NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 P 4.2892 0.0000 0.0000 62.7286 32.6235 174.8048 2 Q 4.1677 8.4520 119.4934 53.6545 29.3371 169.1870 3 V 4.1653 8.1092 126.2740 61.4494 33.4350 175.2968 4 T 4.4353 8.3757 117.6407 61.2620 68.7594 174.0204 5 L 4.6834 7.7682 117.7926 54.2902 42.3196 179.1383 6 W 4.1917 8.0700 121.4796 58.6973 29.2877 176.4701 7 Q 4.6860 7.3531 113.3119 53.5296 30.9761 175.2596 8 R 3.7759 8.6839 118.6790 56.5441 30.5735 174.9386 9 P 4.5486 0.0000 0.0000 62.5754 31.6200 175.0640 10 L 5.3686 8.3194 124.9774 53.3077 44.5998 176.1159 11 V 4.5814 8.1705 118.4421 60.7306 35.2590 173.7965 12 T 4.9273 8.4712 118.8515 62.7732 69.6502 174.2122 13 I 4.8220 8.6815 119.2182 58.9689 41.0002 174.1244 14 K 5.1067 9.1059 125.5484 54.8302 35.3666 175.3991 15 I 4.2095 9.1173 120.9138 60.0043 39.9316 174.9532 16 G 3.9886 9.2440 119.2787 46.6980 0.0000 173.0382 17 G 3.9039 8.1189 102.0180 45.8048 0.0000 172.8928 18 Q 4.6671 7.6245 118.1854 53.7689 31.2236 174.1922 19 L 5.0800 8.2884 120.7511 53.2845 43.5747 175.8002 20 K 4.7783 9.3608 122.1987 54.7891 37.0537 174.5636 21 E 5.2526 8.6871 119.2411 54.9629 32.3833 175.7793 22 A 4.8381 8.8338 123.3236 50.4910 23.4368 175.2411 23 L 4.6409 8.9546 120.4879 54.2125 43.4442 176.2585 24 L 4.5837 8.6413 124.1776 53.9110 42.6281 175.8589 25 D 4.8935 9.3018 125.1286 52.6003 43.2098 176.4775 26 T 4.1312 8.8577 116.4632 63.1343 69.4156 175.4448 27 G 3.7852 8.0889 109.9621 45.4098 0.0000 173.1451 28 A 4.6512 7.5457 123.8869 50.4842 20.7180 177.4730 29 D 4.5041 8.6003 122.5314 55.9566 42.2825 175.9572 30 D 5.0536 7.8380 116.7948 52.4008 44.3011 175.8871 31 T 4.3463 8.1449 118.8414 63.4349 70.0984 173.8874 32 V 4.6313 8.7827 125.4296 61.0790 34.9672 173.9652 33 L 5.0976 8.4879 127.3237 52.4848 44.1897 175.9137 34 E 4.9685 9.1360 123.8664 55.7614 31.0871 175.5869 35 E 3.9065 7.5324 122.4277 56.4091 29.8301 177.0397 36 M 4.5733 7.9283 121.0635 54.2088 35.9253 174.8845 37 S 4.3129 8.4953 118.2426 58.2685 62.6578 173.7241 38 L 4.6132 7.9710 125.4592 51.7938 43.9727 174.6157 39 P 4.5870 0.0000 0.0000 60.7160 32.2106 176.2006 40 G 4.2182 9.5173 111.1711 46.1097 0.0000 170.6456 41 R 3.6137 8.8879 115.1862 55.1964 26.1491 175.0237 42 W 5.0767 6.6735 118.3877 55.9171 31.4047 174.9803 43 K 4.6180 8.9678 121.2005 54.5801 35.1879 173.8029 44 P 5.2577 0.0000 0.0000 62.7660 33.0022 174.6941 45 K 4.4947 8.3050 118.1946 56.1492 36.1728 173.4232 46 M 5.4646 8.8482 123.5348 53.6288 35.3617 174.9063 47 I 4.3808 8.8419 116.0096 59.0615 41.2624 174.4539 48 G 3.6171 7.9859 109.2797 44.4828 0.0000 173.7632 49 G 3.8669 8.5461 111.2554 44.3765 0.0000 172.0956 50 I 3.8612 8.5268 123.6833 60.9257 38.8656 176.9445 51 G 3.9151 9.2255 118.4867 45.4278 0.0000 171.5743 52 G 4.4729 7.1418 104.5524 43.6146 0.0000 171.1446 53 F 5.0284 8.4395 120.1101 55.9563 40.5522 175.4996 54 I 4.7184 8.3803 115.5726 58.8963 40.8993 174.5814 55 K 4.8881 8.6685 123.9662 56.2219 32.9098 176.5872 56 V 4.6817 9.3975 124.0467 60.1059 35.6765 174.2992 57 R 5.0490 8.8390 119.8499 54.4427 33.6037 174.7463 58 Q 4.7180 9.6955 125.6658 55.2441 30.6794 173.7807 59 Y 4.9126 8.9584 124.8624 56.7761 40.1256 174.6957 60 D 5.2289 8.6282 121.9557 52.9324 44.5357 175.2578 61 Q 3.5466 8.6172 116.2806 57.2568 25.9335 173.9123 62 I 4.1987 7.8784 119.4004 60.0155 38.6462 175.6374 63 L 4.2951 8.6694 130.1131 55.4750 42.5489 175.6653 64 I 4.6274 8.7719 127.3795 59.1319 41.0365 173.7884 65 E 4.9008 9.1567 129.5297 54.5118 31.8766 175.8102 66 I 4.6004 8.8444 127.8808 61.5037 37.8775 176.9342 *68 G 3.7815 7.9355 107.7247 45.5690 0.0000 172.7604 69 H 4.7738 8.3897 117.2110 53.4322 31.1488 173.0406 70 