NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 31 G 3.8750 8.1976 109.7240 45.2790 0.0000 175.8828 32 F 4.2243 7.6817 118.4003 58.4708 37.4752 174.4557 33 M 4.1339 7.3438 118.4540 56.9375 33.4617 178.7288 34 E 4.1467 8.0914 121.3950 59.9293 29.7246 179.2968 35 E 4.0752 7.8472 117.5058 61.1600 30.0413 181.1064 36 F 4.1485 8.0264 121.6411 61.1890 39.1551 177.3176 37 F 4.2851 7.9917 119.3095 60.9544 38.6955 177.8980 38 E 4.0551 7.9390 118.4939 62.2861 29.7300 182.1366 39 Q 4.2949 8.1699 120.5341 60.0845 28.2417 181.3765 40 V 3.6646 7.2552 122.5475 66.3756 31.5382 178.3081 41 E 4.2193 8.8234 116.9298 59.3592 29.3623 180.1019 42 E 4.2709 7.8758 117.4980 60.2670 30.3882 178.5941 43 I 3.6184 7.7355 120.9372 63.7722 36.7714 178.0551 44 R 3.8561 7.9841 119.4900 59.3395 30.1300 178.2400 45 A 4.1068 7.8794 120.0830 54.2197 18.3813 179.2864 46 M 3.9025 8.1758 117.6197 58.8462 32.4878 178.0125 47 I 3.7846 7.7493 118.6441 64.1197 37.8634 177.4815 48 D 4.4138 7.9148 122.1198 57.6123 40.9946 179.0764 49 K 3.7321 7.8069 123.8030 60.1698 31.5797 180.5483 50 I 4.0881 7.9974 121.8778 64.0985 37.7868 178.9524 51 S 4.1417 8.1344 122.1936 64.1545 62.0863 179.6961 52 D 4.6837 8.6442 124.8965 58.5511 39.5187 180.7031 53 N 4.6958 8.0008 116.1316 56.4932 38.5393 177.4365 54 V 3.7699 7.7870 119.6551 66.5494 31.0005 177.6276 55 D 4.3966 8.0705 117.7666 57.2168 40.5964 178.5393 56 A 4.3386 8.4188 123.6643 54.9130 18.8001 179.7732 57 V 4.0121 7.8036 116.6559 64.7448 31.4439 180.7156 58 K 4.5731 7.8377 126.1520 60.7542 32.3362 183.5912 59 K 4.0911 8.1434 125.5147 60.1758 31.4559 181.6370 60 K 4.0654 8.5430 123.1831 60.4314 31.6071 180.7362 61 H 4.3055 7.6288 118.1207 58.7932 29.9607 177.1379 62 S 4.3190 8.3312 116.4335 61.7813 62.5245 176.0246 63 D 4.3561 7.6558 121.5340 56.8530 40.6978 178.5826 64 I 4.0412 7.1208 118.7136 63.7346 37.6717 177.2574 65 L 4.2511 7.8596 124.7021 55.1907 40.2593 177.4229 66 S 5.5721 8.5435 131.3338 60.5767 61.3772 179.2987 *74 M 4.4807 7.2361 121.3314 54.3976 33.3148 179.8274 75 K 4.0994 8.0458 125.7524 60.1829 31.7853 181.7809 76 E 4.1243 8.0369 118.1133 61.1934 30.1056 181.1579 77 E 4.1899 8.3060 119.5135 59.1402 29.3996 179.4115 78 L 4.0474 8.1869 122.6570 58.8402 42.1142 179.4777 79 E 4.1716 7.6926 118.7522 61.3279 29.8162 181.2755 80 E 4.3413 8.2068 117.5086 61.6173 30.0413 183.2142 81 L 4.2148 7.7283 119.9463 58.1249 41.5123 179.5848 82 M 4.3974 8.3283 117.4867 57.5550 31.8266 178.3852 83 T 4.0502 7.7403 113.7405 64.4630 67.8178 175.9310 84 D 4.3860 8.0948 120.3791 57.8348 40.8233 178.9468 85 I 3.7417 7.7014 121.8126 64.9127 36.7705 179.3952 86 K 4.0448 7.5706 126.0435 60.6468 31.8579 181.8441 87 R 4.3684 8.3750 122.4983 60.7093 29.5503 180.6299 88 T 4.2030 8.7286 115.9805 66.6421 68.6454 176.3264 89 A 4.1921 7.8327 122.1163 55.6470 18.2622 179.5418 90 N 4.4687 8.4202 113.6246 56.3483 38.8284 176.8781 91 K 3.8120 8.2034 120.5262 59.8917 32.2437 178.2917 92 V 3.4903 7.9314 117.7381 66.2176 31.2313 178.0307 93 R 3.8269 8.4302 117.6037 57.7593 29.7495 177.9041 94 G 3.6260 8.2464 105.0896 47.2619 0.0000 176.0089 95 K 3.8666 7.9914 120.9260 58.8309 31.8856 179.2643 96 L 4.1783 7.8728 121.5773 58.2454 41.5117 180.0803 97 K 4.0082 7.4954 123.5918 59.9740 31.5577 180.6571 98 T 4.0727 8.0554 117.3554 66.8903 68.4310 176.2991 99 I 3.7284 7.5267 120.5445 64.6299 37.2760 177.8539 100 E 3.2914 8.8211 122.6937 