NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 S 4.3119 8.3231 115.2901 57.4741 63.6962 172.2928 2 G 3.2570 7.8182 106.9113 42.6068 0.0000 172.6799 3 R 4.7281 8.4955 115.4048 53.0308 33.8066 173.7258 4 G 4.3372 8.3807 114.6092 45.6670 0.0000 172.1066 5 K 3.9300 8.3336 128.7193 56.6556 36.9644 174.2236 *11 G 3.8401 7.8048 107.0234 45.2692 0.0000 171.2145 12 K 4.2167 8.2204 115.6011 56.8542 34.0879 176.9872 *16 K 4.1990 8.5698 128.6198 56.0415 34.6855 175.1189 17 R 4.6029 7.7473 117.3385 54.7569 31.9947 176.3969 18 H 4.6271 8.4521 127.3543 58.3768 30.1165 175.0538 19 R 3.8140 8.4335 109.1373 56.7758 25.8661 175.3990 20 K 4.2012 7.4530 121.3309 54.9047 33.5349 176.6184 21 V 3.6335 8.1096 122.6119 62.8644 31.8995 175.1957 22 L 4.5710 8.3625 127.4177 53.2855 42.1883 176.0462 23 R 4.5455 8.1737 118.7025 55.8389 32.3487 174.2183 24 D 4.5365 8.8619 116.5367 55.6494 39.7481 175.0096 25 N 4.5780 7.5734 115.7691 54.5991 38.4382 176.5946 26 I 3.7218 7.7300 120.2874 63.7808 37.9062 176.9599 27 Q 4.3214 7.9495 117.4437 57.4702 28.6727 177.8560 28 G 3.9431 8.1369 106.7757 45.8745 0.0000 174.2403 29 I 4.1224 7.3502 122.4124 60.3086 35.9058 176.3199 30 T 4.1879 7.8821 116.3424 60.4910 71.1053 175.1898 31 K 3.5061 8.3117 121.9749 59.2660 32.0154 176.9421 32 P 4.2225 0.0000 0.0000 65.4151 31.1995 178.4739 33 A 3.9758 7.8329 119.1899 55.3264 18.2779 179.7955 34 I 3.7036 8.0503 118.5479 64.3957 37.0666 178.6252 35 R 3.9837 8.5920 120.0695 59.5469 29.9426 178.7810 36 R 3.9246 8.2457 117.9307 59.3143 30.1083 179.0079 37 L 3.9800 8.1758 118.5979 57.7793 41.5189 179.4967 38 A 4.0081 8.3042 120.8668 55.0718 18.2957 179.8816 39 R 3.8386 8.2998 116.9079 59.5550 29.9927 179.3385 40 R 4.2059 7.9797 117.0941 59.0370 30.1073 177.8810 41 G 3.8907 7.8633 103.0232 44.6677 0.0000 174.1915 42 G 3.8639 8.2200 109.0320 45.6303 0.0000 173.6130 43 V 3.9530 7.8598 119.6592 61.6784 32.1307 175.8121 44 K 4.3506 8.5732 127.1969 56.9867 33.2821 176.1429 45 R 4.6954 7.6187 116.9282 54.4988 33.1046 173.8063 46 I 4.5260 8.0697 124.0799 59.3153 40.8599 175.3465 47 S 4.3180 8.4545 119.5511 57.5963 63.0313 174.9848 48 G 3.8700 8.6880 114.5677 48.6622 0.0000 174.4969 49 L 4.2867 7.8145 117.8567 55.7951 42.2214 178.9352 50 I 3.5596 7.6129 120.8173 64.2853 36.8103 177.8214 51 Y 4.0740 7.1130 117.1622 61.1266 37.8553 178.0374 52 E 4.0473 8.2213 119.7390 58.9616 29.8098 178.2136 53 E 3.9350 7.9462 119.8059 59.5809 29.6266 178.9821 54 T 3.8849 8.2659 116.1742 66.5669 68.3844 176.8799 55 R 4.0405 8.1948 120.2067 59.2013 30.1283 179.2942 56 G 3.6181 8.1501 105.4379 47.8850 0.0000 175.9283 57 V 3.6398 7.9351 120.9547 65.5724 31.5690 177.9019 58 L 3.9976 8.3269 120.5542 57.8501 41.8653 178.8018 59 K 3.9571 8.3956 120.0244 59.4799 32.1604 178.9413 60 V 3.7565 7.8030 118.4394 65.8987 31.5530 177.5845 61 F 4.0475 8.4363 120.4517 61.4727 39.1717 177.0994 62 L 4.0167 8.6688 118.7947 57.8348 41.3508 179.2332 63 E 3.9433 8.5925 118.9288 59.5816 29.2651 179.3347 64 N 4.2316 8.0665 116.2760 56.2305 38.5338 177.7822 65 V 3.4304 7.3097 119.3350 66.0126 31.6109 178.1129 66 I 3.6624 7.9425 119.9523 64.1836 36.9106 178.1779 67 R 3.8363 8.1306 119.7267 59.8507 29.9196 178.3792 68 D 4.2499 7.8823 118.1722 57.1175 40.6862 178.6631 69 A 4.3784 8.4075 121.8308 55.3380 18.3866 179.9252 70 V 3.5827 8.3395 117.1585 66.2323 31.5585 178.4241 71 T 3.8671 7.7782 115.7830 66.6901 68.3420 176.2327 72 Y 4.1840 7.9762 118.6704 61.2605 37.6929 178.4728 73 T 3.9602 8.2220 116.8413 66.9497 68.5862 176.5095 74 E 4.0805 8.6381 120.7444 59.6781 29.2420 178.9295 75 H 4.1159 8.2718 117.1988 58.7346 29.9709 