K 4.9970 8.5939 123.9274 55.6502 33.3352 176.0038 71 A 4.7568 8.6689 124.2619 50.9555 23.2567 174.8272 72 I 4.9127 7.4906 117.5111 58.9057 41.3747 175.0813 73 G 4.1361 7.9977 113.4135 46.4172 0.0000 171.2528 74 T 5.1212 8.6380 117.5944 63.0971 69.1557 174.8579 75 V 4.5880 8.5891 119.0520 59.4913 35.6038 174.3426 76 L 5.3622 8.2973 123.0251 53.2024 44.2777 176.0255 77 V 4.8816 8.4389 116.9470 59.8135 35.2026 175.1984 78 G 4.1049 8.2750 109.4235 45.7469 0.0000 171.6171 79 P 5.1878 0.0000 0.0000 60.6115 29.9222 174.5703 80 T 4.5246 7.3625 118.3039 60.3413 69.4518 172.7229 81 P 4.4332 0.0000 0.0000 65.2140 31.6526 177.3958 82 V 4.4895 7.1912 114.9539 60.0210 34.5913 173.8604 83 N 4.8928 8.5833 120.1329 53.2614 40.2736 174.0981 84 I 4.9653 8.6330 122.2810 59.7830 42.1253 174.1490 85 I 4.4924 8.8524 127.9054 59.9860 39.2302 175.2529 86 G 4.5284 7.8924 119.2836 44.4655 0.0000 173.2358 87 R 4.0612 8.5152 117.5642 58.0365 30.4199 178.4618 88 N 4.3621 7.7248 115.3430 55.1315 37.3298 176.2112 89 L 4.5392 7.7451 117.5113 55.8204 43.2476 178.3700 90 L 3.9901 8.1216 119.3856 57.9100 41.6806 179.4823 91 T 3.9469 7.9908 109.2174 64.2292 68.4120 176.3836 92 Q 4.2189 8.0452 120.8265 58.3641 29.1640 177.6427 93 I 3.9842 7.6792 118.8833 61.8482 37.3675 176.0813 94 G 3.7464 7.5619 106.2613 46.3046 0.0000 173.8753 95 A 4.2921 8.0620 121.9240 51.7871 19.2092 178.2077 96 T 4.6895 8.0955 115.9179 61.5842 72.3642 173.2847 97 L 4.7365 8.4397 126.1369 53.2889 43.9705 175.2739 98 N 5.0993 8.7070 122.2333 51.3965 41.5359 174.4033 99 F 4.4750 8.2240 116.9764 57.1520 37.9647 174.1458 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 P 0.00 4.29 0.00 2.21 2.18 0.00 3.74 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.98 0.00 2 Q 8.45 4.17 0.00 2.13 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.91 6.77 0.00 0.00 0.00 0.00 0.00 2.30 2.44 0.00 3 V 8.11 4.17 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 0.91 0.00 0.00 0.94 0.00 0.00 4 T 8.38 4.44 4.55 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 1.37 0.00 0.00 5 L 7.77 4.68 0.00 1.38 1.43 0.83 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 6 W 8.07 4.19 0.00 3.41 3.43 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 7 Q 7.35 4.69 0.00 2.15 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.59 6.89 0.00 0.00 0.00 0.00 0.00 2.29 2.49 0.00 8 R 8.68 3.78 0.00 1.82 1.93 0.00 3.35 0.00 0.00 3.25 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.59 0.00 9 P 0.00 4.55 0.00 2.10 2.22 0.00 3.63 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 1.96 0.00 10 L 8.32 5.37 0.00 1.53 1.60 0.92 0.90 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 11 V 8.17 4.58 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 0.72 0.00 0.00 0.92 0.00 0.00 12 T 8.47 4.93 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 13 I 8.68 4.82 1.86 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.93 0.90 0.00 0.00 14 K 9.11 5.11 0.00 1.78 1.65 0.00 1.65 0.00 0.00 1.69 0.00 0.00 2.89 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.31 1.44 7.81 15 I 9.12 4.21 1.82 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.19 0.88 0.00 0.00 16 G 9.24 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 17 G 8.12 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 18 Q 7.62 4.67 0.00 2.32 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 7.07 0.00 0.00 0.00 0.00 0.00 2.25 2.26 0.00 19 L 8.29 5.08 0.00 1.48 1.57 0.91 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 20 K 9.36 4.78 0.00 1.58 1.65 0.00 1.57 0.00 0.00 1.61 0.00 0.00 2.79 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.32 1.36 7.81 21 E 8.69 5.25 