NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -5 T 4.3948 8.1749 110.9470 60.8164 69.8608 175.4270 -4 E 5.7390 8.7656 125.4319 56.1530 32.3405 174.8997 -3 F 4.7952 8.7536 121.3607 56.4986 41.6174 174.5660 -2 K 4.0592 7.5340 125.0980 53.7500 34.7813 176.2072 -1 A 4.0238 7.3115 125.3294 51.6652 19.5649 176.7215 -4 G 5.3490 8.6756 114.0319 44.6530 0.0000 173.1997 -3 S 4.6452 8.7636 116.7607 57.0986 65.8174 173.3660 -2 A 4.0592 7.4840 128.4980 50.0500 20.7813 177.4072 -1 K 4.0238 7.3615 121.9294 55.3652 33.5649 175.5215 5 K 4.0969 8.1880 119.4804 59.7767 32.0728 178.7569 6 G 3.7264 8.1958 104.9738 47.6556 0.0000 175.2317 7 A 2.5800 7.5626 122.7149 54.6854 18.3481 179.5263 8 T 3.9656 7.6116 107.3484 64.2001 69.0860 177.0713 9 L 3.9327 7.5420 121.9476 57.5459 41.6689 178.8574 10 F 3.9941 8.1719 120.5480 61.3273 39.1357 177.1184 11 K 3.9096 7.8998 116.9534 59.6310 32.0638 178.8316 12 T 4.2281 7.8742 107.0809 62.7432 69.2690 175.3985 13 R 4.5445 7.9809 118.3747 55.6980 32.8478 175.8313 14 C 4.2497 7.8200 114.7505 60.1397 30.3314 175.9247 15 L 4.0093 7.1263 119.5455 57.1256 41.8576 177.4184 16 Q 4.0486 8.0158 118.6818 58.8886 29.0012 176.6264 17 C 4.8500 7.8315 111.3954 59.5461 30.4123 173.3873 18 H 5.3068 8.2991 115.5085 54.2415 33.2622 172.4438 19 T 4.8477 8.5891 109.9689 60.3953 71.6359 174.8778 20 V 4.2642 8.3500 113.0410 60.8002 34.1810 176.3151 21 D 4.4689 7.8688 119.8233 52.6646 39.9492 175.3613 22 Q 3.8906 8.1633 123.0646 57.3854 29.3090 176.3122 23 G 3.8831 8.9833 113.0744 45.6203 0.0000 173.4476 24 G 4.3179 8.0558 107.2512 44.1802 0.0000 173.7559 25 A 4.5460 7.4129 125.2764 50.5267 20.2238 177.4949 26 N 4.7573 8.4405 117.5068 53.3263 40.3614 174.9913 27 K 4.6585 8.3357 122.6166 55.7875 32.6614 178.1964 28 V 3.7042 9.0136 125.9120 66.4664 31.4479 176.0193 29 G 3.7434 8.1385 108.3694 42.5525 0.0000 171.1212 30 P 4.3325 0.0000 0.0000 61.5503 32.0235 175.8571 31 N 4.5177 8.8652 119.2166 54.0325 39.3861 175.0051 32 L 4.2254 8.6359 124.0617 54.7345 42.4124 176.1462 33 H 4.0641 7.6760 119.0351 57.6955 29.9158 174.8492 34 G 3.8790 8.8675 115.2510 46.5527 0.0000 174.6893 35 I 3.6457 7.6821 123.0224 63.2153 38.1470 176.3764 36 F 4.6957 7.6346 119.2420 58.6500 39.0594 175.5553 37 G 3.9511 10.3028 114.4631 45.3341 0.0000 172.8861 38 R 4.6203 7.7690 120.0817 55.1082 32.7456 175.0697 39 H 5.6811 8.7585 120.0726 53.6143 30.7595 175.1165 40 S 4.4027 8.2323 114.4411 58.9465 63.8365 173.9396 41 G 2.0671 7.7822 107.6071 46.7935 0.0000 174.2939 42 Q 4.5258 7.9996 114.4714 54.7372 30.1074 175.7062 43 A 4.2018 8.5920 123.4136 51.8238 18.8266 177.5908 44 E 4.0588 8.8286 123.4178 57.8123 29.9138 177.5602 45 G 3.9414 9.0443 111.0005 45.8201 0.0000 172.0748 46 Y 4.4851 7.5594 119.9437 55.5854 40.4397 176.2407 47 S 4.3129 6.9194 121.7603 57.0859 60.9663 173.1080 48 Y 4.6027 8.1010 122.9878 57.0848 38.7340 176.1308 49 T 4.4071 8.4048 111.9816 61.1846 71.3081 175.4284 50 D 4.3667 8.6622 121.2451 57.5368 40.8380 178.4934 51 A 3.9821 8.1720 120.6691 55.7335 18.0095 178.5933 52 N 4.2281 7.8445 113.7251 57.0171 38.9484 176.3744 53 I 3.6809 7.5282 120.4311 64.7938 37.1559 178.6055 54 K 4.0585 8.0822 117.5223 58.9662 31.8917 179.0135 55 K 3.8000 7.9468 119.5860 57.3619 32.4837 176.0154 56 N 3.9344 7.5413 114.9360 53.9777 38.1578 174.1561 57 V 3.4624 6.9002 116.8206 62.5617 33.0124 174.5060 58 L 4.4435 8.0202 129.4241 53.4752 42.7414 175.7954 59 W 4.9284 9.3824 128.2029 56.4144 30.0293 175.1065 60 D 5.3863 8.7335 123.8177 50.8184 42.6234 176.5798 61 E 3.7422 8.6887 117.1102 59.4149 28.9858 179.4770 62 N 4.4155 8.7852 116.9115 56.3966 38.6473 177.0848 63 N 4.3440 8.5681 117.3862 56.7943 38.7383 176.9368 64 M 4.2698 8.2491 119.2886 58.6804 32.1430 178.2848 65 S 4.1441 7.8144 113.5243 61.1040 62.3901 175.6172 66 E 3.9030 7.6757 120.9653 59.4758 29.5723 177.7953 67 Y 4.1204 7.9351 119.7663 60.8034 38.8986 178.1779 68 L 3.9751 8.1186 119.4440 57.6419 41.5546 179.6551 69 T 4.3465 7.7152 117.7747 64.7930 68.9707 172.9602 70 N 4.4421 7.6965 115.2959 52.3550 41.1159 172.8244 71 P 