16 0.00 2.76 2.80 0.00 0.00 7.22 7.50 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 76 G 8.41 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 77 K 7.87 4.19 0.00 1.75 1.78 0.00 1.62 0.00 0.00 1.55 0.00 0.00 2.87 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.37 1.34 7.81 78 D 8.66 4.75 0.00 2.63 2.54 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 79 V 8.34 4.64 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 1.16 0.00 0.00 0.93 0.00 0.00 80 R 8.34 3.88 0.00 1.89 1.97 0.00 3.10 0.00 0.00 3.13 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.90 0.00 81 N 7.91 4.92 0.00 2.65 2.78 0.00 0.00 6.93 7.57 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 82 S 7.82 4.46 0.00 3.97 3.76 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 83 T 8.07 4.46 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 1.21 0.00 0.00 84 E 8.56 3.95 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 2.45 0.00 85 Q 8.16 3.97 0.00 2.16 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.90 0.00 0.00 0.00 0.00 0.00 2.43 2.66 0.00 86 A 7.94 3.98 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 0.00 0.00 0.00 0.00 0.00 0.00 87 V 7.60 3.52 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 1.06 0.00 0.00 0.93 0.00 0.00 88 I 7.87 3.70 2.03 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 1.76 0.84 0.94 0.00 0.00 89 D 8.42 4.38 0.00 2.83 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 90 L 7.62 3.98 0.00 1.80 1.70 0.89 0.93 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 91 I 7.97 3.80 2.04 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 1.36 0.72 0.94 0.00 0.00 92 K 8.29 4.24 0.00 1.74 1.91 0.00 1.72 0.00 0.00 1.73 0.00 0.00 3.05 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.54 1.71 7.81 93 E 7.89 4.15 0.00 2.19 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 2.35 2.53 0.00 94 A 7.18 4.18 1.38 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 95 D 8.61 4.59 0.00 2.76 2.91 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 96 F 7.67 5.22 0.00 3.19 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 97 K 7.39 5.42 0.00 1.64 1.21 0.00 1.36 0.00 0.00 1.43 0.00 0.00 2.76 0.00 0.00 2.79 0.00 0.00 0.00 0.00 0.30 1.06 7.81 98 I 8.43 4.59 1.50 0.00 0.00 0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.06 0.33 0.33 0.00 0.00 99 E 9.30 4.78 0.00 1.83 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 2.18 2.17 0.00 100 L 9.03 4.97 0.00 1.51 1.45 0.81 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 101 E 8.80 4.68 0.00 2.00 1.85 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 2.19 2.23 0.00 102 I 8.71 4.88 1.56 0.00 0.00 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 1.13 0.68 0.88 0.00 0.00 103 Q 8.77 5.03 0.00 2.06 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.57 0.00 0.00 0.00 0.00 0.00 2.25 2.26 0.00 104 T 9.25 5.05 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 1.28 0.00 0.00 *105 F 8.55 5.26 0.00 2.09 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 0.00 0.00 0.00 106 D 9.02 4.34 0.00 2.56 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 * Residues marked with a * may have inaccurate shift predictions.