NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -1 G 4.0983 8.3544 109.7394 46.0180 0.0000 173.5724 0 H 4.6453 7.9941 122.1367 54.6251 30.0213 172.5831 2 S 4.6752 9.1515 113.2369 56.6159 67.4989 173.1378 3 T 3.9659 8.3674 119.3603 63.3034 68.6009 172.8989 4 P 4.6612 0.0000 0.0000 62.5350 32.6293 175.6714 5 L 4.0712 8.9009 124.8877 55.0580 43.1341 175.6267 6 T 4.9014 8.6510 124.1051 62.3830 70.4744 173.8820 7 L 5.2469 8.9440 125.6593 52.9604 45.4146 175.4310 8 I 4.7456 8.6291 123.4183 59.5275 40.1486 174.2323 9 A 5.1076 8.6644 129.2342 50.6775 21.2655 175.2406 10 T 4.6365 9.2771 120.4934 61.9995 70.8934 173.8000 11 I 4.9356 8.5863 127.9859 59.8166 40.4343 174.7080 12 T 5.0263 8.8336 124.6174 61.5261 70.3560 174.2486 13 A 4.6844 9.1930 129.5261 51.5952 19.3731 177.1489 14 A 4.2221 9.0688 123.6257 50.9896 19.9293 175.6256 15 P 4.2085 0.0000 0.0000 64.6632 31.6994 177.1498 16 G 3.9585 9.3704 110.6574 45.9663 0.0000 173.0770 17 H 4.8988 8.2372 115.3421 55.0395 29.8976 175.6632 18 A 4.1122 7.9755 124.7590 55.0876 18.0978 180.4190 19 E 3.9175 8.1389 116.7542 59.4699 29.7207 179.0801 20 A 4.0016 7.9404 120.3684 55.0112 18.4760 179.2896 21 L 3.8832 8.0481 118.8586 58.2277 42.1587 178.7394 22 E 3.3174 8.1905 119.5055 59.0139 29.4047 178.4811 23 R 3.8635 7.9644 118.6889 59.8362 29.8490 178.3514 24 E 4.0728 7.9273 116.8093 59.2572 29.7727 179.0036 25 L 3.8626 8.2801 119.6307 57.6300 41.7055 179.5421 26 R 3.9083 8.3691 118.2991 59.2723 29.7680 178.8260 27 A 4.0531 7.5878 119.6776 55.1341 18.5915 179.2990 28 L 4.1381 7.8711 117.2193 57.1340 41.6067 179.7834 29 V 3.6728 7.7344 118.4735 65.9239 31.7030 177.9012 30 A 3.9259 7.8220 119.8895 54.8565 18.1693 177.7395 31 P 4.1426 0.0000 0.0000 65.5669 31.7664 178.8606 32 S 4.4876 7.6839 115.4302 61.1157 62.4136 176.6461 33 R 3.8296 7.8286 119.6408 59.4081 29.8716 178.6342 34 A 4.1117 7.5742 118.6251 53.3509 18.4709 177.9069 35 E 4.0110 7.7055 117.6088 56.3196 30.2344 177.7005 36 A 3.9912 9.0270 126.6842 55.4499 18.4910 178.6139 37 G 3.9924 8.1908 101.9091 45.9226 0.0000 171.9117 38 C 4.1309 7.9802 121.5724 58.0967 31.5599 173.3873 39 L 4.3581 8.4025 126.7152 56.1371 42.5423 176.8045 40 Q 4.4097 7.3555 117.4254 55.4319 32.4818 172.8549 41 Y 4.7686 8.4112 127.2593 56.9698 40.2302 172.5003 42 D 4.9460 8.6870 125.5845 52.0263 43.9777 175.0799 43 L 4.8228 8.4626 125.0158 54.0133 43.7417 175.0818 44 H 5.1564 9.4915 122.1059 54.1952 33.4674 171.8314 45 Q 4.8759 8.6388 121.5756 53.9835 30.9007 174.6721 46 D 4.5373 8.6664 126.0592 54.8372 41.1925 176.6805 47 R 3.9540 8.8353 125.2459 59.0913 30.2934 176.6952 48 H 4.8838 8.8623 112.0491 54.9538 30.1354 172.9620 49 D 4.5016 7.8076 120.4284 52.8053 42.7148 175.9700 50 S 4.2763 8.7714 122.2724 60.8552 63.4124 174.6012 51 H 4.6800 8.8943 117.7558 55.6400 29.1869 173.8044 52 L 4.9826 7.4435 121.1039 53.0153 43.5377 175.6915 53 F 5.1878 8.8754 121.4726 56.2087 43.5486 174.0094 54 Y 5.7134 8.7719 116.9890 55.9074 42.5346 173.5516 *56 I 4.2907 8.2142 119.4918 62.1797 38.7876 174.8953 57 E 5.0883 9.2280 126.0190 54.5704 34.0965 174.8256 58 Q 4.8995 8.4548 120.4625 53.9604 32.9826 174.3276 59 W 5.0595 8.9058 122.9692 54.6632 32.2755 176.3533 60 R 4.0772 9.1469 125.4023 59.5136 30.3170 175.6358 61 D 4.6250 7.8821 115.4025 51.5214 41.9420 175.6795 62 D 4.3567 8.6942 118.1426 57.5766 40.4691 178.9710 63 A 3.9717 8.0735 120.5385 55.0744 18.4508 179.3849 64 A 3.9246 8.4847 119.3788 55.0399 18.4539 179.6802 65 L 2.6458 7.6698 118.7472 57.7800 41.8997 178.6777 66 E 3.6988 8.0834 118.4005 59.3165 29.7469 178.4901 67 R 3.8908 7.9755 118.7268 59.5614 