3.8714 0.0000 0.0000 63.1028 31.5375 178.2349 *73 K 3.8923 8.0019 121.3518 56.6565 33.8595 176.4975 74 Y 4.3967 8.3257 119.1617 60.0465 39.0811 175.7848 75 I 4.4880 8.7017 122.4749 57.7703 37.4889 171.2713 76 P 4.4029 0.0000 0.0000 64.0956 31.7696 176.6248 77 G 4.1031 9.0919 111.5203 45.6485 0.0000 173.8682 78 T 4.0930 7.7978 114.4562 62.2001 67.7261 173.9684 79 K 4.3138 8.5912 125.2949 57.2120 33.5010 176.3985 80 M 4.0366 7.8300 120.3544 56.1858 32.7390 176.9257 81 A 4.4877 8.4565 133.7823 51.1155 17.9508 176.5636 82 F 4.7328 7.6592 122.3787 55.4081 42.0666 175.0187 83 G 3.3004 7.9602 117.7455 47.1862 0.0000 172.6372 84 G 4.2179 5.3800 104.1538 44.3343 0.0000 173.4038 85 L 4.6600 9.0839 120.8665 52.6680 42.4834 177.9857 86 K 4.0006 8.6098 124.5237 58.7246 32.6872 178.8323 87 K 4.2898 7.8864 119.1381 55.5067 33.4020 177.4866 88 E 4.0509 8.9064 124.9856 59.0178 29.6276 179.0290 89 K 3.9835 8.0178 118.6795 60.0594 32.6357 178.7505 90 D 4.3963 8.0840 119.7578 57.1472 40.8172 178.8181 91 R 4.0161 8.0492 118.4639 59.2881 30.0361 178.8702 92 N 4.7768 8.6181 116.5498 56.5330 38.5645 177.0101 93 D 4.3845 8.2257 120.1344 57.3578 41.0081 178.4253 94 L 4.0720 8.3010 120.8590 58.6800 42.0640 179.2816 95 I 4.0313 8.3845 119.7055 64.5209 36.7528 178.6933 96 T 4.0104 8.0672 117.0244 66.6463 68.2241 176.1351 97 Y 3.9696 8.1354 121.4594 60.6398 38.8934 178.0064 98 L 3.6050 8.4561 120.2767 57.4769 41.5248 179.0403 99 K 3.4132 7.9060 118.9312 59.4235 32.0254 178.4525 100 K 3.9709 7.3543 116.7795 60.1390 33.2478 178.7753 101 A 3.9494 8.0180 123.1226 54.0459 18.2738 178.4446 102 C 4.1073 8.3593 113.4547 60.2578 27.9968 173.6352 103 E 4.1005 7.4010 126.3235 56.2176 29.2170 175.5287 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 -5 T 8.17 4.39 4.67 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 1.28 0.00 0.00 -4 E 8.77 5.74 0.00 2.10 2.04 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 2.10 2.36 0.00 -3 F 8.75 4.80 0.00 3.07 3.16 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 -2 K 7.53 4.06 0.00 1.45 1.40 0.00 1.73 0.00 0.00 1.60 0.00 0.00 2.98 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.18 1.22 7.81 -1 A 7.31 4.02 1.19 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 0.00 0.00 0.00 -4 G 8.68 5.35 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 0.00 -3 S 8.76 4.65 0.00 3.82 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 -2 A 7.48 4.06 1.14 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 -1 K 7.36 4.02 0.00 1.58 1.47 0.00 0.61 0.00 0.00 1.78 0.00 0.00 2.13 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.50 1.32 7.81 5 K 8.19 4.10 0.00 1.87 2.06 0.00 1.62 0.00 0.00 1.83 0.00 0.00 3.04 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.90 1.60 7.81 6 G 8.20 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 0.00 0.00 0.00 7 A 7.56 2.58 1.10 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 8 T 7.61 3.97 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 1.17 0.00 0.00 9 L 7.54 3.93 0.00 1.93 1.77 0.94 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 10 F 8.17 3.99 0.00 3.08 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 11 K 7.90 3.91 0.00 1.75 1.86 0.00 1.71 0.00 0.00 1.75 0.00 0.00 3.05 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.53 1.73 7.81 12 T 7.87 4.23 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 1.22 0.00 0.00 13 R 7.98 4.54 0.00 1.68 1.84 0.00 3.37 0.00 0.00 3.45 7.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.74 0.00 14 C 7.82 4.25 0.00 1.23 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 0.00 0.00 0.00 0.00 15 L 7.13 4.01 0.00 1.41 1.69 1.15 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 16 Q 8.02 4.05 0.00 1.98 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.57 0.00 0.00 0.00 0.00 0.00 2.31 2.38 0.00 17 C 7.83 4.85 0.00 2.69 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 18 H 8.30 5.31 0.00 3.06 3.20 0.00 5.56 0.00 0.00 0.00 0.00 6.