NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 L 4.3301 8.0276 120.6291 54.6946 40.6904 175.2845 2 K 4.6594 7.1833 121.5738 54.8952 36.1394 174.8942 3 G 3.9503 9.2327 108.7278 44.0464 0.0000 173.0984 4 L 4.0903 8.2837 117.0317 56.1626 41.8970 178.3752 5 R 5.1033 9.8997 122.9442 56.5165 33.2328 176.2196 6 R 5.2079 7.6978 117.4545 55.0121 33.9285 173.8465 7 L 5.2197 9.1640 125.2270 52.9132 46.2324 175.7756 8 V 4.7619 8.5599 122.4588 61.3915 33.9408 173.8773 9 L 5.0807 9.1800 129.2775 53.1341 44.0990 175.4541 10 D 4.9891 8.9912 124.2733 53.3483 42.3499 175.0912 11 V 4.8529 8.8988 126.6813 60.9395 34.9911 173.7249 12 L 5.1172 8.3933 129.4547 53.3135 44.4059 175.0784 13 K 5.0517 8.8427 124.1188 54.7900 36.1681 173.6449 14 P 4.7334 0.0000 0.0000 62.4132 31.8339 175.6550 15 H 4.2942 8.6438 118.6053 58.7585 29.0904 175.3488 16 E 4.6680 8.0336 115.8048 53.6469 31.2969 174.0922 17 P 4.6540 0.0000 0.0000 61.8253 32.8462 175.9227 18 K 4.3159 8.3440 117.5786 56.0216 32.7418 178.5865 19 T 3.8748 8.4967 111.9575 65.0941 68.4475 176.4793 20 I 3.7076 7.8432 122.2683 64.4043 37.2596 178.2776 21 V 3.6411 7.9363 118.9297 65.8999 31.4089 178.0359 22 F 3.9197 8.4395 116.8812 60.4399 38.8139 177.1036 23 A 4.0306 8.4600 120.5802 56.0508 18.2271 178.8297 24 L 3.8398 7.8675 117.3064 57.1033 41.3839 179.7190 25 K 3.8453 8.0218 119.8024 60.0901 32.8856 178.8795 26 L 4.1392 7.8898 118.9034 57.8604 41.6718 179.8224 27 S 4.3548 8.5658 114.3796 60.7027 62.6449 174.9788 28 E 4.4240 7.7460 121.2214 55.4449 30.4436 175.5290 29 L 4.6940 6.9133 118.3983 52.5946 43.6838 176.5029 30 E 4.2373 8.4390 121.7398 57.8519 30.1105 177.5016 31 N 4.5033 8.8161 115.8065 53.5038 36.8449 174.0883 32 V 4.5967 7.2697 117.9382 61.2105 32.1291 174.8868 33 D 4.5525 8.9293 128.9478 57.1920 41.4986 177.0186 34 G 4.1270 7.5042 102.2454 45.6549 0.0000 172.6741 35 V 5.0671 8.4081 119.6780 60.8785 34.9099 173.8867 36 N 5.0165 9.4692 126.1697 51.8250 41.5600 172.8732 37 I 4.7422 8.4958 126.7577 59.9660 39.4670 174.2310 38 H 4.7149 9.3853 128.6093 54.3148 31.5781 173.5894 39 L 4.2557 8.2332 128.4690 55.2572 41.8678 176.3164 40 S 4.4480 8.7173 123.5006 60.5333 63.2806 174.2973 41 E 4.7104 7.8153 118.8594 55.1554 32.9756 173.2278 42 I 4.6947 8.3318 126.5812 59.8900 39.3296 174.9045 43 D 4.9590 8.6943 123.6322 52.9068 44.3428 174.6022 44 Q 4.0656 8.6520 118.3427 57.5459 29.0401 176.1693 45 A 3.5768 8.9738 122.1158 53.2267 17.4373 175.5996 46 T 4.7048 7.7971 109.2909 60.2154 71.6796 172.1639 47 E 5.0746 8.8029 124.8269 54.9363 33.7379 173.3145 48 N 5.5139 9.4505 124.4556 51.7403 41.3450 173.8743 49 I 4.9181 8.6247 114.9516 59.7331 41.8574 173.3889 50 K 5.0423 9.0754 123.2196 54.8127 34.7290 175.1774 51 I 4.8679 8.9853 126.1241 59.8903 39.9551 174.6043 52 T 4.9138 9.3825 125.2966 62.0638 70.5072 173.5561 53 I 4.7579 9.1111 128.3649 59.2816 40.0321 174.4055 54 L 5.0218 8.3469 129.4717 53.4346 44.5104 175.4024 55 G 5.0066 9.2762 112.0140 46.7726 0.0000 171.2134 56 N 5.0782 8.7938 117.9254 52.1700 38.9615 173.8479 57 N 4.0603 8.1604 120.7441 54.0144 37.2017 172.4371 58 L 4.6217 8.3337 122.1019 52.6726 44.1048 177.0190 59 D 4.7269 8.2708 121.2430 52.8206 41.7475 176.4142 60 Y 4.1170 8.5262 127.7533 60.9876 38.9414 177.3545 61 E 3.5136 8.3893 118.7364 59.8040 29.5318 179.3747 62 Q 3.9240 8.1071 118.7268 58.8960 29.3609 177.8626 63 