59.8859 29.1782 179.7827 101 L 3.9504 8.0730 121.9218 59.3088 41.2629 180.5145 102 N 4.4089 8.1536 118.0583 56.5383 38.3077 177.0254 103 I 3.5494 7.3632 119.1666 64.6511 37.6033 177.6123 104 E 4.0951 8.2564 121.2213 60.4712 29.2120 180.5161 105 Q 4.0269 7.9301 119.0595 60.1230 28.3074 179.5528 106 E 4.4852 8.0462 118.8730 56.3950 29.2856 176.9870 107 E 4.1573 7.2548 116.6746 54.6721 30.5328 180.2347 *113 S 4.3112 8.2704 118.3849 57.2905 63.7572 172.1779 114 A 4.5953 8.2745 118.5076 53.8891 20.3882 178.3424 115 D 4.4139 8.0443 116.4840 56.9292 40.8951 178.6237 116 L 3.8665 7.8026 120.8886 58.1948 41.9518 178.6391 117 R 3.9268 8.0236 118.0649 59.5903 29.8295 178.0045 118 I 3.8081 7.8008 119.7022 64.6441 37.1465 177.8802 119 R 3.8258 7.6813 119.1824 60.3041 29.7089 179.4902 120 K 4.0004 7.9210 123.0956 60.7477 31.9633 180.9033 121 T 4.2594 7.7296 115.0838 66.6520 68.4328 176.5202 122 Q 4.1122 8.4940 119.7277 59.5571 29.0085 178.5608 123 Y 4.1423 8.8411 120.5565 61.0340 38.6242 178.4893 124 S 4.0421 8.3962 113.8518 61.9631 62.4761 175.6647 125 T 3.8801 8.1087 118.0462 66.1738 68.0465 176.2782 126 I 3.6063 7.9537 121.3294 64.7101 37.4066 178.0827 127 S 3.9707 7.8105 115.8679 61.9889 62.0614 177.1248 128 R 3.9663 8.4140 125.9430 62.1416 29.4211 181.3016 129 K 4.2101 8.2673 124.8294 59.1473 31.4922 180.6160 130 F 4.3345 7.8735 119.6798 61.9070 39.4251 177.4319 131 V 3.7389 8.0942 120.2072 66.6148 31.2397 178.5248 132 E 3.9225 8.5338 118.6046 61.0757 29.7743 182.9313 133 V 3.7500 7.5594 118.7831 66.2368 31.3370 178.0870 134 M 4.0292 8.0842 119.8539 58.5625 32.0312 179.0722 135 S 4.2677 8.5364 119.8968 63.0031 62.6919 181.2479 136 D 4.4768 8.0933 120.8724 56.8133 41.6858 178.6681 137 Y 3.9759 8.1232 122.5243 61.4995 38.6434 177.9584 138 N 4.4358 8.2240 120.0575 57.5757 36.9461 178.7514 139 T 3.9107 7.8883 115.0875 66.3716 67.4809 176.7494 140 T 3.8910 7.3809 117.2057 67.7530 68.4778 177.8692 141 Q 4.0380 7.5877 124.8094 59.1018 27.8545 180.5110 142 I 4.0561 6.8989 123.3904 64.2158 36.5354 178.9547 143 D 4.2979 7.4543 125.7756 52.6885 39.6082 175.3700 144 Y 3.8906 5.4350 122.7181 55.0987 38.9656 176.8637 145 R 4.0056 8.3533 122.1945 58.1491 29.7762 175.2390 146 D 4.7656 8.1730 121.0873 54.4428 38.3896 174.5621 147 R 3.5649 7.0250 116.0463 54.4254 29.2582 175.8187 148 C 4.4025 8.7006 121.5349 60.8932 29.3607 175.0035 149 K 3.7884 8.1354 119.7383 54.4876 31.5447 181.1066 150 A 4.1984 8.8520 127.2847 52.5562 19.0224 178.5652 151 R 4.1078 8.0425 116.3701 56.0571 29.3458 176.7743 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 31 G 8.20 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 32 F 7.68 4.22 0.00 3.36 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 33 M 7.34 4.13 0.00 1.93 1.72 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.55 0.00 34 E 8.09 4.15 0.00 2.02 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 2.40 2.43 0.00 35 E 7.85 4.08 0.00 2.14 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 2.24 2.18 0.00 36 F 8.03 4.15 0.00 3.06 3.08 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 37 F 7.99 4.29 0.00 3.23 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 38 E 7.94 4.06 0.00 2.12 1.92 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 2.28 2.24 0.00 39 Q 8.17 4.29 0.00 2.06 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.78 0.00 0.00 0.00 0.00 0.00 2.29 2.23 