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 T 8.59 4.85 4.46 0.00 0.00 0.00 0.00 0.00 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 20 V 8.35 4.26 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 0.24 0.00 0.00 0.72 0.00 0.00 21 D 7.87 4.47 0.00 2.88 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 22 Q 8.16 3.89 0.00 1.47 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.07 0.00 0.00 0.00 0.00 0.00 2.24 2.32 0.00 23 G 8.98 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 24 G 8.06 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 0.00 0.00 0.00 0.00 25 A 7.41 4.55 1.27 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 26 N 8.44 4.76 0.00 2.83 2.89 0.00 0.00 6.73 7.61 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 27 K 8.34 4.66 0.00 1.78 1.06 0.00 1.71 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.37 1.52 7.81 28 V 9.01 3.70 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 0.78 0.00 0.00 0.93 0.00 0.00 29 G 8.14 3.74 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 0.00 0.00 0.00 30 P 0.00 4.33 0.00 1.91 1.04 0.00 3.42 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.14 0.00 31 N 8.87 4.52 0.00 2.85 2.88 0.00 0.00 7.11 8.21 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 32 L 8.64 4.23 0.00 1.60 1.42 0.77 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 33 H 7.68 4.06 0.00 3.27 3.21 0.00 6.04 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 G 8.87 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 35 I 7.68 3.65 1.67 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 0.62 0.44 0.16 0.00 0.00 36 F 7.63 4.70 0.00 3.09 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 37 G 10.30 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 38 R 7.77 4.62 0.00 2.08 2.03 0.00 3.13 0.00 0.00 3.20 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.63 0.00 39 H 8.76 5.68 0.00 2.97 3.14 0.00 6.00 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 S 8.23 4.40 0.00 4.10 3.66 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 41 G 7.78 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 0.00 0.00 0.00 0.00 0.00 0.00 42 Q 8.00 4.53 0.00 2.04 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.86 0.00 0.00 0.00 0.00 0.00 2.33 2.35 0.00 43 A 8.59 4.20 1.40 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 44 E 8.83 4.06 0.00 2.02 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 2.36 2.29 0.00 45 G 9.04 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 0.00 0.00 0.00 46 Y 7.56 4.49 0.00 2.78 2.60 0.00 0.00 0.00 0.00 0.00 0.00 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 S 6.92 4.31 0.00 3.66 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 48 Y 8.10 4.60 0.00 3.06 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.40 4.41 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 1.31 0.00 0.00 50 D 8.66 4.37 0.00 2.77 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 51 A 8.17 3.98 1.42 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 0.00 0.00 0.00 0.00 0.00 0.00 52 N 7.84 4.23 0.00 2.88 3.07 0.00 0.00 7.34 7.85 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 53 I 7.53 3.68 2.02 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 1.37 0.88 0.87 0.00 0.00 54 K 8.08 4.06 0.00 1.72 1.83 0.00 1.69 0.00 0.00 1.61 0.00 0.00 3.02 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.44 1.68 7.81 55 K 7.95 3.80 0.00 1.81 1.94 0.00 1.59 0.00 0.00 1.33 0.00 0.00 2.13 0.00 0.00 2.39 0.00 0.00 0.00 0.00 1.25 1.20 7.81 56 N 7.54 3.93 0.00 2.72 2.65 0.00 0.00 7.17 7.59 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 57 V 6.90 3.46 0.67 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 0.13 0.00 0.00 0.43 0.00 0.00 58 L 8.02 4.44 0.00 1.44 1.44 0.73 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 59 W 9.38 4.93 0.00 3.33 2.85 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 60 D 8.73 5.39 0.00 2.79 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 61 E 8.69 3.74 0.00 1.60 1.12 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 1.79 1.61 0.00 62 N 8.79 4.42 0.00 3.00 2.91 0.00 0.00 