NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 I 4.2524 7.8827 121.4127 61.2121 39.5552 173.5935 3 V 4.6604 8.4582 125.4152 60.3177 33.9811 170.5380 4 E 5.0502 9.7212 130.3769 54.8866 31.5370 173.9958 5 E 4.8086 8.9599 128.2180 54.6603 31.8754 174.4170 6 R 5.1032 8.9279 126.5359 54.4898 33.3171 175.2901 7 I 4.8659 9.0875 123.9616 59.9462 40.7293 173.8876 8 Y 5.3737 9.2432 125.4398 56.1774 41.2487 174.7536 9 R 4.9160 8.8507 123.6081 54.9303 32.1604 174.7954 10 I 4.7329 8.4945 127.6819 59.2735 39.1511 175.6890 11 R 3.9328 8.7827 126.8069 56.4796 31.1351 176.1595 12 G 3.8287 8.6140 114.2513 47.1975 0.0000 173.9812 13 G 3.9820 9.0390 112.2663 45.2813 0.0000 174.2775 14 K 4.3259 7.6240 121.1773 54.9400 30.9553 176.5340 *16 Q 4.3090 7.8461 120.8388 55.8127 31.4555 177.7001 17 E 3.9226 8.2262 117.6159 59.3660 29.8147 177.8411 18 Y 4.0422 8.4252 119.9766 61.0080 38.8510 178.3819 19 L 4.0960 8.0918 119.2404 57.3309 41.7760 179.1817 20 K 3.8651 8.3298 119.8649 59.4978 32.2294 178.5555 21 L 4.0657 7.9775 119.3197 58.1247 41.5339 179.9706 22 V 3.5762 7.5480 117.2763 65.8249 31.2614 177.8857 23 R 3.7505 8.1605 117.5751 59.4005 30.0400 177.7111 24 E 4.3455 8.1228 115.5378 57.1016 29.6913 176.3199 25 E 4.4248 7.6482 117.1686 56.8082 33.7548 177.2204 26 G 2.6652 7.8155 105.2852 47.6934 0.0000 175.6761 27 I 3.8404 8.0570 122.0638 63.1906 37.7362 177.7953 28 A 3.9976 7.8371 120.6836 54.7162 17.1744 179.2950 29 I 3.8772 7.2528 118.3124 64.4546 37.3048 178.3578 30 Q 3.5849 8.2371 120.1277 58.9473 28.8646 177.8589 31 A 4.3207 8.2192 121.8338 54.9166 18.2678 177.6233 32 P 4.1405 0.0000 0.0000 66.0317 31.4713 178.5733 33 I 3.8860 6.9727 117.3702 64.1910 37.1231 178.1111 34 L 4.1585 7.9137 119.3575 56.1925 41.5775 177.2765 35 G 4.1672 10.0177 106.5435 45.9326 0.0000 173.8988 36 N 4.8979 7.6828 116.5181 51.9462 39.6842 172.2475 37 L 3.3643 7.7793 121.2786 55.0262 43.1181 176.1724 38 I 3.9887 7.9150 126.7948 62.9388 38.0884 175.9654 39 G 3.7237 6.9697 106.4135 44.4940 0.0000 171.0811 40 Y 4.3399 6.7465 120.7368 56.0680 41.2907 173.9757 41 F 5.2021 9.6712 125.0481 55.7981 43.9846 173.7814 42 V 4.9449 8.4750 120.2583 61.4041 33.6915 175.2039 43 T 4.1361 8.6872 125.0790 63.7122 68.3432 174.0537 44 D 4.6060 8.8789 124.8365 54.9270 42.5849 176.1274 45 I 4.5318 8.3585 118.5503 60.7996 40.5459 174.0945 46 G 3.9143 8.4642 116.6880 44.2548 0.0000 170.4918 47 P 4.2724 0.0000 0.0000 62.6292 31.7767 176.0974 48 L 4.4232 8.3434 122.8062 53.4115 44.2212 175.7285 49 S 3.6703 8.4103 111.4150 59.7949 60.7122 171.1190 50 Q 5.0736 7.5793 120.1677 54.3754 32.8839 174.4597 51 V 5.0333 8.8627 125.7163 61.2055 35.0223 174.1796 52 I 5.1414 9.0785 127.6015 60.0120 41.0699 174.2325 53 H 5.0509 8.4420 121.6869 52.3153 32.5762 171.7026 *55 W 4.7502 8.4487 116.3052 56.8369 30.4503 174.9218 56 G 4.3194 9.0294 112.2426 45.2712 0.0000 172.6902 57 Y 5.0807 8.8964 120.5345 55.9572 41.6493 175.7073 58 A 4.1424 9.0449 125.1616 55.2205 19.0409 178.0302 59 S 4.5908 7.4728 108.6356 56.7867 66.7003 175.8764 60 L 3.9637 8.2362 121.3626 57.6078 41.3395 179.3932 61 D 4.2772 7.9838 118.7733 57.0771 40.6984 177.9680 62 D 4.2410 7.8915 118.1887 57.2740 41.2945 177.9881 63 R 3.0292 7.6124 118.9459 59.3364 29.8299 178.1438 64 A 3.8827 7.8902 120.2820 55.0309 18.2523 179.2503 65 E 3.7986 8.0788 117.7274 59.4981 29.7716 179.3636 66 R 3.8817 8.1678 118.3683 59.4052 30.2646 179.3542 67 R 3.9052 8.5251 118.1722 58.6810 29.6734 179.4291 68 G 3.4957 7.6458 105.1754 47.7501 0.0000 175.2635 69 K 3.9820 8.2297 122.2954 59.0305 32.2169 