NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 25 D 4.6279 8.3601 119.5550 52.5458 42.2362 175.0918 26 A 4.5895 7.3717 120.0239 49.3632 22.5916 172.6017 27 V 3.8476 8.0762 121.0684 62.4924 33.0342 174.0065 *29 V 3.9851 8.1852 118.7328 63.0667 32.2912 175.8051 30 F 4.9534 9.2678 127.1208 55.8001 41.3178 174.8728 31 A 5.3848 8.5929 123.1977 50.5016 22.7513 175.1044 32 R 4.7321 9.1318 119.8241 54.2278 33.4273 174.7981 33 Q 3.7957 9.1429 125.4990 56.1591 28.9847 176.3594 34 G 4.2533 8.2317 112.3750 45.8525 0.0000 172.6540 35 D 4.6311 8.6613 122.3092 54.2887 42.4003 175.5164 36 K 4.7270 8.2747 120.3655 55.0748 34.3860 175.8757 37 G 4.3342 8.9853 110.1423 46.0642 0.0000 171.1484 38 S 5.1055 8.2552 112.2675 57.2467 66.0612 173.9943 39 V 4.2769 8.3900 120.7885 61.1238 34.5758 174.3631 40 S 4.9606 8.5746 121.0642 56.4328 65.2434 173.1913 41 V 4.2380 8.7955 126.9122 61.5742 33.8407 176.1691 42 G 3.7762 8.2223 119.4405 47.2685 0.0000 173.4287 43 D 4.6939 8.9230 124.1734 53.8321 41.3827 175.8887 44 K 4.4044 8.0217 120.8789 55.5184 33.2389 175.4798 45 H 5.1482 8.1973 116.9327 55.1113 31.0647 172.0819 46 F 5.3243 8.4128 114.0475 56.1607 41.5873 173.1811 47 R 5.2135 9.4734 118.9294 54.7486 33.0457 175.4272 48 T 5.3820 8.9947 111.4228 60.0948 72.5831 172.5378 49 Q 4.8605 9.2787 124.2437 54.4908 32.2058 173.8062 50 A 5.2817 8.8564 128.6198 50.9681 21.3135 175.7542 51 F 5.2551 9.4390 118.3613 55.6176 43.9915 173.7470 52 K 4.9638 8.9332 123.1607 55.5099 33.7992 175.5045 53 V 4.9979 9.1354 127.1993 61.0956 34.9700 173.8597 54 R 5.1441 9.3121 127.9261 54.5793 33.0355 173.9184 55 L 5.1093 9.0971 126.4930 53.1020 44.2203 175.5767 56 V 4.8139 8.4251 122.5111 61.1810 34.6054 174.1831 57 N 4.7382 9.3442 127.4992 52.4204 39.3701 174.2898 58 A 4.7280 8.5905 126.8789 51.9048 19.7152 176.4584 59 A 4.4697 8.7025 122.0638 51.9551 19.8466 179.1360 60 K 4.2327 8.6667 119.3270 55.8167 32.2689 175.8956 61 S 4.8905 7.5015 110.2845 56.6611 66.4491 173.4835 62 E 4.2499 8.9067 121.4201 57.2152 30.1252 175.9822 63 I 4.5920 8.4057 126.5341 59.4463 40.4337 174.8998 64 S 4.7739 8.7521 121.4196 57.9543 63.2333 173.5721 65 L 4.5775 8.8032 126.0710 54.1820 42.5511 178.0786 66 K 3.8010 7.8955 120.9709 59.5019 31.9435 177.4840 67 N 4.8927 8.0444 112.4623 53.1529 38.7975 174.4066 68 S 5.1909 7.7488 114.2528 57.1718 66.0201 171.0207 69 C 5.0147 8.8926 114.5392 54.0612 45.1932 173.2162 70 L 4.9352 8.5322 121.1003 54.7039 42.3274 176.4822 71 V 4.7005 8.8361 122.1587 61.2110 35.3936 173.8753 72 A 4.5134 7.8880 128.2789 50.5499 21.3797 175.7536 73 Q 5.1220 8.7120 120.8388 54.6181 33.1396 174.6506 74 S 5.0877 9.2766 119.4684 56.4410 64.5078 175.1192 75 A 3.9560 8.6118 124.0824 55.2757 18.1827 178.9610 76 A 4.0454 7.9077 116.9844 53.6515 18.5945 178.1503 77 G 3.9793 8.1478 104.0466 44.7297 0.0000 173.2581 78 Q 4.2096 8.0195 121.8102 55.2736 30.1477 174.9861 79 S 5.0476 8.1397 120.2984 56.7066 65.7170 173.2110 80 F 5.1248 8.8051 119.6642 55.5947 42.8844 174.8343 81 R 4.4587 8.7807 119.1765 55.6148 31.2549 175.4228 82 L 4.0578 8.5822 123.3533 55.1589 42.8186 175.5588 83 D 4.7568 9.0840 126.4686 55.9375 42.3539 176.3301 84 T 4.9171 7.4559 106.5362 60.3626 72.5415 172.9595 85 V 4.8467 7.9379 120.3649 60.4041 34.4609 173.6004 86 D 4.4962 8.8519 122.7849 54.1900 41.5162 177.3364 87 E 3.9631 9.0422 122.7297 59.3309 29.9286 178.9013 88 E 3.9767 8.2093 117.2274 59.1332 29.5598 177.5378 89 L 4.3699 7.8644 116.4053 55.3893 41.8539 177.0723 90 T 4.3458 7.7663 108.4339 60.9343 69.0533 174.8090 91 A 4.0239 7.8981 124.8816 53.5703 18.8275 177.8728 92 D 4.7589 8.7257 121.5352 56.4758 42.1688 175.9528 93 T 5.0910 7.6432 106.6596 60.1774 72.5960 172.8869 94 L 4.7460 8.6548 123.2245 52.9230 45.1230 176.0817 95 K 4.5148 