I 3.5967 7.8134 121.1701 64.3809 37.2487 178.0543 64 K 3.7245 8.3282 121.4056 59.5275 31.7440 178.8079 65 G 3.4514 7.8105 105.7323 47.7755 0.0000 175.5646 66 V 3.5128 7.5304 120.3979 65.6160 31.6352 177.8784 67 I 3.7922 7.5548 118.8421 64.5651 36.7640 178.3902 68 E 4.4296 7.8006 119.3889 58.5675 29.3659 179.9235 69 D 4.5704 7.9394 119.0979 54.0924 40.9846 177.8133 *71 G 3.9915 8.2274 110.2080 45.3761 0.0000 174.4337 72 G 4.0725 7.9103 107.0406 46.5005 0.0000 172.9524 73 V 4.6310 8.5321 119.3217 61.1588 35.5009 174.2264 74 I 4.4605 8.4656 128.5062 61.1192 36.6910 175.3548 75 H 4.6674 9.2198 126.5500 58.7118 29.2454 176.1949 76 S 4.5536 7.8763 109.8385 57.5728 66.1193 174.5386 77 V 4.3905 8.2575 121.7471 61.6887 31.0140 175.0600 78 D 4.5698 8.7781 127.6023 56.6391 41.3427 176.6179 79 E 4.7840 8.0691 117.8118 54.3086 33.6058 174.2898 80 V 4.8465 8.2889 123.9151 61.2238 34.7402 174.3122 81 V 4.4917 8.9572 127.3877 61.0738 33.9329 174.0034 82 A 4.7929 9.0203 128.7349 51.0369 22.2498 174.8179 83 G 3.7239 7.8893 105.4023 44.5173 0.0000 174.5605 84 K 4.4301 8.6760 118.1530 58.2923 32.5802 177.2467 85 I 4.3189 7.3317 117.4371 59.4441 38.7799 175.9380 86 I 3.8912 8.1283 124.9608 60.8218 36.1965 175.6799 87 V 4.0303 8.0730 126.1526 61.4019 31.8813 175.6731 88 E 4.2732 8.4840 126.9843 55.5596 30.3297 176.4773 89 S 4.1970 8.3514 116.6760 58.1779 63.1451 174.3152 90 V 3.8034 8.3149 125.9827 63.2101 31.3034 175.4302 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 L 8.03 4.33 0.00 1.73 1.72 0.92 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 2 K 7.18 4.66 0.00 1.95 1.87 0.00 1.74 0.00 0.00 1.78 0.00 0.00 2.96 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.39 1.46 7.81 3 G 9.23 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 4 L 8.28 4.09 0.00 1.77 1.68 1.02 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 5 R 9.90 5.10 0.00 1.69 1.93 0.00 3.30 0.00 0.00 3.32 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.57 0.00 6 R 7.70 5.21 0.00 1.85 1.71 0.00 3.12 0.00 0.00 3.34 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.84 0.00 7 L 9.16 5.22 0.00 1.64 1.56 1.15 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 8 V 8.56 4.76 2.18 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 0.99 0.00 0.00 0.99 0.00 0.00 9 L 9.18 5.08 0.00 1.65 1.63 1.03 1.23 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 10 D 8.99 4.99 0.00 2.94 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 11 V 8.90 4.85 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 0.99 0.00 0.00 0.97 0.00 0.00 12 L 8.39 5.12 0.00 1.51 1.23 0.94 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 13 K 8.84 5.05 0.00 1.70 1.64 0.00 0.61 0.00 0.00 1.21 0.00 0.00 2.68 0.00 0.00 2.31 0.00 0.00 0.00 0.00 1.08 1.21 7.81 14 P 0.00 4.73 0.00 2.10 2.07 0.00 3.46 0.00 0.00 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 1.86 0.00 15 H 8.64 4.29 0.00 3.07 3.42 0.00 5.67 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 E 8.03 4.67 0.00 1.97 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 2.26 2.24 0.00 17 P 0.00 4.65 0.00 2.28 2.13 0.00 4.01 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 2.36 2.01 0.00 18 K 8.34 4.32 0.00 1.86 1.79 0.00 1.70 0.00 0.00 1.90 0.00 0.00 3.37 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.56 1.39 7.81 19 T 8.50 3.87 