178.9425 70 L 3.6870 7.8733 119.8743 58.1753 41.7600 178.9934 71 A 4.3267 7.7379 118.7035 54.4531 18.3893 178.4309 72 E 4.4004 7.6226 114.8572 55.7175 30.3407 176.0123 73 D 4.4801 7.5703 120.8722 53.7896 42.3011 176.1716 74 Q 4.0156 9.0782 127.6926 59.6965 29.0503 178.5543 75 R 4.0084 8.2029 118.3881 59.2036 30.0928 178.7357 76 W 4.4270 8.4253 127.8089 60.5593 30.5640 178.1994 77 Q 4.2328 8.5434 117.1264 58.5871 28.1677 178.1397 78 A 4.2011 7.7679 120.1642 53.4932 18.8700 178.2980 79 F 4.4458 7.3627 117.3620 60.1120 40.3871 177.5466 80 I 2.8860 7.5270 118.4624 63.2660 37.6781 176.0243 81 P 4.1452 0.0000 0.0000 65.4987 30.9086 178.7268 82 R 3.7972 7.2128 115.8590 58.7973 30.1885 178.6361 83 L 3.8699 6.9420 119.6405 58.1799 42.2727 178.8823 84 S 4.1105 8.3956 115.6730 61.5336 62.5133 177.0606 85 V 3.6813 7.4266 120.2401 64.2277 31.2195 177.6363 86 L 4.4268 8.0655 118.6897 54.5619 41.5644 175.9814 87 I 4.4275 7.2245 123.1150 60.7607 37.6221 176.0316 88 E 4.4136 8.9758 125.3038 59.0129 30.4406 173.2613 89 S 4.8146 7.7737 112.3134 57.5005 66.5401 173.3660 90 S 5.3704 8.2671 114.1271 57.7655 65.9064 172.5788 91 E 4.9765 8.9923 117.0723 56.0471 33.0025 173.5301 92 N 5.6691 8.5668 117.3873 52.2665 41.0233 172.9347 93 R 4.6810 8.7655 114.0492 55.5093 33.3167 173.6135 94 I 4.9763 8.3040 120.5472 59.6098 39.4145 175.0791 95 L 4.7695 9.1026 126.9825 52.8280 44.7925 175.3806 96 L 4.8227 8.3953 123.5317 52.1573 43.0660 174.8314 97 P 4.2094 0.0000 0.0000 62.5455 32.1558 176.7323 98 T 4.0009 7.8769 112.1494 60.8837 69.4499 174.8500 99 D 4.5197 8.2734 120.4910 54.7352 39.5642 176.7112 100 F 4.8277 6.7456 114.2767 56.5056 38.1333 174.8082 101 S 4.3924 7.3866 116.5996 57.1032 62.6254 171.8243 102 P 4.2968 0.0000 0.0000 65.4924 31.1847 176.4645 103 L 4.2282 7.7248 120.1420 54.3469 42.1366 176.2348 104 R 4.1252 8.2675 125.4791 56.7249 30.0982 174.2550 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 2 I 7.88 4.25 2.16 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 1.28 0.68 1.02 0.00 0.00 3 V 8.46 4.66 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 0.99 0.00 0.00 0.94 0.00 0.00 4 E 9.72 5.05 0.00 2.18 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 0.00 2.40 2.34 0.00 5 E 8.96 4.81 0.00 2.11 1.80 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 2.20 2.26 0.00 6 R 8.93 5.10 0.00 1.31 1.66 0.00 3.27 0.00 0.00 3.27 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.68 0.00 7 I 9.09 4.87 1.92 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 1.23 1.26 0.95 0.00 0.00 8 Y 9.24 5.37 0.00 2.70 2.63 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 9 R 8.85 4.92 0.00 1.90 1.79 0.00 3.08 0.00 0.00 3.17 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.59 0.00 10 I 8.49 4.73 1.83 0.00 0.00 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.70 0.96 0.00 0.00 11 R 8.78 3.93 0.00 1.88 1.83 0.00 3.10 0.00 0.00 3.17 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.62 0.00 12 G 8.61 3.83 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 0.00 0.00 0.00 13 G 9.04 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 14 K 7.62 4.33 0.00 1.99 1.82 0.00 1.84 0.00 0.00 1.67 0.00 0.00 2.94 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.40 1.55 7.81 *16 Q 7.85 4.31 0.00 2.14 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.94 6.91 0.00 0.00 0.00 0.00 0.00 2.38 2.33 0.00 17 E 8.23 3.92 0.00 2.07 2.13 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 2.39 2.38 0.00 18 Y 8.43 4.04 0.00 3.10 3.02 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 