176.1921 76 A 4.3739 7.7886 119.5260 51.0872 18.6861 177.0413 77 K 3.8132 7.8845 115.9717 57.7182 30.1997 175.8534 78 R 4.6288 7.8692 116.4565 54.9200 31.9855 176.6496 79 K 4.4875 8.4713 116.6906 56.4165 33.3695 176.3636 80 T 4.5192 7.5821 116.0748 61.3038 70.5485 173.7979 81 V 3.9854 8.6610 126.4842 62.1324 32.1347 176.1539 82 T 4.4629 8.9420 118.3277 60.3932 71.7564 175.6984 83 A 3.9462 8.3304 123.0219 55.5554 18.3061 179.8772 84 M 3.6202 7.8778 116.7803 58.4135 31.9969 178.3996 85 D 4.3315 7.9356 119.0939 57.3200 40.9847 179.1591 86 V 3.5175 7.4988 118.4964 65.9580 31.4995 178.1595 87 V 3.5557 7.8930 118.3984 66.3706 31.2769 177.6484 88 Y 4.2599 7.7436 116.3283 60.8994 37.0571 178.2072 89 A 4.2846 8.1227 121.8546 55.2017 18.4755 179.7037 90 L 3.9552 8.4425 117.9581 57.7582 41.6512 179.5891 91 K 3.9963 8.4130 120.0894 59.5306 31.9980 178.8348 92 R 4.1356 8.2070 114.3647 58.1754 29.4660 177.5858 93 Q 4.5568 7.3999 116.9637 54.9083 29.0596 175.3840 94 G 3.9736 8.1882 107.4813 47.0037 0.0000 174.7078 95 R 4.7313 8.1488 115.1585 54.5086 30.8003 176.8620 96 T 3.8822 7.9780 113.1407 64.2787 69.2689 173.7127 97 L 4.7585 8.5457 126.9036 53.3687 44.5025 174.9267 98 Y 4.9872 8.3390 123.0496 57.4797 40.0653 175.6102 99 G 3.9246 8.8211 109.2746 45.7386 0.0000 174.5473 100 F 4.5097 8.3105 117.0313 57.2660 39.8207 174.3988 101 G 3.6684 8.6358 106.6461 45.3128 0.0000 174.7096 102 G 4.1509 8.4319 106.3933 45.9135 0.0000 173.6952 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 S 8.32 4.31 0.00 3.85 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 2 G 7.82 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 0.00 0.00 0.00 3 R 8.50 4.73 0.00 1.88 1.88 0.00 3.18 0.00 0.00 3.23 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.58 0.00 4 G 8.38 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 5 K 8.33 3.93 0.00 1.68 1.72 0.00 1.81 0.00 0.00 1.71 0.00 0.00 2.93 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.17 1.26 7.81 *11 G 7.80 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 0.00 0.00 0.00 12 K 8.22 4.22 0.00 1.70 1.57 0.00 1.80 0.00 0.00 1.63 0.00 0.00 2.90 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.33 1.33 7.81 *16 K 8.57 4.20 0.00 1.74 1.88 0.00 1.75 0.00 0.00 1.70 0.00 0.00 2.88 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.32 1.47 7.81 17 R 7.75 4.60 0.00 1.81 1.85 0.00 3.32 0.00 0.00 3.16 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.66 0.00 18 H 8.45 4.63 0.00 3.07 3.13 0.00 5.76 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 19 R 8.43 3.81 0.00 1.96 2.17 0.00 3.26 0.00 0.00 3.15 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.59 0.00 20 K 7.45 4.20 0.00 1.63 1.63 0.00 1.77 0.00 0.00 1.61 0.00 0.00 2.74 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.39 1.40 7.81 21 V 8.11 3.63 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 0.85 0.00 0.00 0.92 0.00 0.00 22 L 8.36 4.57 0.00 1.66 1.59 0.92 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 23 R 8.17 4.55 0.00 1.93 1.96 0.00 3.12 0.00 0.00 3.26 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.61 0.00 24 D 8.86 4.54 0.00 2.93 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 25 N 7.57 4.58 0.00 2.95 2.85 0.00 0.00 6.68 7.10 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 26 I 7.73 3.72 1.89 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 1.66 1.24 0.92 0.00 0.00 27 Q 7.95 4.32 0.00 2.25 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.76 0.00 0.00 0.00 0.00 0.00 2.50 2.52 0.00 28 G 8.14 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 29 I 7.35 4.12 2.01 