NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.3855 8.2644 123.5939 52.0462 19.9463 175.9085 2 N 4.7488 8.5582 119.2594 51.3973 41.7569 172.7110 3 A 4.3077 8.5823 127.7879 50.7728 20.5108 174.1163 4 F 3.6057 8.2189 118.3624 59.8204 38.7615 176.2272 5 L 3.8073 8.3062 131.0553 55.7414 38.9890 172.7432 *8 L 4.3853 7.5010 119.7538 54.2712 44.1128 178.5640 9 R 3.9184 7.9820 116.1313 56.0716 30.4192 174.7173 10 P 4.4345 0.0000 0.0000 61.8372 32.1599 176.0809 11 G 3.8316 7.8981 109.2408 45.6679 0.0000 173.6049 12 S 4.1524 7.9630 113.6043 57.2721 64.0028 175.5317 13 L 3.7369 8.1390 128.0791 55.8257 41.0724 178.2177 *15 R 4.1236 7.9078 117.1621 55.9541 31.7238 176.7308 *17 C 5.0702 8.1623 113.3222 57.4912 41.9277 175.5161 18 K 4.3223 7.4974 117.8591 56.5930 31.2396 176.9977 *21 Q 4.4669 7.9647 116.6196 56.0116 29.8176 173.7412 22 C 5.1488 9.5000 116.2129 53.8784 44.4157 173.0870 23 S 5.1282 8.3349 115.9725 56.6596 64.7938 175.0923 24 F 3.0148 7.9928 124.0238 58.2764 36.7691 174.6886 *27 A 4.1432 7.9653 127.1037 51.4753 20.5300 178.9951 28 R 3.4832 7.8503 115.5118 58.6361 30.7413 177.6396 *30 I 3.9833 7.6883 116.5069 61.9925 38.8387 176.8795 31 F 4.2728 8.2036 117.7955 58.1430 39.0972 176.3538 32 K 4.3359 9.2205 124.5147 56.9245 31.2099 176.4932 33 D 4.4466 7.7241 117.7684 54.3515 41.4004 177.3130 34 A 4.2053 8.5080 123.4670 54.0907 18.8795 179.3372 *36 R 4.1385 7.9310 116.1116 56.6774 32.3275 178.0560 37 T 3.7025 7.7007 113.9290 66.5174 68.3789 176.6388 38 K 4.2591 8.4961 120.6341 59.6717 31.9636 178.7103 39 L 3.9219 8.0428 118.5592 58.4263 42.0154 178.5772 40 F 4.2354 7.9644 119.5809 61.1637 39.5333 176.9929 41 W 4.1071 9.2627 128.0824 60.0023 30.1595 177.7535 42 I 3.7277 8.2457 119.8003 64.6328 36.8166 178.0397 43 S 4.1903 7.7693 114.8622 61.4275 62.8514 175.5961 44 Y 3.9120 6.7889 121.1835 60.4663 38.2687 177.3320 45 S 3.9613 6.7533 109.9490 57.7620 63.0875 174.3457 46 D 4.1961 7.7901 122.4404 55.2057 41.2271 177.7814 47 G 3.8881 7.9700 102.0321 45.7548 0.0000 172.8266 48 D 4.9878 7.9495 119.2827 52.0560 40.2490 176.8295 49 Q 4.1980 8.7303 124.0600 57.6865 29.0896 177.2078 50 C 4.2484 8.7070 115.4250 57.3924 40.8300 175.4594 51 A 3.7284 8.1744 123.4751 55.0144 17.9689 178.4303 52 S 4.2903 7.9998 107.8703 58.2277 63.6159 175.0432 53 S 3.5933 7.8333 115.1941 59.6318 59.9804 170.2799 54 P 4.2379 0.0000 0.0000 65.1510 32.0654 178.4745 55 C 4.5212 7.9372 116.9584 56.7170 35.1767 173.4359 56 Q 4.1777 9.1103 124.9929 54.7836 30.4881 174.9266 57 N 3.8507 9.3150 113.6908 54.5856 35.5766 174.7482 58 G 3.7873 7.7738 98.3132 46.5190 0.0000 173.4317 59 G 4.0277 7.6409 106.1111 45.4134 0.0000 173.9603 60 S 4.9469 8.9515 116.0961 56.6605 65.7178 172.7823 61 C 5.3225 8.7978 124.1993 55.2080 45.5645 172.8085 62 K 4.5952 8.9770 125.6430 54.4563 34.6970 175.0089 63 D 4.9245 8.9150 127.4732 55.0897 42.1025 175.1751 64 Q 4.4507 8.4911 121.4847 54.5157 32.8801 174.3336 65 L 4.3627 8.3576 118.6983 55.7839 40.9488 177.4901 66 Q 3.9308 10.5131 122.3939 56.0716 27.1347 173.7109 67 S 4.5518 7.3997 112.5499 58.5098 65.4102 172.0181 68 Y 5.1776 7.4519 117.2463 56.8179 41.0549 173.8321 69 I 4.6385 8.9465 119.2991 59.8170 41.2673 173.9864 70 C 5.5059 8.9347 123.8994 55.4968 43.3312 173.2085 71 F 4.5950 9.7346 123.4736 56.2619 39.8274 174.7685 72 C 5.0167 8.6946 121.3484 55.7132 42.1958 174.0892 73 L 4.4522 8.6088 120.6271 53.9913 42.2128 176.6510 74 P 4.0892 0.0000 0.0000 66.0197 31.6123 177.0636 75 A 4.2171 7.9958 118.6115 51.9350 18.3444 176.1853 76 F 5.5342 8.4186 115.1710 56.3409 43.4660 173.2443 77 E 4.5680 8.6804 118.8220 55.4442 32.1796 174.4356 78 G 4.2674 9.0464 105.0599 44.6761 0.0000 174.4514 79 R 3.8250 8.5702 120.3140 58.9873 30.1272 177.2314 80 N 5.0161 8.3977 113.1171 52.7722 39.0664 174.1263 81 C 4.4961 8.3384 113.5119 57.9831 38.3562 174.6072 82 E 3.9277 8.3152 119.5480 59.0034 30.0859 177.0793 83 T 4.0997 7.9745 117.5524 63.4487 68.9301 173.2326 84 H 4.6692 8.9310 124.5995 