8.7908 125.7112 55.4958 33.5600 174.7388 96 P 4.4143 0.0000 0.0000 64.1318 31.6062 177.2407 97 G 3.8807 8.8839 109.8252 45.5317 0.0000 173.3750 98 A 4.5605 7.6287 121.7392 51.4913 20.4164 176.6553 99 S 5.7729 8.3343 113.6920 55.9190 67.2587 174.0893 100 V 4.6418 8.2911 114.1136 59.7509 35.7161 174.1797 101 E 5.1454 8.5581 123.2216 54.7096 33.2070 174.3006 102 G 4.0390 8.4699 111.0813 46.3560 0.0000 171.6179 103 D 5.4775 8.4626 118.7808 53.5361 42.9097 175.9808 104 A 4.8829 9.2259 122.8973 50.3000 22.8015 174.9158 105 I 4.8664 8.5902 123.6079 59.5850 39.9283 175.1345 106 F 5.3696 9.3091 125.3650 56.0082 41.9282 174.6031 107 A 5.9400 9.0368 121.1668 50.0139 22.5702 175.6622 108 S 4.7422 8.5237 112.4452 56.9388 66.3905 174.8671 109 E 3.9627 9.1694 123.0105 59.4405 29.7031 176.9227 110 D 4.7402 7.7691 115.9429 52.6298 41.8407 176.0737 111 D 4.2203 8.3836 119.3435 53.8877 39.4165 177.6045 112 A 4.0714 8.2322 125.1919 55.5635 18.2673 180.6904 113 V 2.0000 7.5790 117.4927 64.3987 31.0424 178.0650 114 Y 4.5471 7.6467 116.5837 60.3186 37.4440 177.7425 115 G 3.9180 8.2859 105.7465 44.2569 0.0000 173.4487 116 A 4.5520 7.5339 125.6198 52.5424 18.6983 177.2748 117 S 4.9844 8.9963 115.8548 57.6478 64.5837 173.7802 118 L 4.7607 7.7662 122.1436 53.3663 45.8338 174.6718 119 V 4.4830 8.1068 124.1470 60.9215 33.7388 174.5662 120 R 4.7180 8.7919 123.2077 54.5043 33.6432 173.5481 121 L 4.9650 8.3552 119.2293 53.5407 43.0879 176.1739 122 S 4.8598 9.1342 118.7255 56.3933 65.3586 173.8477 123 D 4.8844 8.6809 123.3996 53.1589 39.5387 176.9927 124 R 4.4547 7.8295 120.3531 54.7695 29.6056 174.0011 125 C 4.9928 8.4434 120.8939 55.3637 43.7721 175.3445 126 K 4.2142 8.6250 123.7123 54.6750 31.7060 174.3720 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 25 D 8.36 4.63 0.00 2.71 2.65 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.37 4.59 1.20 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 0.00 0.00 27 V 8.08 3.85 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 0.87 0.00 0.00 0.94 0.00 0.00 *29 V 8.19 3.99 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 0.83 0.00 0.00 0.88 0.00 0.00 30 F 9.27 4.95 0.00 3.08 2.97 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 0.00 0.00 0.00 31 A 8.59 5.38 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 32 R 9.13 4.73 0.00 1.93 1.82 0.00 3.12 0.00 0.00 3.20 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.62 0.00 33 Q 9.14 3.80 0.00 1.90 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.48 0.00 0.00 0.00 0.00 0.00 2.40 2.45 0.00 34 G 8.23 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 0.00 0.00 0.00 0.00 35 D 8.66 4.63 0.00 2.56 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 36 K 8.27 4.73 0.00 1.15 0.74 0.00 1.29 0.00 0.00 0.61 0.00 0.00 2.68 0.00 0.00 2.80 0.00 0.00 0.00 0.00 0.82 1.00 7.81 37 G 8.99 4.33 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 0.00 38 S 8.26 5.11 0.00 3.82 3.80 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 39 V 8.39 4.28 0.79 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 0.79 0.00 0.00 0.56 0.00 0.00 40 S 8.57 4.96 0.00 3.76 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 41 V 8.80 4.24 2.10 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 0.94 0.00 0.00 0.95 0.00 0.00 42 G 8.22 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 43 D 8.92 4.69 0.00 2.68 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 44 K 8.02 4.40 0.00 1.99 1.75 0.00 1.73 0.00 0.00 1.73 0.00 0.00 2.94 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.41 1.37 7.81 45 H 8.20 5.15 0.00 3.25 3.22 0.00 5.54 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 F 8.41 5.32 0.00 3.32 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 47 R 9.47 5.21 0.00 