0.00 1.80 1.81 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 2.19 2.26 0.00 22 A 8.83 4.84 1.17 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 23 L 8.95 4.64 0.00 1.75 1.57 0.90 0.65 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 24 L 8.64 4.58 0.00 1.49 1.60 0.91 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 25 D 9.30 4.89 0.00 2.60 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 26 T 8.86 4.13 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 1.20 0.00 0.00 27 G 8.09 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 28 A 7.55 4.65 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 29 D 8.60 4.50 0.00 2.60 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 30 D 7.84 5.05 0.00 2.49 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 31 T 8.14 4.35 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 1.28 0.00 0.00 32 V 8.78 4.63 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 1.00 0.00 0.00 0.90 0.00 0.00 33 L 8.49 5.10 0.00 1.63 1.46 0.90 0.43 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 34 E 9.14 4.97 0.00 2.14 1.78 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 2.47 2.26 0.00 35 E 7.53 3.91 0.00 1.86 1.83 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 2.31 2.44 0.00 36 M 7.93 4.57 0.00 1.84 1.77 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.48 0.00 37 S 8.50 4.31 0.00 3.83 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 38 L 7.97 4.61 0.00 0.44 0.84 0.33 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 39 P 0.00 4.59 0.00 2.24 2.10 0.00 3.86 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.96 0.00 40 G 9.52 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 0.00 0.00 0.00 0.00 41 R 8.89 3.61 0.00 2.07 2.15 0.00 3.27 0.00 0.00 3.38 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.83 0.00 42 W 6.67 5.08 0.00 2.96 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 0.00 0.00 0.00 43 K 8.97 4.62 0.00 1.84 1.89 0.00 1.29 0.00 0.00 1.65 0.00 0.00 2.87 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.47 1.38 7.81 44 P 0.00 5.26 0.00 2.24 2.42 0.00 3.82 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 2.05 2.04 0.00 45 K 8.31 4.49 0.00 1.90 1.67 0.00 1.60 0.00 0.00 1.67 0.00 0.00 2.80 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.30 1.39 7.81 46 M 8.85 5.46 0.00 2.33 2.14 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.67 0.00 47 I 8.84 4.38 1.74 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 1.11 0.84 0.87 0.00 0.00 48 G 7.99 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 49 G 8.55 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 50 I 8.53 3.86 1.85 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.85 0.90 0.00 0.00 51 G 9.23 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 52 G 7.14 4.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.44 5.03 0.00 2.91 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 54 I 8.38 4.72 1.88 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 1.26 0.92 0.00 0.00 55 K 8.67 4.89 0.00 1.70 1.82 0.00 1.77 0.00 0.00 1.82 0.00 0.00 2.98 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.50 1.42 7.81 56 V 9.40 4.68 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 0.79 0.00 0.00 0.96 0.00 0.00 57 R 8.84 5.05 0.00 1.38 1.61 0.00 2.21 0.00 0.00 2.25 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 1.14 0.00 58 Q 9.70 4.72 0.00 2.12 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 7.34 0.00 0.00 0.00 0.00 0.00 2.48 2.39 0.00 59 Y 8.96 4.91 0.00 3.24 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 60 D 8.63 5.23 0.00 2.55 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 