54.3445 29.1188 176.4427 85 K 3.9895 8.3430 125.6592 59.3221 32.0493 179.2310 86 D 4.3886 7.8569 117.1445 56.4736 40.9127 176.4584 87 D 4.7848 7.8939 117.9083 54.3330 40.7724 176.6082 88 Q 4.5349 7.5899 116.9163 55.7685 29.2054 177.1012 89 L 4.3348 7.6702 121.6984 53.9874 40.4767 175.5557 90 I 4.7528 7.0952 114.9491 58.3956 41.3146 178.1650 91 C 4.3214 9.4918 119.8765 60.1522 40.1441 176.7754 92 V 3.3875 7.6975 117.3877 63.3149 31.4906 175.7031 93 N 4.5124 8.1857 120.4566 52.7076 38.0049 174.3182 94 E 3.8176 9.2417 129.2233 57.7139 27.4623 175.1233 95 N 4.6040 8.3186 109.6707 53.2117 37.8378 174.0199 96 G 4.0054 9.0703 101.8608 45.9159 0.0000 175.5905 97 G 3.9006 8.2935 105.5975 45.5358 0.0000 174.1750 98 C 4.5323 7.9137 117.2049 56.3546 40.9631 173.6994 99 E 4.0282 8.7324 124.5670 58.3956 30.4212 176.9501 100 Q 4.2158 8.0631 112.4063 55.9787 31.0310 176.4664 101 Y 4.9685 5.4445 119.9642 57.8454 40.9248 174.7921 102 C 5.4718 8.7500 121.2724 55.0085 43.6007 173.1924 103 S 4.7417 9.3484 121.2025 56.7955 65.8561 173.3956 104 D 4.7680 8.6869 124.5106 54.4698 42.2144 176.6909 105 H 4.6622 8.4848 118.5782 54.4477 30.8307 173.1846 106 T 4.1041 8.2760 115.0384 62.8427 69.0864 174.8448 107 G 4.0949 9.3485 112.1082 45.8605 0.0000 173.1440 108 T 4.7180 7.4438 113.9355 61.0229 72.6926 173.5029 109 K 4.0631 8.4642 124.0940 56.2810 32.7166 176.7015 110 R 4.4361 8.4177 121.8022 56.4826 30.4679 175.5698 111 S 4.9024 9.3171 114.1906 56.8642 66.4161 172.2189 112 C 5.4478 8.7839 118.1550 55.7749 38.3210 172.9136 113 R 4.7951 8.9321 119.8205 55.1984 34.8444 172.9636 114 C 5.0958 8.5049 115.5127 55.3709 39.2290 174.0381 115 H 4.4818 9.2648 120.6848 55.4238 30.2097 174.6934 116 E 4.2529 8.1990 122.4418 57.9448 29.8196 177.8879 117 G 3.9490 9.5280 110.4507 45.1362 0.0000 172.1178 118 Y 5.3891 7.6394 115.3625 56.2542 42.1845 174.8395 119 S 4.7752 9.1305 114.3417 56.4958 66.9337 173.1188 120 L 4.5952 8.5086 124.2844 55.2497 42.9525 176.7393 121 L 4.5128 9.1989 126.5454 53.8101 43.2118 177.6590 122 A 4.1249 8.6069 122.0063 54.7183 18.0814 178.1194 123 D 4.4667 8.1658 114.3994 53.2950 39.6718 177.9374 124 G 4.0569 8.0508 107.0961 46.4367 0.0000 174.6245 125 V 4.4761 7.7223 109.4897 60.5900 34.9098 175.5897 126 S 5.1371 8.7832 117.0256 57.4718 64.8850 172.5422 127 C 5.5213 9.5798 120.2652 55.4717 42.4824 173.4562 128 T 4.9284 8.9137 117.5214 59.3411 70.4867 171.3378 129 P 4.3834 0.0000 0.0000 62.9968 31.8189 176.1960 130 T 4.5277 8.9745 113.0049 61.5150 69.6796 173.7721 131 V 4.4874 7.2017 114.0458 59.3592 35.8600 175.1330 132 E 3.8213 8.7145 121.4642 58.8353 29.6049 176.5016 133 Y 4.6950 7.2929 115.8530 54.9721 38.0411 173.2375 134 P 4.3642 0.0000 0.0000 61.8665 31.2714 177.1514 135 C 4.2730 8.5033 114.3785 59.3353 30.2074 174.0330 136 G 4.0542 8.8404 107.6829 46.1548 0.0000 173.4836 137 K 4.6083 7.5326 117.0898 54.2562 35.4317 176.4673 138 I 4.3032 8.0206 122.9781 59.0026 37.3168 174.5436 139 P 4.3028 0.0000 0.0000 65.6868 31.2195 178.9727 140 I 3.9258 7.8439 108.2280 62.4776 37.4701 176.0955 141 L 4.5804 7.7565 120.1764 55.6531 43.7856 176.2670 142 E 4.1456 7.8164 121.8764 56.7735 29.3414 176.6448 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 A 8.26 4.39 1.31 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 2 N 8.56 4.75 0.00 2.74 2.68 0.00 0.00 6.75 7.08 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 3 A 8.58 4.31 1.23 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 0.00 0.00 0.00 4 F 8.22 3.61 0.00 2.97 3.28 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 5 L 8.31 3.81 0.00 0.36 1.57 0.76 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 *8 L 7.50 4.39 0.00 1.67 1.76 0.99 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 9 R 7.98 3.92 0.00 1.77 1.87 0.00 3.34 0.00 0.00 3.19 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.60 0.00 10 P 0.00 4.43 0.00 2.01 1.95 0.00 3.69 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.06 0.00 11 