NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- *1 Q 4.2673 8.3401 119.0978 54.9825 30.5498 175.5618 2 A 3.9414 7.3689 120.4357 50.5754 19.3996 171.1920 3 V 4.4949 8.5820 119.3055 61.0490 36.1493 172.7873 4 V 4.9499 8.5819 127.0645 61.5964 33.8610 173.9435 5 T 4.9929 9.0956 125.1485 62.0036 70.9579 173.5713 6 Q 5.3420 8.4778 123.2620 52.4860 32.8966 174.9906 7 E 4.1886 8.7547 120.0510 56.4548 30.4592 178.5233 8 S 4.3391 8.8106 117.4324 61.4319 64.2573 173.9222 9 A 5.1025 7.6100 118.5186 50.5530 21.9586 175.6778 10 L 4.8649 9.0546 121.1897 53.1701 45.6475 175.7073 11 T 5.0336 8.4889 118.2296 62.3129 71.4538 173.1812 12 T 4.6926 8.5761 118.7024 60.9318 71.7174 171.8069 13 S 5.0439 8.3083 114.7831 55.4463 66.2098 171.8041 14 P 5.0291 0.0000 0.0000 63.7882 31.3533 176.9523 15 G 3.7937 8.7426 108.4941 45.6391 0.0000 172.6116 16 E 4.4842 7.5537 121.5333 55.2502 32.2394 174.2790 17 T 5.1862 8.5432 117.4312 61.7267 71.5189 174.5944 18 V 4.5182 8.6990 123.4137 60.5028 35.2921 173.8457 19 T 4.9775 8.3713 118.4262 61.7860 71.6925 173.1518 20 L 4.9123 8.6305 125.8146 53.0677 44.7780 175.6139 21 T 5.3908 9.0774 111.6946 60.1659 72.9804 171.9962 22 C 5.2001 9.8386 124.8964 55.8191 45.1054 173.3436 23 R 5.2053 9.2863 129.6610 55.8564 32.1393 172.1754 24 S 5.6249 8.7198 120.3908 55.7126 65.0302 174.0712 25 S 4.1296 8.7190 118.1668 59.8416 62.8667 175.6742 26 T 4.0775 7.8924 111.5547 62.0103 69.6141 176.4608 27 G 3.9314 7.2880 111.5153 44.4659 0.0000 172.3249 28 A 4.3459 8.8115 122.2140 52.5826 19.2191 177.5984 29 V 4.3405 8.1638 119.3891 61.6318 33.5270 174.8249 30 T 4.6930 8.0249 120.0772 60.3996 71.0702 174.1253 31 T 3.6235 8.7220 119.6983 66.4316 68.4214 176.3987 32 S 4.2686 7.7884 113.8930 60.0834 63.7308 174.6925 33 N 4.4362 8.3602 118.8190 53.5793 39.2799 173.7987 34 Y 3.0367 6.9203 114.5596 58.3096 35.2840 170.3002 35 A 4.2285 7.5594 121.7773 52.5874 20.1929 177.3889 36 N 5.2325 8.7568 121.1660 51.6563 42.3418 172.9870 37 W 5.2151 8.6415 124.8468 55.0823 31.6352 174.9802 38 V 4.8148 9.6592 125.4821 61.1677 34.1262 173.8007 39 Q 4.7479 9.1815 128.7730 54.3053 31.2604 173.4445 40 E 4.6181 8.7417 127.8025 54.3223 31.6948 174.7319 41 K 4.6931 8.8544 126.6585 53.6892 34.9433 174.3252 42 P 3.9649 0.0000 0.0000 64.4662 31.9081 174.9095 43 D 4.1531 8.4907 122.0532 55.7424 36.1878 172.8123 44 H 4.0678 7.9108 117.7292 57.0724 27.3365 174.4537 45 L 4.4945 7.3934 119.9217 54.1009 42.5074 176.1984 46 F 5.4414 8.6521 122.1843 56.3277 42.4090 175.0910 47 T 4.3665 8.6974 113.3876 61.0593 71.1079 173.0986 48 G 3.9836 9.0095 116.7136 46.8875 0.0000 172.3981 49 L 4.6701 9.1835 122.2878 55.5755 43.8280 176.4823 50 I 5.3830 6.9906 116.9976 58.7436 41.9349 174.4545 51 G 3.9462 8.9089 107.3922 46.0123 0.0000 173.3853 52 G 4.0198 9.4691 108.1301 47.0679 0.0000 175.3350 53 T 3.7395 8.3003 121.6874 64.4058 67.8461 174.1231 54 N 5.0911 8.0022 113.1482 52.3057 38.2951 173.3097 55 N 4.8116 8.1862 117.7430 52.4130 39.5720 174.9026 56 R 4.6334 8.5890 123.2996 55.8461 30.8201 176.6590 57 A 4.3135 9.5444 125.8740 50.8852 19.8543 175.5965 58 P 4.2904 0.0000 0.0000 64.0066 32.1597 175.0140 59 G 4.1656 9.2538 110.6007 45.7276 0.0000 174.4713 60 V 3.4267 6.8932 117.4044 62.1803 31.9537 173.8942 61 P 4.3099 0.0000 0.0000 62.8716 31.4516 176.9067 62 A 4.0526 8.9436 126.1391 55.2314 18.4152 178.4323 63 R 4.5681 8.0968 111.2948 57.7360 30.1952 176.3655 64 F 5.4450 8.1587 119.3667 56.1269 40.8648 175.4813 65 S 4.6315 8.9176 115.9597 57.4545 66.4774 174.3793 66 G 4.7795 8.9351 109.9886 44.2437 0.0000 172.0673 67 S 4.9067 7.3825 111.4916 58.5846 66.4556 175.4259 68 L 5.1536 8.4817 118.5398 53.4166 44.6314 177.0902 69 I 4.3358 8.5382 124.1327 60.0029 38.9102 176.6088 70 G 4.0203 8.1529 118.8161 46.8992 0.0000 172.1512 71 N 4.8148 8.7762 123.0278 52.3100 37.5775 174.0005 72 K 5.1440 7.7467 117.6976 54.7853 36.8894 175.3514 73 A 4.8519 8.7510 123.9755 51.9057 20.1334 176.5598 74 A 5.2912 9.3444 121.6416 50.3295 23.4788 174.7802 75 L 4.6262 8.4813 122.8273 53.3214 