0.00 40 V 7.26 3.66 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 0.95 0.00 0.00 0.22 0.00 0.00 41 E 8.82 4.22 0.00 1.97 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 2.24 2.19 0.00 42 E 7.88 4.27 0.00 2.19 2.44 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 2.33 2.31 0.00 43 I 7.74 3.62 1.96 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 1.43 0.54 0.82 0.00 0.00 44 R 7.98 3.86 0.00 2.08 1.90 0.00 3.25 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.79 0.00 45 A 7.88 4.11 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 46 M 8.18 3.90 0.00 2.11 2.24 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.55 0.00 47 I 7.75 3.78 2.19 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.46 0.98 0.00 0.00 48 D 7.91 4.41 0.00 2.75 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 49 K 7.81 3.73 0.00 1.76 1.84 0.00 1.80 0.00 0.00 1.57 0.00 0.00 2.81 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.38 1.34 7.81 50 I 8.00 4.09 1.84 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 1.03 1.05 0.00 0.00 51 S 8.13 4.14 0.00 3.80 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 52 D 8.64 4.68 0.00 2.69 2.66 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 53 N 8.00 4.70 0.00 3.04 2.91 0.00 0.00 6.54 7.03 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 54 V 7.79 3.77 2.17 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 1.17 0.00 0.00 1.18 0.00 0.00 55 D 8.07 4.40 0.00 3.00 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 56 A 8.42 4.34 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 57 V 7.80 4.01 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 0.81 0.00 0.00 0.93 0.00 0.00 58 K 7.84 4.57 0.00 1.70 1.77 0.00 1.80 0.00 0.00 1.68 0.00 0.00 2.90 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.30 1.30 7.81 59 K 8.14 4.09 0.00 1.79 1.78 0.00 1.81 0.00 0.00 1.68 0.00 0.00 2.91 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.38 1.35 7.81 60 K 8.54 4.07 0.00 1.76 1.89 0.00 1.78 0.00 0.00 1.57 0.00 0.00 2.85 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.39 1.36 7.81 61 H 7.63 4.31 0.00 3.16 3.50 0.00 5.74 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 S 8.33 4.32 0.00 4.10 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 63 D 7.66 4.36 0.00 2.66 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 64 I 7.12 4.04 2.00 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 1.49 0.43 0.83 0.00 0.00 65 L 7.86 4.25 0.00 1.76 1.65 0.99 1.00 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 S 8.54 5.57 0.00 4.04 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 *74 M 7.24 4.48 0.00 1.99 2.11 0.00 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.11 0.00 75 K 8.05 4.10 0.00 1.75 1.86 0.00 1.75 0.00 0.00 1.85 0.00 0.00 2.96 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.45 1.09 7.81 76 E 8.04 4.12 0.00 1.97 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 2.31 1.96 0.00 77 E 8.31 4.19 0.00 2.13 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 2.41 2.47 0.00 78 L 8.19 4.05 0.00 1.85 1.66 0.97 0.78 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 79 E 7.69 4.17 0.00 2.10 1.86 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 2.26 2.20 0.00 80 E 8.21 4.34 0.00 1.99 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 2.24 2.22 0.00 81 L 7.73 4.21 0.00 1.93 1.83 0.98 