29.9891 177.7019 68 H 4.0741 7.7631 119.3877 58.6735 29.4685 176.7765 69 Q 2.5697 7.1768 117.2627 57.0539 28.5806 177.1678 70 N 4.6043 7.8574 117.1619 53.3188 39.4800 175.4655 71 T 4.1774 6.9062 111.5341 60.7464 70.1325 175.1457 72 E 3.9409 8.9915 124.2033 60.0496 29.3293 179.1032 73 H 4.3139 8.0798 113.3204 58.4943 28.9963 177.0381 74 F 4.2566 7.7776 123.4060 61.2134 39.1180 177.2453 75 L 3.9968 8.2308 117.5518 57.6471 41.5305 179.2345 76 R 4.0679 8.4024 119.3069 59.1894 29.7723 178.2462 77 F 4.6221 7.6844 117.6695 58.1361 40.2727 175.2072 78 S 4.4779 7.9808 110.7577 56.0722 63.4903 175.2514 79 R 4.2522 7.6829 115.9844 56.2390 31.9358 175.5031 80 G 4.1798 8.8530 110.0930 46.2129 0.0000 173.3889 81 N 4.7030 7.2818 116.2129 52.7129 40.2949 176.6180 82 E 3.6264 8.2868 117.1893 59.4057 29.6932 178.3396 83 A 4.0745 7.8490 120.2236 54.7740 18.8679 178.3550 84 L 4.0707 7.6104 115.0170 55.8689 42.3095 176.2144 85 L 5.0432 8.3621 119.5896 52.9489 42.9808 175.9483 86 Q 4.2256 8.9698 126.4622 58.7833 29.8076 175.7148 87 N 4.8647 7.7503 114.7159 52.4903 42.4850 173.2623 88 V 4.8909 8.4728 124.7383 60.9434 34.6352 174.2675 89 K 4.7120 9.3133 128.7467 54.6158 35.2541 174.5053 90 I 5.0327 8.5063 127.1182 59.6798 40.0205 174.3931 91 D 5.0718 9.2114 126.9505 52.6194 43.6114 175.2359 92 Q 5.2572 8.5544 120.9318 54.0869 31.3763 174.8023 93 L 4.6153 8.6499 122.4538 54.7516 44.4355 173.8620 94 Y 5.0910 8.2649 117.1611 55.8835 40.8396 175.7912 95 R 4.0260 8.9103 124.1547 56.4118 30.9426 175.5683 96 L 4.5566 8.2912 124.1500 52.9100 43.4212 176.4856 97 A 4.1786 8.5646 123.5911 52.6883 18.1634 177.4937 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 G 8.35 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 0 H 7.99 4.65 0.00 3.13 2.63 0.00 5.73 0.00 0.00 0.00 0.00 7.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2 S 9.15 4.68 0.00 3.87 3.71 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 0.00 0.00 0.00 3 T 8.37 3.97 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 1.36 0.00 0.00 4 P 0.00 4.66 0.00 1.97 2.12 0.00 3.73 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 2.16 2.11 0.00 5 L 8.90 4.07 0.00 1.89 1.70 0.51 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 6 T 8.65 4.90 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 1.24 0.00 0.00 7 L 8.94 5.25 0.00 1.73 1.61 0.98 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 8 I 8.63 4.75 1.90 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.85 1.00 0.00 0.00 9 A 8.66 5.11 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 0.00 0.00 0.00 0.00 0.00 0.00 10 T 9.28 4.64 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 1.07 0.00 0.00 11 I 8.59 4.94 1.95 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.79 1.03 0.00 0.00 12 T 8.83 5.03 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 1.24 0.00 0.00 13 A 9.19 4.68 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 14 A 9.07 4.22 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 15 P 0.00 4.21 0.00 2.06 2.01 0.00 3.74 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.09 0.00 16 G 9.37 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 17 H 8.24 4.90 0.00 3.39 3.25 0.00 5.62 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 A 7.98 4.11 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 19 E 8.14 3.92 0.00 2.01 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 2.42 2.34 0.00 20 A 7.94 4.00 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 21 L 8.05 3.88 0.00 1.84 1.60 1.09 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 22 E 8.19 3.32 0.00 