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 1.11 0.00 0.00 20 I 7.84 3.71 1.90 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 1.54 1.01 0.93 0.00 0.00 21 V 7.94 3.64 2.32 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 1.00 0.00 0.00 0.98 0.00 0.00 22 F 8.44 3.92 0.00 3.28 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 A 8.46 4.03 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.87 3.84 0.00 1.93 1.66 0.93 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 25 K 8.02 3.85 0.00 1.63 1.83 0.00 1.66 0.00 0.00 1.65 0.00 0.00 3.12 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.37 1.50 7.81 26 L 7.89 4.14 0.00 2.01 1.75 1.02 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 27 S 8.57 4.35 0.00 4.02 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 0.00 28 E 7.75 4.42 0.00 2.09 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 2.30 2.45 0.00 29 L 6.91 4.69 0.00 1.78 1.54 0.91 0.88 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 30 E 8.44 4.24 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 2.31 2.28 0.00 31 N 8.82 4.50 0.00 2.94 3.33 0.00 0.00 6.33 7.68 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 32 V 7.27 4.60 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 0.88 0.00 0.00 1.02 0.00 0.00 33 D 8.93 4.55 0.00 2.62 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 34 G 7.50 4.13 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 0.00 0.00 0.00 35 V 8.41 5.07 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 0.90 0.00 0.00 0.96 0.00 0.00 36 N 9.47 5.02 0.00 2.74 2.64 0.00 0.00 6.79 7.82 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 37 I 8.50 4.74 1.88 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.82 0.87 0.00 0.00 38 H 9.39 4.71 0.00 3.22 3.18 0.00 5.77 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 L 8.23 4.26 0.00 1.60 1.47 0.92 0.94 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 40 S 8.72 4.45 0.00 3.87 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 41 E 7.82 4.71 0.00 2.00 1.71 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 2.28 2.33 0.00 42 I 8.33 4.69 1.86 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 1.40 0.71 0.92 0.00 0.00 43 D 8.69 4.96 0.00 2.67 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 44 Q 8.65 4.07 0.00 2.12 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.06 0.00 0.00 0.00 0.00 0.00 2.46 2.36 0.00 45 A 8.97 3.58 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 46 T 7.80 4.70 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 1.18 0.00 0.00 47 E 8.80 5.07 0.00 2.07 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 2.12 2.26 0.00 48 N 9.45 5.51 0.00 2.73 2.66 0.00 0.00 6.27 7.24 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 49 I 8.62 4.92 1.88 0.00 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 1.00 0.79 0.00 0.00 50 K 9.08 5.04 0.00 1.70 1.75 0.00 1.64 0.00 0.00 1.66 0.00 0.00 2.84 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.39 1.55 7.81 51 I 8.99 4.87 1.92 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.96 0.96 0.00 0.00 52 T 9.38 4.91 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 53 I 9.11 4.76 1.92 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 1.15 0.85 0.94 0.00 0.00 54 L 8.35 5.02 0.00 1.77 1.64 0.93 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 