44.6070 175.1702 76 T 4.8629 9.1496 123.7463 61.7471 71.2875 173.3339 77 I 4.5754 8.5777 127.3875 59.4624 40.2740 174.6003 78 T 4.3810 8.9061 118.7768 60.8517 70.3020 174.8369 79 G 3.3996 8.7824 118.0782 45.6030 0.0000 172.5796 80 A 3.8212 7.7329 120.7899 52.5513 18.8969 177.6053 81 Q 4.8367 8.7758 122.2159 53.9960 31.2786 176.9235 82 T 3.8310 8.5394 110.5674 65.2355 68.4897 175.3825 83 E 4.3087 8.2024 117.6950 57.3111 29.1692 176.4003 84 D 5.1090 8.0330 117.7803 53.9501 41.9103 176.1154 85 E 4.3769 8.2520 121.0041 56.1450 30.2610 175.9643 86 A 4.1973 8.1603 127.6183 52.2557 24.0777 174.3022 87 I 4.6044 7.7168 119.7303 60.1658 39.3019 174.9967 88 Y 5.0915 9.5340 126.8096 56.6547 39.6428 175.1707 89 F 5.5723 10.0836 124.1325 56.0665 42.3845 172.3660 90 C 5.1766 8.9613 113.9842 53.8062 40.0526 172.4584 91 A 4.9973 8.1507 120.1032 50.6283 22.7996 175.2294 92 L 5.0569 8.8947 119.6603 52.7003 45.9754 175.7180 93 W 4.2687 8.6697 134.7285 56.1612 30.7354 174.9931 94 Y 4.1907 7.7629 126.2705 57.1359 40.5504 178.9461 95 S 3.1153 8.6790 119.5454 59.5202 63.0285 172.2385 96 N 4.6490 8.5898 119.8949 52.7447 38.3744 174.9769 97 H 4.4181 6.4303 112.5558 55.6077 31.4128 172.8729 98 W 5.1195 9.0015 120.3555 55.4774 30.8619 176.0331 99 V 4.7372 9.1776 121.4212 61.3757 34.0781 174.3776 100 F 5.1046 9.1961 125.9631 55.9159 40.9798 175.8618 101 G 4.2284 8.9754 109.7092 45.5367 0.0000 174.2663 102 G 3.8830 8.8518 109.0744 47.1534 0.0000 175.0559 103 G 3.2254 8.6196 106.7886 44.8322 0.0000 172.8424 104 T 4.9549 8.7180 120.7725 61.0275 71.4153 174.1624 105 K 4.6758 8.8956 131.0900 54.7064 33.3802 172.1073 106 L 4.8618 9.5133 128.6586 52.9402 43.9701 175.7151 107 T 4.6673 8.6059 125.7479 62.2453 68.7103 174.6040 108 V 3.9166 8.1404 126.5278 62.0896 32.6033 174.9014 109 L 3.4323 8.8851 129.9613 55.7358 39.4614 174.6111 *110 E 4.3209 9.1026 118.9413 55.4413 30.4417 175.2142 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 Q 8.34 4.27 0.00 2.09 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 7.00 0.00 0.00 0.00 0.00 0.00 2.18 1.94 0.00 2 A 7.37 3.94 0.33 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 3 V 8.58 4.49 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 0.97 0.00 0.00 0.92 0.00 0.00 4 V 8.58 4.95 2.39 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 1.08 0.00 0.00 1.17 0.00 0.00 5 T 9.10 4.99 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 1.26 0.00 0.00 6 Q 8.48 5.34 0.00 1.98 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.74 6.95 0.00 0.00 0.00 0.00 0.00 2.35 2.30 0.00 7 E 8.75 4.19 0.00 2.11 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 2.42 2.40 0.00 8 S 8.81 4.34 0.00 3.91 4.14 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 9 A 7.61 5.10 1.21 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 0.00 0.00 10 L 9.05 4.86 0.00 1.53 1.49 0.91 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 11 T 8.49 5.03 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 1.21 0.00 0.00 12 T 8.58 4.69 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 1.21 0.00 0.00 13 S 8.31 5.04 0.00 3.85 3.58 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 14 P 0.00 5.03 0.00 2.19 2.03 0.00 3.47 0.00 0.00 4.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.92 0.00 15 G 8.74 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 16 E 7.55 4.48 0.00 2.03 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 2.21 2.27 0.00 17 T 8.54 5.19 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 1.20 0.00 0.00 18 V 8.70 4.52 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 0.71 0.00 0.00 0.82 0.00 0.00 19 T 8.37 4.98 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 1.14 0.00 0.00 20 L 8.63 4.91 0.00 1.08 1.36 0.63 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 21 T 9.08 5.39 4.35 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 1.25 0.00 0.00 22 C 9.84 5.20 0.00 2.87 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 23 R 9.29 5.21 0.00 1.51 1.75 0.00 3.28 0.00 0.00 