0.00 0.00 0.00 19 L 8.09 4.10 0.00 1.80 1.73 1.01 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 20 K 8.33 3.87 0.00 1.94 1.98 0.00 1.66 0.00 0.00 1.66 0.00 0.00 2.94 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.44 1.60 7.81 21 L 7.98 4.07 0.00 1.84 1.90 0.78 0.73 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 22 V 7.55 3.58 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 0.85 0.00 0.00 0.71 0.00 0.00 23 R 8.16 3.75 0.00 1.79 2.08 0.00 3.27 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.61 0.00 24 E 8.12 4.35 0.00 2.03 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 2.27 2.42 0.00 25 E 7.65 4.42 0.00 1.90 1.68 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 0.00 2.13 2.26 0.00 26 G 7.82 2.67 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 0.00 0.00 0.00 27 I 8.06 3.84 1.87 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.24 0.85 0.00 0.00 28 A 7.84 4.00 1.26 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 0.00 0.00 29 I 7.25 3.88 2.19 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 1.44 0.89 1.06 0.00 0.00 30 Q 8.24 3.58 0.00 2.08 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.81 0.00 0.00 0.00 0.00 0.00 1.97 1.63 0.00 31 A 8.22 4.32 1.43 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 0.00 0.00 32 P 0.00 4.14 0.00 2.02 2.14 0.00 3.70 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 2.18 2.19 0.00 33 I 6.97 3.89 1.70 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 1.47 0.40 0.82 0.00 0.00 34 L 7.91 4.16 0.00 1.43 1.42 -0.47 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 35 G 10.02 4.17 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 0.00 36 N 7.68 4.90 0.00 2.70 2.75 0.00 0.00 6.87 6.66 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 37 L 7.78 3.36 0.00 1.11 1.32 -0.25 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 38 I 7.91 3.99 1.73 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 1.35 0.89 0.88 0.00 0.00 39 G 6.97 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 40 Y 6.75 4.34 0.00 2.67 2.51 0.00 0.00 0.00 0.00 0.00 0.00 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 F 9.67 5.20 0.00 2.87 2.84 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 0.00 0.00 0.00 0.00 42 V 8.48 4.94 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 0.91 0.00 0.00 1.05 0.00 0.00 43 T 8.69 4.14 4.36 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 1.27 0.00 0.00 44 D 8.88 4.61 0.00 2.62 2.68 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 0.00 0.00 0.00 0.00 45 I 8.36 4.53 1.86 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 1.35 0.78 0.91 0.00 0.00 46 G 8.46 3.91 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 P 0.00 4.27 0.00 2.21 2.01 0.00 3.66 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.11 0.00 48 L 8.34 4.42 0.00 1.63 1.61 0.93 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 49 S 8.41 3.67 0.00 3.96 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 50 Q 7.58 5.07 0.00 2.14 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.62 0.00 0.00 0.00 0.00 0.00 2.33 2.52 0.00 51 V 8.86 5.03 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 1.15 0.00 0.00 0.82 0.00 0.00 52 I 9.08 5.14 2.02 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 1.28 0.52 0.95 0.00 0.00 53 H 8.44 5.05 0.00 2.37 1.63 0.00 5.57 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *55 W 8.45 4.75 0.00 3.39 2.92 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 56 G 9.03 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 