55 G 9.28 5.01 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 56 N 8.79 5.08 0.00 2.72 2.83 0.00 0.00 6.06 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 57 N 8.16 4.06 0.00 2.92 2.85 0.00 0.00 7.14 7.66 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 58 L 8.33 4.62 0.00 1.72 1.60 1.01 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 59 D 8.27 4.73 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 60 Y 8.53 4.12 0.00 3.13 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 61 E 8.39 3.51 0.00 2.14 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 2.49 2.38 0.00 62 Q 8.11 3.92 0.00 2.29 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.91 0.00 0.00 0.00 0.00 0.00 2.39 2.41 0.00 63 I 7.81 3.60 1.87 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 1.64 1.30 0.90 0.00 0.00 64 K 8.33 3.72 0.00 0.98 1.63 0.00 1.52 0.00 0.00 1.54 0.00 0.00 3.05 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.49 1.35 7.81 65 G 7.81 3.45 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 0.00 0.00 0.00 0.00 66 V 7.53 3.51 2.01 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 0.74 0.00 0.00 0.94 0.00 0.00 67 I 7.55 3.79 2.01 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 1.75 0.58 1.07 0.00 0.00 68 E 7.80 4.43 0.00 2.05 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 2.35 2.42 0.00 69 D 7.94 4.57 0.00 2.75 2.62 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 *71 G 8.23 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 72 G 7.91 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 0.00 0.00 0.00 73 V 8.53 4.63 2.12 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 1.01 0.00 0.00 0.97 0.00 0.00 74 I 8.47 4.46 1.97 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.71 1.09 0.00 0.00 75 H 9.22 4.67 0.00 3.16 3.35 0.00 5.71 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 S 7.88 4.55 0.00 3.86 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 77 V 8.26 4.39 2.01 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 0.74 0.00 0.00 0.83 0.00 0.00 78 D 8.78 4.57 0.00 2.64 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 79 E 8.07 4.78 0.00 1.98 1.72 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 2.25 2.26 0.00 80 V 8.29 4.85 2.05 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 0.80 0.00 0.00 0.86 0.00 0.00 81 V 8.96 4.49 2.16 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 0.90 0.00 0.00 0.97 0.00 0.00 82 A 9.02 4.79 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 83 G 7.89 3.72 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 0.00 0.00 0.00 84 K 8.68 4.43 0.00 1.76 1.87 0.00 1.78 0.00 0.00 0.61 0.00 0.00 3.03 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.43 1.41 7.81 85 I 7.33 4.32 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 1.41 0.42 0.91 0.00 0.00 86 I 8.13 3.89 1.87 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 1.30 0.74 0.91 0.00 0.00 87 V 8.07 4.03 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 0.80 0.00 0.00 0.96 0.00 0.00 88 E 8.48 4.27 0.00 2.00 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 2.31 2.23 0.00 89 S 8.35 4.20 0.00 3.82 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 90 V 8.31 3.80 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 * Residues marked with a * may have inaccurate shift predictions.