3.20 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.42 0.00 24 S 8.72 5.62 0.00 3.39 3.73 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 25 S 8.72 4.13 0.00 3.88 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 T 7.89 4.08 4.32 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 1.12 0.00 0.00 27 G 7.29 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 28 A 8.81 4.35 1.24 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 0.00 0.00 0.00 29 V 8.16 4.34 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 0.70 0.00 0.00 0.90 0.00 0.00 30 T 8.02 4.69 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 1.18 0.00 0.00 31 T 8.72 3.62 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 1.11 0.00 0.00 32 S 7.79 4.27 0.00 4.01 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 33 N 8.36 4.44 0.00 2.84 2.67 0.00 0.00 6.85 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 34 Y 6.92 3.04 0.00 3.11 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 35 A 7.56 4.23 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 36 N 8.76 5.23 0.00 2.73 2.40 0.00 0.00 6.62 7.44 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 37 W 8.64 5.22 0.00 3.49 3.29 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 38 V 9.66 4.81 2.49 0.00 0.00 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 1.13 0.00 0.00 39 Q 9.18 4.75 0.00 2.15 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.54 0.00 0.00 0.00 0.00 0.00 1.95 1.51 0.00 40 E 8.74 4.62 0.00 1.74 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.47 0.00 41 K 8.85 4.69 0.00 1.57 1.62 0.00 1.69 0.00 0.00 1.79 0.00 0.00 2.83 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.29 1.50 7.81 42 P 0.00 3.96 0.00 1.99 1.99 0.00 3.71 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 2.01 2.06 0.00 43 D 8.49 4.15 0.00 2.94 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 H 7.91 4.07 0.00 3.24 3.38 0.00 5.71 0.00 0.00 0.00 0.00 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 L 7.39 4.49 0.00 1.59 1.55 0.90 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 46 F 8.65 5.44 0.00 2.80 2.89 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 47 T 8.70 4.37 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 1.19 0.00 0.00 48 G 9.01 3.98 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 0.00 0.00 0.00 49 L 9.18 4.67 0.00 1.67 1.50 1.17 -0.11 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 50 I 6.99 5.38 2.22 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 2.71 1.19 0.00 0.00 51 G 8.91 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 52 G 9.47 4.02 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 0.00 0.00 0.00 53 T 8.30 3.74 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 1.25 0.00 0.00 54 N 8.00 5.09 0.00 2.81 2.88 0.00 0.00 5.98 8.04 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 55 N 8.19 4.81 0.00 2.93 2.85 0.00 0.00 7.04 7.64 0.00 0.00 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 R 8.59 4.63 0.00 1.72 1.88 0.00 3.24 0.00 0.00 3.50 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.67 0.00 57 A 9.54 4.31 1.22 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 0.00 0.00 58 P 0.00 4.29 0.00 2.06 2.00 0.00 3.65 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.09 0.00 59 G 9.25 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 60 V 6.89 3.43 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 0.54 0.00 0.00 0.86 0.00 0.00 61 P 0.00 4.31 0.00 2.41 2.28 0.00 3.81 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 2.50 2.15 0.00 62 A 8.94 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 63 R 8.10 4.57 0.00 1.96 2.15 0.00 2.95 0.00 0.00 3.24 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.13 0.00 64 F 8.16 5.44 0.00 2.95 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 65 S 8.92 4.63 0.00 3.89 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 66 G 8.94 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 67 S 7.38 4.91 0.00 3.97 4.07 