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 1.49 0.89 0.93 0.00 0.00 30 T 7.88 4.19 4.19 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 0.00 0.00 0.00 1.24 0.00 0.00 31 K 8.31 3.51 0.00 1.25 1.54 0.00 0.90 0.00 0.00 1.46 0.00 0.00 2.75 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.10 0.21 7.81 32 P 0.00 4.22 0.00 2.17 2.05 0.00 3.51 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 2.06 2.09 0.00 33 A 7.83 3.98 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 34 I 8.05 3.70 2.29 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.78 1.00 0.00 0.00 35 R 8.59 3.98 0.00 2.05 2.15 0.00 3.12 0.00 0.00 3.21 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.75 0.00 36 R 8.25 3.92 0.00 2.08 1.97 0.00 3.19 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 1.66 1.87 0.00 37 L 8.18 3.98 0.00 1.83 1.70 0.91 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 38 A 8.30 4.01 1.37 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 39 R 8.30 3.84 0.00 2.01 2.00 0.00 3.31 0.00 0.00 3.32 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.80 0.00 40 R 7.98 4.21 0.00 1.81 2.10 0.00 3.25 0.00 0.00 3.22 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.64 0.00 41 G 7.86 3.89 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 0.00 0.00 0.00 42 G 8.22 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 0.00 0.00 0.00 43 V 7.86 3.95 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 0.78 0.00 0.00 0.91 0.00 0.00 44 K 8.57 4.35 0.00 1.74 1.80 0.00 1.79 0.00 0.00 1.63 0.00 0.00 2.95 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.34 1.40 7.81 45 R 7.62 4.70 0.00 1.74 1.71 0.00 3.23 0.00 0.00 3.22 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.64 0.00 46 I 8.07 4.53 1.90 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 1.25 0.78 0.58 0.00 0.00 47 S 8.45 4.32 0.00 3.82 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 48 G 8.69 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 49 L 7.81 4.29 0.00 1.73 1.69 0.92 0.63 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 50 I 7.61 3.56 1.42 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.78 0.59 0.00 0.00 51 Y 7.11 4.07 0.00 3.13 3.03 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 52 E 8.22 4.05 0.00 2.13 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 2.40 2.44 0.00 53 E 7.95 3.94 0.00 2.15 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 2.27 2.37 0.00 54 T 8.27 3.88 4.39 0.00 0.00 0.00 0.00 0.00 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 55 R 8.19 4.04 0.00 2.06 2.01 0.00 3.37 0.00 0.00 3.30 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.89 0.00 56 G 8.15 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 0.00 0.00 0.00 57 V 7.94 3.64 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 1.07 0.00 0.00 0.97 0.00 0.00 58 L 8.33 4.00 0.00 1.77 1.88 0.95 0.62 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 59 K 8.40 3.96 0.00 1.96 1.99 0.00 1.71 0.00 0.00 1.59 0.00 0.00 2.90 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.57 1.47 7.81 60 V 7.80 3.76 2.27 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 0.97 0.00 0.00 0.99 0.00 0.00 61 F 8.44 4.05 0.00 3.19 3.22 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 0.00 62 L 8.67 4.02 0.00 1.84 1.74 0.98 1.09 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 63 E 8.59 3.94 0.00 2.16 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 2.50 0.00 64 N 8.07 4.23 0.00 2.70 2.73 0.00 0.00 6.69 7.39 0.00 0.00 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 V 7.31 3.43 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 