1.96 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 2.26 2.24 0.00 23 R 7.96 3.86 0.00 1.92 2.21 0.00 3.15 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.69 0.00 24 E 7.93 4.07 0.00 2.34 2.30 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 2.65 2.53 0.00 25 L 8.28 3.86 0.00 1.54 1.51 0.54 0.23 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 26 R 8.37 3.91 0.00 1.99 1.98 0.00 3.13 0.00 0.00 3.17 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.77 0.00 27 A 7.59 4.05 1.35 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 0.00 0.00 0.00 0.00 0.00 0.00 28 L 7.87 4.14 0.00 1.96 1.81 0.56 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 29 V 7.73 3.67 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 1.24 0.00 0.00 1.12 0.00 0.00 30 A 7.82 3.93 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 31 P 0.00 4.14 0.00 1.38 1.95 0.00 3.66 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 2.08 0.00 32 S 7.68 4.49 0.00 2.72 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 33 R 7.83 3.83 0.00 1.92 1.97 0.00 3.16 0.00 0.00 3.22 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.88 0.00 34 A 7.57 4.11 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 35 E 7.71 4.01 0.00 2.38 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 2.45 2.65 0.00 36 A 9.03 3.99 1.32 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 37 G 8.19 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 38 C 7.98 4.13 0.00 2.67 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 39 L 8.40 4.36 0.00 1.49 1.62 0.90 0.69 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 40 Q 7.36 4.41 0.00 1.98 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.80 0.00 0.00 0.00 0.00 0.00 2.35 2.33 0.00 41 Y 8.41 4.77 0.00 2.75 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 42 D 8.69 4.95 0.00 2.55 2.40 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 43 L 8.46 4.82 0.00 1.62 1.54 1.02 0.94 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 44 H 9.49 5.16 0.00 3.25 3.20 0.00 5.83 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 Q 8.64 4.88 0.00 2.11 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.62 6.86 0.00 0.00 0.00 0.00 0.00 2.00 1.62 0.00 46 D 8.67 4.54 0.00 2.88 2.77 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.84 3.95 0.00 1.71 1.78 0.00 3.13 0.00 0.00 3.06 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 1.50 0.00 48 H 8.86 4.88 0.00 3.08 3.23 0.00 5.89 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 D 7.81 4.50 0.00 2.62 2.46 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 0.00 0.00 0.00 0.00 50 S 8.77 4.28 0.00 4.02 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 51 H 8.89 4.68 0.00 3.32 3.53 0.00 5.61 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 52 L 7.44 4.98 0.00 1.61 1.28 0.93 0.57 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 53 F 8.88 5.19 0.00 2.91 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 54 Y 8.77 5.71 0.00 2.84 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 *56 I 8.21 4.29 1.89 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 1.29 0.64 0.90 0.00 0.00 57 E 9.23 5.09 0.00 1.94 1.67 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 1.74 2.14 0.00 58 Q 8.45 4.90 0.00 1.84 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.74 0.00 0.00 0.00 0.00 0.00 2.21 2.35 0.00 59 W 8.91 5.06 0.00 3.33 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 60 R 9.15 4.08 0.00 1.88 2.09 0.00 3.33 0.00 0.00 3.32 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.64 0.00 61 D 7.88 4.63 