1.77 1.66 0.00 3.01 0.00 0.00 3.32 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 1.36 0.00 48 T 8.99 5.38 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 1.47 0.00 0.00 49 Q 9.28 4.86 0.00 2.24 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.85 0.00 0.00 0.00 0.00 0.00 2.15 1.93 0.00 50 A 8.86 5.28 1.28 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 0.00 0.00 51 F 9.44 5.26 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 52 K 8.93 4.96 0.00 1.96 1.76 0.00 1.50 0.00 0.00 1.79 0.00 0.00 3.00 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.43 1.49 7.81 53 V 9.14 5.00 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 0.96 0.00 0.00 1.09 0.00 0.00 54 R 9.31 5.14 0.00 1.93 1.87 0.00 2.96 0.00 0.00 3.11 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.70 0.00 55 L 9.10 5.11 0.00 1.64 1.59 0.95 0.52 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 56 V 8.43 4.81 2.36 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 0.86 0.00 0.00 1.06 0.00 0.00 57 N 9.34 4.74 0.00 2.81 2.87 0.00 0.00 6.64 7.72 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 58 A 8.59 4.73 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 59 A 8.70 4.47 1.32 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 60 K 8.67 4.23 0.00 1.79 1.72 0.00 1.75 0.00 0.00 1.76 0.00 0.00 2.99 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.34 0.99 7.81 61 S 7.50 4.89 0.00 3.80 3.81 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 62 E 8.91 4.25 0.00 2.00 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 2.30 2.54 0.00 63 I 8.41 4.59 1.88 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 1.12 1.08 0.91 0.00 0.00 64 S 8.75 4.77 0.00 3.83 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 65 L 8.80 4.58 0.00 1.90 1.65 0.99 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 66 K 7.90 3.80 0.00 1.74 1.86 0.00 1.78 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.46 1.44 7.81 67 N 8.04 4.89 0.00 2.74 2.79 0.00 0.00 6.74 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 68 S 7.75 5.19 0.00 3.87 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 69 C 8.89 5.01 0.00 2.97 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 70 L 8.53 4.94 0.00 1.69 1.91 0.99 0.86 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 71 V 8.84 4.70 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 0.98 0.00 0.00 0.98 0.00 0.00 72 A 7.89 4.51 0.25 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 73 Q 8.71 5.12 0.00 2.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.81 0.00 0.00 0.00 0.00 0.00 2.22 2.34 0.00 74 S 9.28 5.09 0.00 4.19 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 0.00 75 A 8.61 3.96 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 76 A 7.91 4.05 1.32 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 77 G 8.15 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 78 Q 8.02 4.21 0.00 2.09 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.67 0.00 0.00 0.00 0.00 0.00 1.49 2.03 0.00 79 S 8.14 5.05 0.00 3.77 3.67 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 0.00 80 F 8.81 5.12 0.00 3.00 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 81 R 8.78 4.46 0.00 1.95 2.11 0.00 2.97 0.00 0.00 3.26 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.66 0.00 82 L 8.58 4.06 0.00 1.78 1.60 0.22 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 83 D 9.08 4.76 0.00 2.58 2.74 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 84 T 7.46 4.92 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 85 V 7.94 4.85 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 0.64 0.00 0.00 0.90 0.00 0.00 86 D 8.85 4.50 0.00 2.65 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 87 E 9.04 3.96 