1.03 0.00 0.00 0.33 0.00 0.00 66 I 7.94 3.66 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 1.40 0.44 0.90 0.00 0.00 67 R 8.13 3.84 0.00 1.92 2.07 0.00 3.05 0.00 0.00 3.13 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.65 0.00 68 D 7.88 4.25 0.00 2.69 2.73 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 69 A 8.41 4.38 1.42 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 0.00 0.00 0.00 0.00 0.00 0.00 70 V 8.34 3.58 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 1.10 0.00 0.00 0.97 0.00 0.00 71 T 7.78 3.87 4.16 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 1.02 0.00 0.00 72 Y 7.98 4.18 0.00 3.38 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 73 T 8.22 3.96 4.45 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 1.32 0.00 0.00 74 E 8.64 4.08 0.00 1.98 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 2.34 2.52 0.00 75 H 8.27 4.12 0.00 3.20 3.57 0.00 5.94 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 A 7.79 4.37 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 77 K 7.88 3.81 0.00 1.92 1.91 0.00 1.67 0.00 0.00 1.69 0.00 0.00 2.98 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.35 1.36 7.81 78 R 7.87 4.63 0.00 1.98 1.87 0.00 3.15 0.00 0.00 3.25 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.78 0.00 79 K 8.47 4.49 0.00 1.72 1.82 0.00 1.70 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.34 1.42 7.81 80 T 7.58 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 1.22 0.00 0.00 81 V 8.66 3.99 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 0.84 0.00 0.00 0.95 0.00 0.00 82 T 8.94 4.46 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 1.22 0.00 0.00 83 A 8.33 3.95 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 84 M 7.88 3.62 0.00 1.59 1.99 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.48 0.00 85 D 7.94 4.33 0.00 2.88 3.01 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 86 V 7.50 3.52 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 0.86 0.00 0.00 0.91 0.00 0.00 87 V 7.89 3.56 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 1.01 0.00 0.00 0.98 0.00 0.00 88 Y 7.74 4.26 0.00 2.42 2.25 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 89 A 8.12 4.28 1.52 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 0.00 0.00 90 L 8.44 3.96 0.00 1.88 2.01 0.92 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 91 K 8.41 4.00 0.00 2.01 2.05 0.00 1.72 0.00 0.00 1.76 0.00 0.00 3.10 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.50 1.53 7.81 92 R 8.21 4.14 0.00 2.08 2.18 0.00 3.35 0.00 0.00 3.44 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 1.73 0.00 93 Q 7.40 4.56 0.00 2.16 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.68 0.00 0.00 0.00 0.00 0.00 2.29 2.47 0.00 94 G 8.19 3.97 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 0.00 0.00 0.00 95 R 8.15 4.73 0.00 1.89 1.98 0.00 3.47 0.00 0.00 3.45 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.84 0.00 96 T 7.98 3.88 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 1.34 0.00 0.00 97 L 8.55 4.76 0.00 1.60 1.59 1.07 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 98 Y 8.34 4.99 0.00 2.96 2.71 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 99 G 8.82 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 0.00 100 F 8.31 4.51 0.00 3.02 3.04 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 0.00 101 G 8.64 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 0.00 0.00 0.00 102 G 8.43 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 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.