0.00 2.94 2.80 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 62 D 8.69 4.36 0.00 2.72 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 63 A 8.07 3.97 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 64 A 8.48 3.92 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 0.00 0.00 0.00 0.00 0.00 0.00 65 L 7.67 2.65 0.00 1.39 1.57 0.10 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 66 E 8.08 3.70 0.00 1.90 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 2.23 2.23 0.00 67 R 7.98 3.89 0.00 1.85 1.95 0.00 3.16 0.00 0.00 3.08 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.59 0.00 68 H 7.76 4.07 0.00 2.54 2.61 0.00 5.88 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 Q 7.18 2.57 0.00 1.89 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.64 0.00 0.00 0.00 0.00 0.00 1.48 1.85 0.00 70 N 7.86 4.60 0.00 2.80 2.82 0.00 0.00 6.99 7.41 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 71 T 6.91 4.18 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 1.30 0.00 0.00 72 E 8.99 3.94 0.00 2.12 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 2.41 2.48 0.00 73 H 8.08 4.31 0.00 3.39 3.44 0.00 5.58 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 F 7.78 4.26 0.00 2.92 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 75 L 8.23 4.00 0.00 1.80 1.74 0.95 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 76 R 8.40 4.07 0.00 2.18 1.98 0.00 3.12 0.00 0.00 3.11 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.66 0.00 77 F 7.68 4.62 0.00 2.99 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 78 S 7.98 4.48 0.00 3.79 3.61 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.68 4.25 0.00 1.87 1.91 0.00 3.06 0.00 0.00 3.35 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.55 0.00 80 G 8.85 4.18 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 0.00 81 N 7.28 4.70 0.00 2.32 2.43 0.00 0.00 7.01 7.54 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 82 E 8.29 3.63 0.00 1.86 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 0.00 2.26 2.31 0.00 83 A 7.85 4.07 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 84 L 7.61 4.07 0.00 1.79 1.66 0.80 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 85 L 8.36 5.04 0.00 1.59 1.56 0.67 0.53 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 86 Q 8.97 4.23 0.00 2.09 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.61 6.55 0.00 0.00 0.00 0.00 0.00 2.37 2.31 0.00 87 N 7.75 4.86 0.00 2.86 2.59 0.00 0.00 6.58 7.71 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 88 V 8.47 4.89 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 0.93 0.00 0.00 1.02 0.00 0.00 89 K 9.31 4.71 0.00 1.82 1.62 0.00 1.65 0.00 0.00 1.68 0.00 0.00 3.09 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.35 1.40 7.81 90 I 8.51 5.03 1.92 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.15 0.96 0.00 0.00 91 D 9.21 5.07 0.00 2.57 2.55 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 92 Q 8.55 5.26 0.00 1.85 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 6.75 0.00 0.00 0.00 0.00 0.00 2.22 2.30 0.00 93 L 8.65 4.62 0.00 1.64 1.68 0.90 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 94 Y 8.26 5.09 0.00 2.86 2.83 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 95 R 8.91 4.03 0.00 1.79 1.89 0.00 3.28 0.00 0.00 3.24 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.74 0.00 96 L 8.29 4.56 0.00 1.69 1.58 0.94 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 97 A 8.56 4.18 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 * Residues marked with a * may have inaccurate shift predictions.