G 7.90 3.83 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 0.00 0.00 0.00 12 S 7.96 4.15 0.00 3.73 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 13 L 8.14 3.74 0.00 1.34 1.39 0.21 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 *15 R 7.91 4.12 0.00 1.78 2.12 0.00 3.36 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 1.49 1.71 0.00 *17 C 8.16 5.07 0.00 2.90 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 18 K 7.50 4.32 0.00 1.77 1.88 0.00 1.76 0.00 0.00 1.74 0.00 0.00 2.99 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.58 1.47 7.81 *21 Q 7.96 4.47 0.00 2.16 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.80 0.00 0.00 0.00 0.00 0.00 2.31 2.32 0.00 22 C 9.50 5.15 0.00 3.16 3.20 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 23 S 8.33 5.13 0.00 3.96 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 24 F 7.99 3.01 0.00 2.02 2.58 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.97 4.14 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 28 R 7.85 3.48 0.00 1.75 1.86 0.00 3.13 0.00 0.00 3.16 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.63 0.00 *30 I 7.69 3.98 1.37 0.00 0.00 0.59 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 0.44 0.30 0.00 0.00 31 F 8.20 4.27 0.00 2.92 2.98 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 0.00 32 K 9.22 4.34 0.00 1.80 2.02 0.00 1.71 0.00 0.00 1.69 0.00 0.00 2.95 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.32 1.38 7.81 33 D 7.72 4.45 0.00 2.81 2.61 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 34 A 8.51 4.21 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 *36 R 7.93 4.14 0.00 1.88 1.83 0.00 3.15 0.00 0.00 3.72 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.64 0.00 37 T 7.70 3.70 4.44 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 0.53 0.00 0.00 38 K 8.50 4.26 0.00 1.89 2.04 0.00 1.79 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.71 1.89 7.81 39 L 8.04 3.92 0.00 1.60 1.82 0.93 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 40 F 7.96 4.24 0.00 2.87 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 41 W 9.26 4.11 0.00 3.83 3.50 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 0.00 0.00 0.00 0.00 42 I 8.25 3.73 2.00 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 1.62 1.03 0.92 0.00 0.00 43 S 7.77 4.19 0.00 3.76 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 44 Y 6.79 3.91 0.00 1.74 2.13 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 45 S 6.75 3.96 0.00 3.47 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 D 7.79 4.20 0.00 2.74 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 47 G 7.97 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 48 D 7.95 4.99 0.00 2.61 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 0.00 0.00 0.00 49 Q 8.73 4.20 0.00 2.36 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.91 6.63 0.00 0.00 0.00 0.00 0.00 2.51 2.45 0.00 50 C 8.71 4.25 0.00 3.24 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 51 A 8.17 3.73 1.23 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 0.00 0.00 0.00 52 S 8.00 4.29 0.00 3.92 3.90 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 53 S 7.83 3.59 0.00 3.87 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 54 P 0.00 4.24 0.00 1.90 1.79 0.00 3.49 0.00 0.00 3.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.59 0.00 55 C 7.94 4.52 0.00 2.98 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 56 Q 9.11 4.18 0.00 2.09 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.18 6.16 0.00 0.00 0.00 0.00 0.00 2.29 2.46 0.00 57 N 9.31 3.85 0.00 1.72 1.42 0.00 0.00 6.84 7.65 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 58 G 7.77 3.79 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 0.00 0.00 0.00 59 G 7.64 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 60 S 8.95 4.95 0.00 3.77 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 C 8.80 5.32 0.00 2.95 