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 68 L 8.48 5.15 0.00 1.52 1.70 0.94 0.73 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 69 I 8.54 4.34 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 1.24 0.90 0.92 0.00 0.00 70 G 8.15 4.02 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 0.00 0.00 0.00 71 N 8.78 4.81 0.00 2.90 3.05 0.00 0.00 5.71 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 72 K 7.75 5.14 0.00 1.83 1.76 0.00 1.71 0.00 0.00 1.70 0.00 0.00 2.85 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.39 1.40 7.81 73 A 8.75 4.85 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 74 A 9.34 5.29 1.24 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 0.00 0.00 0.00 75 L 8.48 4.63 0.00 0.27 0.22 0.78 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 76 T 9.15 4.86 4.14 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 1.11 0.00 0.00 77 I 8.58 4.58 1.51 0.00 0.00 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 0.23 0.37 0.38 0.00 0.00 78 T 8.91 4.38 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 1.14 0.00 0.00 79 G 8.78 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 80 A 7.73 3.82 1.16 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 0.00 0.00 81 Q 8.78 4.84 0.00 2.12 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.79 6.64 0.00 0.00 0.00 0.00 0.00 2.37 2.41 0.00 82 T 8.54 3.83 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 83 E 8.20 4.31 0.00 2.02 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 0.00 2.34 2.41 0.00 84 D 8.03 5.11 0.00 2.62 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 85 E 8.25 4.38 0.00 2.18 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 0.00 2.34 2.55 0.00 86 A 8.16 4.20 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.72 4.60 1.79 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 1.16 0.56 0.45 0.00 0.00 88 Y 9.53 5.09 0.00 2.99 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 89 F 10.08 5.57 0.00 3.20 3.24 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 0.00 90 C 8.96 5.18 0.00 1.49 1.66 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 91 A 8.15 5.00 0.22 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 0.00 0.00 92 L 8.89 5.06 0.00 1.16 0.98 0.81 0.53 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 93 W 8.67 4.27 0.00 1.78 2.38 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 94 Y 7.76 4.19 0.00 2.62 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 95 S 8.68 3.12 0.00 3.76 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 96 N 8.59 4.65 0.00 2.78 2.80 0.00 0.00 5.81 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 97 H 6.43 4.42 0.00 3.29 3.30 0.00 5.25 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 W 9.00 5.12 0.00 3.45 3.12 0.00 0.00 0.00 0.00 0.00 0.00 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 V 9.18 4.74 2.42 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 1.15 0.00 0.00 1.12 0.00 0.00 100 F 9.20 5.10 0.00 2.99 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 0.00 101 G 8.98 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 0.00 0.00 0.00 0.00 102 G 8.85 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 G 8.62 3.23 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 0.00 104 T 8.72 4.95 4.38 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 1.29 0.00 0.00 105 K 8.90 4.68 0.00 1.46 1.69 0.00 1.77 0.00 0.00 1.57 0.00 0.00 2.74 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.37 1.26 7.81 106 L 9.51 4.86 0.00 1.82 2.06 0.86 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 107 T 8.61 4.67 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 1.24 0.00 0.00 108 V 8.14 3.92 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 0.69 0.00 0.00 0.95 0.00 0.00 109 L 8.89 3.43 0.00 1.78 1.71 0.92 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 *110 E 9.10 4.32 0.00 1.96 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.07 0.00 * Residues marked with a * may have inaccurate shift predictions.