6.98 6.50 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 63 N 8.57 4.34 0.00 3.11 3.05 0.00 0.00 6.70 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 64 M 8.25 4.27 0.00 2.48 2.37 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.70 0.00 65 S 7.81 4.14 0.00 4.08 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 66 E 7.68 3.90 0.00 1.89 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 2.42 2.25 0.00 67 Y 7.94 4.12 0.00 2.86 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 68 L 8.12 3.98 0.00 1.82 1.76 0.94 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 69 T 7.72 4.35 4.37 0.00 0.00 0.00 0.00 0.00 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 70 N 7.70 4.44 0.00 2.61 2.68 0.00 0.00 7.23 7.57 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 71 P 0.00 3.87 0.00 2.17 1.32 0.00 3.67 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 2.29 1.80 0.00 *73 K 8.00 3.89 0.00 1.77 2.10 0.00 1.70 0.00 0.00 1.66 0.00 0.00 3.07 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.38 1.58 7.81 74 Y 8.33 4.40 0.00 3.20 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 75 I 8.70 4.49 2.15 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 1.05 0.98 0.00 0.00 76 P 0.00 4.40 0.00 2.05 2.04 0.00 3.63 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.13 0.00 77 G 9.09 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 78 T 7.80 4.09 4.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 79 K 8.59 4.31 0.00 1.96 1.98 0.00 1.68 0.00 0.00 1.68 0.00 0.00 2.96 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.50 1.52 7.81 80 M 7.83 4.04 0.00 2.23 2.22 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.75 2.66 0.00 81 A 8.46 4.49 1.30 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 0.00 0.00 82 F 7.66 4.73 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 83 G 7.96 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 0.00 0.00 0.00 84 G 5.38 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 85 L 9.08 4.66 0.00 1.95 1.69 1.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 86 K 8.61 4.00 0.00 1.75 1.87 0.00 1.74 0.00 0.00 1.69 0.00 0.00 2.97 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.42 1.44 7.81 87 K 7.89 4.29 0.00 1.98 1.75 0.00 1.68 0.00 0.00 1.76 0.00 0.00 2.89 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.53 1.50 7.81 88 E 8.91 4.05 0.00 2.07 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 2.42 2.43 0.00 89 K 8.02 3.98 0.00 2.03 2.06 0.00 1.57 0.00 0.00 1.82 0.00 0.00 2.95 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.51 1.55 7.81 90 D 8.08 4.40 0.00 2.98 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 91 R 8.05 4.02 0.00 1.98 2.07 0.00 3.28 0.00 0.00 3.49 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.96 0.00 92 N 8.62 4.78 0.00 2.95 3.01 0.00 0.00 7.03 8.85 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 93 D 8.23 4.38 0.00 2.90 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 94 L 8.30 4.07 0.00 1.82 1.77 1.23 1.27 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 95 I 8.38 4.03 2.00 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 1.56 0.60 0.10 0.00 0.00 96 T 8.07 4.01 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 1.32 0.00 0.00 97 Y 8.14 3.97 0.00 3.35 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 98 L 8.46 3.61 0.00 1.83 1.81 0.97 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 99 K 7.91 3.41 0.00 1.67 1.91 0.00 1.72 0.00 0.00 1.68 0.00 0.00 3.35 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.16 1.36 7.81 100 K 7.35 3.97 0.00 1.79 1.97 0.00 1.48 0.00 0.00 1.67 0.00 0.00 3.19 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.36 1.30 7.81 101 A 8.02 3.95 0.64 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 0.00 0.00 0.00 0.00 0.00 102 C 8.36 4.11 0.00 3.05 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 0.00 103 E 7.40 4.10 0.00 2.09 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 2.23 2.26 0.00 * Residues marked with a * may have inaccurate shift predictions.