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 62 K 8.98 4.60 0.00 2.02 1.94 0.00 1.61 0.00 0.00 1.55 0.00 0.00 2.89 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.48 1.52 7.81 63 D 8.91 4.92 0.00 2.73 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 64 Q 8.49 4.45 0.00 2.08 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.78 0.00 0.00 0.00 0.00 0.00 2.52 2.48 0.00 65 L 8.36 4.36 0.00 1.70 1.62 0.92 0.97 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 66 Q 10.51 3.93 0.00 2.16 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.54 0.00 0.00 0.00 0.00 0.00 2.27 2.45 0.00 67 S 7.40 4.55 0.00 3.66 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 68 Y 7.45 5.18 0.00 2.98 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 69 I 8.95 4.64 2.01 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 1.14 0.78 0.57 0.00 0.00 70 C 8.93 5.51 0.00 3.04 3.09 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 0.00 0.00 0.00 71 F 9.73 4.59 0.00 2.94 3.06 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 0.00 0.00 0.00 72 C 8.69 5.02 0.00 3.02 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 73 L 8.61 4.45 0.00 2.00 1.76 1.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 74 P 0.00 4.09 0.00 2.05 2.15 0.00 3.75 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 2.07 2.17 0.00 75 A 8.00 4.22 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 F 8.42 5.53 0.00 2.97 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 77 E 8.68 4.57 0.00 2.12 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 2.29 2.32 0.00 78 G 9.05 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 79 R 8.57 3.83 0.00 1.75 2.02 0.00 3.13 0.00 0.00 3.17 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.56 0.00 80 N 8.40 5.02 0.00 2.96 3.04 0.00 0.00 7.06 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 81 C 8.34 4.50 0.00 3.19 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 82 E 8.32 3.93 0.00 2.13 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 0.00 2.33 2.31 0.00 83 T 7.97 4.10 4.44 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 1.25 0.00 0.00 84 H 8.93 4.67 0.00 3.39 3.22 0.00 5.82 0.00 0.00 0.00 0.00 6.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 K 8.34 3.99 0.00 1.75 1.77 0.00 1.75 0.00 0.00 1.58 0.00 0.00 2.87 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.56 1.33 7.81 86 D 7.86 4.39 0.00 2.61 2.69 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 0.00 0.00 0.00 0.00 87 D 7.89 4.78 0.00 2.78 2.67 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 88 Q 7.59 4.53 0.00 2.02 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 7.48 0.00 0.00 0.00 0.00 0.00 2.47 2.40 0.00 89 L 7.67 4.33 0.00 1.57 1.60 0.98 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 90 I 7.10 4.75 1.86 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 1.59 0.78 0.91 0.00 0.00 91 C 9.49 4.32 0.00 3.14 3.18 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 92 V 7.70 3.39 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 0.68 0.00 0.00 0.92 0.00 0.00 93 N 8.19 4.51 0.00 2.82 2.97 0.00 0.00 7.16 7.27 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 94 E 9.24 3.82 0.00 2.14 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 0.00 2.31 2.21 0.00 95 N 8.32 4.60 0.00 2.94 2.81 0.00 0.00 7.57 7.90 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 96 G 9.07 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 0.00 0.00 0.00 97 G 8.29 3.90 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 0.00 0.00 0.00 98 C 7.91 4.53 0.00 3.09 3.10 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 99 E 8.73 4.03 0.00 1.93 1.97 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 2.19 2.20 0.00 100 Q 8.06 4.22 0.00 1.74 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.82 6.66 0.00 0.00 0.00 0.00 0.00 1.91 2.05 0.00 101 Y 5.44 4.97 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 0.00 102 C 8.75 5.47 0.00 3.03 