0.00 2.00 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 0.00 2.38 2.35 0.00 88 E 8.21 3.98 0.00 2.06 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 0.00 2.33 2.41 0.00 89 L 7.86 4.37 0.00 1.78 1.72 0.97 0.94 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 90 T 7.77 4.35 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 1.25 0.00 0.00 91 A 7.90 4.02 1.34 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 0.00 0.00 92 D 8.73 4.76 0.00 2.70 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 93 T 7.64 5.09 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 1.21 0.00 0.00 94 L 8.65 4.75 0.00 1.77 1.52 0.94 0.43 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 95 K 8.79 4.51 0.00 1.73 1.72 0.00 1.74 0.00 0.00 1.87 0.00 0.00 2.91 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.54 1.40 7.81 96 P 0.00 4.41 0.00 2.18 2.19 0.00 3.84 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.05 0.00 97 G 8.88 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 98 A 7.63 4.56 1.32 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 99 S 8.33 5.77 0.00 3.71 3.81 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 0.00 100 V 8.29 4.64 2.22 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 0.75 0.00 0.00 0.96 0.00 0.00 101 E 8.56 5.15 0.00 1.93 1.76 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 2.21 2.53 0.00 102 G 8.47 4.04 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 0.00 0.00 0.00 0.00 0.00 0.00 103 D 8.46 5.48 0.00 2.64 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 0.00 104 A 9.23 4.88 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 0.00 105 I 8.59 4.87 1.84 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 1.26 0.73 0.99 0.00 0.00 106 F 9.31 5.37 0.00 3.24 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 0.00 107 A 9.04 5.94 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 0.00 108 S 8.52 4.74 0.00 4.03 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 0.00 109 E 9.17 3.96 0.00 2.01 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 0.00 2.36 2.52 0.00 110 D 7.77 4.74 0.00 2.80 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 0.00 111 D 8.38 4.22 0.00 2.34 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 0.00 112 A 8.23 4.07 1.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 V 7.58 2.00 1.63 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 0.82 0.00 0.00 0.72 0.00 0.00 114 Y 7.65 4.55 0.00 2.94 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 0.00 115 G 8.29 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 0.00 116 A 7.53 4.55 1.46 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 0.00 0.00 0.00 117 S 9.00 4.98 0.00 3.91 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 0.00 118 L 7.77 4.76 0.00 1.69 1.58 0.84 0.74 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 0.00 119 V 8.11 4.48 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 -0.13 0.00 0.00 120 R 8.79 4.72 0.00 1.78 1.86 0.00 2.75 0.00 0.00 3.09 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.52 0.00 121 L 8.36 4.96 0.00 1.52 1.62 0.92 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 122 S 9.13 4.86 0.00 3.82 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 0.00 123 D 8.68 4.88 0.00 2.81 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 0.00 124 R 7.83 4.45 0.00 1.79 1.90 0.00 3.08 0.00 0.00 3.21 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.54 0.00 125 C 8.44 4.99 0.00 2.90 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 0.00 126 K 8.62 4.21 0.00 1.75 1.55 0.00 1.84 0.00 0.00 1.74 0.00 0.00 2.87 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.27 0.97 7.81 * Residues marked with a * may have inaccurate shift predictions.