Q 8.62 3.55 0.00 2.25 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.91 0.00 0.00 0.00 0.00 0.00 2.28 2.33 0.00 62 I 7.88 4.20 1.89 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 1.11 0.87 0.00 0.00 63 L 8.67 4.30 0.00 1.66 1.60 0.92 1.07 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 64 I 8.77 4.63 1.87 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 1.11 1.28 0.96 0.00 0.00 65 E 9.16 4.90 0.00 2.04 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 2.19 2.26 0.00 66 I 8.84 4.60 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 1.22 0.86 0.88 0.00 0.00 *68 G 7.94 3.78 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 69 H 8.39 4.77 0.00 3.32 3.22 0.00 5.61 0.00 0.00 0.00 0.00 6.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 K 8.59 5.00 0.00 1.64 1.73 0.00 1.75 0.00 0.00 1.71 0.00 0.00 2.85 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.40 1.44 7.81 71 A 8.67 4.76 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 72 I 7.49 4.91 1.88 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 1.13 2.01 0.92 0.00 0.00 73 G 8.00 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 0.00 0.00 0.00 74 T 8.64 5.12 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 1.34 0.00 0.00 75 V 8.59 4.59 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 0.87 0.00 0.00 0.91 0.00 0.00 76 L 8.30 5.36 0.00 1.75 1.56 0.96 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 77 V 8.44 4.88 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 0.66 0.00 0.00 0.85 0.00 0.00 78 G 8.27 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 79 P 0.00 5.19 0.00 2.17 2.07 0.00 3.34 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.89 0.00 80 T 7.36 4.52 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 81 P 0.00 4.43 0.00 2.06 2.09 0.00 3.70 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 2.01 2.06 0.00 82 V 7.19 4.49 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 0.64 0.00 0.00 0.92 0.00 0.00 83 N 8.58 4.89 0.00 2.65 2.74 0.00 0.00 6.84 8.03 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 84 I 8.63 4.97 1.85 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.85 0.95 0.00 0.00 85 I 8.85 4.49 1.85 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 1.26 0.91 0.90 0.00 0.00 86 G 7.89 4.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.52 4.06 0.00 1.87 1.98 0.00 3.14 0.00 0.00 3.31 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.78 0.00 88 N 7.72 4.36 0.00 2.80 2.98 0.00 0.00 6.99 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 89 L 7.75 4.54 0.00 1.72 1.71 0.93 0.67 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 90 L 8.12 3.99 0.00 1.67 1.71 1.00 0.52 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 91 T 7.99 3.95 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 1.28 0.00 0.00 92 Q 8.05 4.22 0.00 2.16 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 7.24 0.00 0.00 0.00 0.00 0.00 2.38 2.40 0.00 93 I 7.68 3.98 1.97 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 1.50 0.21 0.81 0.00 0.00 94 G 7.56 3.75 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 0.00 0.00 0.00 95 A 8.06 4.29 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 96 T 8.10 4.69 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 1.25 0.00 0.00 97 L 8.44 4.74 0.00 1.61 1.61 0.90 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 98 N 8.71 5.10 0.00 2.71 2.69 0.00 0.00 6.74 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 99 F 8.22 4.48 0.00 3.18 2.96 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 * Residues marked with a * may have inaccurate shift predictions.