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 0.00 103 S 9.35 4.74 0.00 3.67 3.57 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 0.00 104 D 8.69 4.77 0.00 2.51 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 0.00 105 H 8.48 4.66 0.00 3.27 3.16 0.00 5.63 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 T 8.28 4.10 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 0.00 107 G 9.35 4.09 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 0.00 0.00 0.00 0.00 0.00 0.00 108 T 7.44 4.72 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 0.00 109 K 8.46 4.06 0.00 1.72 1.72 0.00 1.79 0.00 0.00 1.76 0.00 0.00 2.87 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.44 1.44 7.81 110 R 8.42 4.44 0.00 1.96 1.92 0.00 3.09 0.00 0.00 3.28 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.70 0.00 111 S 9.32 4.90 0.00 3.87 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 0.00 112 C 8.78 5.45 0.00 3.03 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 0.00 113 R 8.93 4.80 0.00 1.85 1.91 0.00 3.12 0.00 0.00 3.23 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.65 0.00 114 C 8.50 5.10 0.00 2.80 2.97 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 0.00 115 H 9.26 4.48 0.00 2.75 3.05 0.00 5.59 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 0.00 116 E 8.20 4.25 0.00 2.07 1.93 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 2.33 2.39 0.00 117 G 9.53 3.95 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 0.00 0.00 0.00 118 Y 7.64 5.39 0.00 2.87 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 0.00 119 S 9.13 4.78 0.00 3.84 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 0.00 120 L 8.51 4.60 0.00 1.68 1.63 0.96 1.03 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 0.00 121 L 9.20 4.51 0.00 1.80 1.60 0.93 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 122 A 8.61 4.12 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 0.00 123 D 8.17 4.47 0.00 2.84 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 0.00 124 G 8.05 4.06 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 0.00 0.00 0.00 0.00 0.00 0.00 125 V 7.72 4.48 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 0.83 0.00 0.00 1.02 0.00 0.00 126 S 8.78 5.14 0.00 3.95 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 0.00 127 C 9.58 5.52 0.00 2.60 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 0.00 128 T 8.91 4.93 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 1.28 0.00 0.00 129 P 0.00 4.38 0.00 1.82 1.62 0.00 3.67 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.99 0.00 130 T 8.97 4.53 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 1.24 0.00 0.00 131 V 7.20 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 0.68 0.00 0.00 0.83 0.00 0.00 132 E 8.71 3.82 0.00 1.73 1.77 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 1.47 1.79 0.00 133 Y 7.29 4.70 0.00 2.97 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 0.00 134 P 0.00 4.36 0.00 1.56 1.42 0.00 3.77 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 1.93 1.70 0.00 135 C 8.50 4.27 0.00 3.15 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 0.00 136 G 8.84 4.05 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 0.00 0.00 0.00 0.00 0.00 0.00 137 K 7.53 4.61 0.00 1.88 1.74 0.00 1.96 0.00 0.00 1.77 0.00 0.00 3.04 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.54 1.62 7.81 138 I 8.02 4.30 1.89 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 1.43 1.04 0.93 0.00 0.00 139 P 0.00 4.30 0.00 2.27 2.35 0.00 3.65 0.00 0.00 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.35 0.00 140 I 7.84 3.93 1.88 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 1.43 0.54 0.93 0.00 0.00 141 L 7.76 4.58 0.00 1.80 1.73 0.93 0.68 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 0.00 142 E 7.82 4.15 0.00 1.95 1.89 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 2.53 2.44 0.00 * Residues marked with a * may have inaccurate shift predictions.