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 82 M 8.33 4.40 0.00 2.21 2.18 0.00 0.00 0.00 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.89 2.71 0.00 83 T 7.74 4.05 4.49 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 0.00 0.00 0.00 1.27 0.00 0.00 84 D 8.09 4.39 0.00 2.90 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 85 I 7.70 3.74 1.66 0.00 0.00 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 1.27 1.37 0.04 0.00 0.00 86 K 7.57 4.04 0.00 1.85 1.72 0.00 1.80 0.00 0.00 1.74 0.00 0.00 3.00 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.39 1.32 7.81 87 R 8.38 4.37 0.00 1.79 1.88 0.00 3.27 0.00 0.00 3.17 7.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.53 0.00 88 T 8.73 4.20 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 1.22 0.00 0.00 89 A 7.83 4.19 1.49 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 0.00 0.00 0.00 0.00 0.00 0.00 90 N 8.42 4.47 0.00 2.80 2.90 0.00 0.00 7.06 7.63 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 91 K 8.20 3.81 0.00 1.81 1.97 0.00 1.73 0.00 0.00 1.74 0.00 0.00 2.88 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.49 1.50 7.81 92 V 7.93 3.49 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 0.36 0.00 0.00 0.98 0.00 0.00 93 R 8.43 3.83 0.00 1.91 1.99 0.00 3.26 0.00 0.00 3.25 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.57 0.00 94 G 8.25 3.63 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 0.00 0.00 0.00 95 K 7.99 3.87 0.00 1.74 1.85 0.00 1.63 0.00 0.00 1.91 0.00 0.00 2.94 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.50 1.67 7.81 96 L 7.87 4.18 0.00 1.86 1.78 0.59 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 97 K 7.50 4.01 0.00 1.68 1.82 0.00 1.84 0.00 0.00 1.65 0.00 0.00 2.86 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.37 1.35 7.81 98 T 8.06 4.07 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 1.22 0.00 0.00 99 I 7.53 3.73 2.19 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 1.56 0.72 1.21 0.00 0.00 100 E 8.82 3.29 0.00 1.64 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 2.24 2.15 0.00 101 L 8.07 3.95 0.00 1.68 1.64 0.92 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 102 N 8.15 4.41 0.00 2.75 2.90 0.00 0.00 7.10 7.75 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 0.00 103 I 7.36 3.55 1.92 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 1.40 0.37 0.79 0.00 0.00 104 E 8.26 4.10 0.00 2.22 1.95 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 2.28 2.26 0.00 105 Q 7.93 4.03 0.00 2.15 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 7.21 0.00 0.00 0.00 0.00 0.00 2.31 2.27 0.00 106 E 8.05 4.49 0.00 2.02 1.86 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 2.21 2.35 0.00 107 E 7.25 4.16 0.00 2.02 1.74 0.00 0.00 0.00 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 2.11 0.00 *113 S 8.27 4.31 0.00 3.82 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 0.00 114 A 8.27 4.60 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 0.00 115 D 8.04 4.41 0.00 2.81 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 0.00 116 L 7.80 3.87 0.00 1.68 1.61 0.83 0.83 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 0.00 117 R 8.02 3.93 0.00 1.96 2.07 0.00 3.30 0.00 0.00 3.35 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.82 0.00 118 I 7.80 3.81 2.08 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.65 1.24 0.00 0.00 119 R 7.68 3.83 0.00 1.73 1.53 0.00 2.55 0.00 0.00 2.25 7.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.25 0.00 120 K 7.92 4.00 0.00 1.88 1.77 0.00 1.81 0.00 0.00 1.70 0.00 0.00 3.00 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.41 1.40 7.81 121 T 7.73 4.26 4.62 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 1.30 0.00 0.00 122 Q 8.49 4.11 0.00 2.57 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.73 0.00 0.00 0.00 0.00 0.00 2.62 2.97 0.00 123 Y 8.84 4.14 0.00 3.16 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 0.00 124 S 8.40 4.04 0.00 4.05 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 0.00 125 T 8.11 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 1.23 0.00 0.00 126 I 7.95 3.61 2.03 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 1.41 1.06 0.77 0.00 0.00 127 S 7.81 3.97 0.00 3.19 3.70 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 0.00 128 R 8.41 3.97 0.00 1.83 1.92 0.00 3.34 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.51 0.00 129 K 8.27 4.21 0.00 1.74 1.87 0.00 1.77 0.00 0.00 1.57 0.00 0.00 2.83 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.38 1.34 7.81 130 F 7.87 4.33 0.00 3.11 3.30 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 0.00 131 V 8.09 3.74 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 1.00 0.00 0.00 1.09 0.00 0.00 132 E 8.53 3.92 0.00 1.99 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 2.24 2.18 0.00 133 V 7.56 3.75 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 0.91 0.00 0.00 0.93 0.00 0.00 134 M 8.08 4.03 0.00 1.69 1.68 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.03 0.00 135 S 8.54 4.27 0.00 3.73 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 0.00 136 D 8.09 4.48 0.00 2.95 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 0.00 137 Y 8.12 3.98 0.00 3.16 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 0.00 138 N 8.22 4.44 0.00 2.80 2.84 0.00 0.00 6.77 7.20 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 0.00 139 T 7.89 3.91 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 1.22 0.00 0.00 140 T 7.38 3.89 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 1.21 0.00 0.00 141 Q 7.59 4.04 0.00 2.16 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.80 6.82 0.00 0.00 0.00 0.00 0.00 2.31 2.25 0.00 142 I 6.90 4.06 1.87 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 1.52 1.09 0.91 0.00 0.00 143 D 7.45 4.30 0.00 2.54 2.52 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 0.00 144 Y 5.44 3.89 0.00 3.10 2.88 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 0.00 145 R 8.35 4.01 0.00 1.83 1.74 0.00 3.31 0.00 0.00 3.22 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.24 0.00 146 D 8.17 4.77 0.00 2.87 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 0.00 147 R 7.03 3.56 0.00 1.87 1.91 0.00 3.34 0.00 0.00 3.27 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.81 0.00 148 C 8.70 4.40 0.00 2.96 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 0.00 149 K 8.14 3.79 0.00 1.77 1.64 0.00 1.82 0.00 0.00 1.71 0.00 0.00 2.97 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.37 1.05 7.81 150 A 8.85 4.20 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 0.00 151 R 8.04 4.11 0.00 1.85 1.69 0.00 3.30 0.00 0.00 3.26 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.26 0.00 * Residues marked with a * may have inaccurate shift predictions.