57 Y 8.90 5.08 0.00 2.81 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 58 A 9.04 4.14 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 59 S 7.47 4.59 0.00 4.01 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 60 L 8.24 3.96 0.00 1.67 1.68 0.90 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 61 D 7.98 4.28 0.00 2.74 2.68 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 0.00 0.00 0.00 0.00 62 D 7.89 4.24 0.00 2.80 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 63 R 7.61 3.03 0.00 0.75 1.65 0.00 3.11 0.00 0.00 2.79 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.50 0.00 64 A 7.89 3.88 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.08 3.80 0.00 2.23 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 0.00 2.30 2.22 0.00 66 R 8.17 3.88 0.00 1.92 2.13 0.00 3.53 0.00 0.00 3.40 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.88 0.00 67 R 8.53 3.91 0.00 1.72 1.87 0.00 2.98 0.00 0.00 3.01 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.60 0.00 68 G 7.65 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 0.00 0.00 0.00 69 K 8.23 3.98 0.00 2.00 1.86 0.00 1.79 0.00 0.00 1.57 0.00 0.00 2.83 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.47 1.35 7.81 70 L 7.87 3.69 0.00 1.41 1.55 -0.12 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 71 A 7.74 4.33 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 72 E 7.62 4.40 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 2.31 2.48 0.00 73 D 7.57 4.48 0.00 2.74 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 74 Q 9.08 4.02 0.00 2.19 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.64 0.00 0.00 0.00 0.00 0.00 2.47 2.49 0.00 75 R 8.20 4.01 0.00 2.19 2.05 0.00 3.20 0.00 0.00 3.28 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.74 0.00 76 W 8.43 4.43 0.00 3.41 3.36 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 77 Q 8.54 4.23 0.00 2.27 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.77 0.00 0.00 0.00 0.00 0.00 2.47 2.63 0.00 78 A 7.77 4.20 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 79 F 7.36 4.45 0.00 3.17 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 80 I 7.53 2.89 0.63 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.89 0.71 0.00 0.00 81 P 0.00 4.15 0.00 2.07 1.98 0.00 3.45 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.07 0.00 82 R 7.21 3.80 0.00 1.55 1.76 0.00 3.08 0.00 0.00 3.09 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.49 0.00 83 L 6.94 3.87 0.00 0.78 1.21 0.40 1.14 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 84 S 8.40 4.11 0.00 3.77 3.83 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 85 V 7.43 3.68 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 0.78 0.00 0.00 0.90 0.00 0.00 86 L 8.07 4.43 0.00 2.00 1.84 0.99 0.53 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 87 I 7.22 4.43 1.83 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.58 0.60 0.00 0.00 88 E 8.98 4.41 0.00 1.74 1.85 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 2.24 2.13 0.00 89 S 7.77 4.81 0.00 3.84 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 90 S 8.27 5.37 0.00 3.94 3.53 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 91 E 8.99 4.98 0.00 2.10 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 2.38 2.27 0.00 92 N 8.57 5.67 0.00 2.84 2.88 0.00 0.00 5.86 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 93 R 8.77 4.68 0.00 1.91 2.04 0.00 2.74 0.00 0.00 3.18 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.62 0.00 94 I 8.30 4.98 1.89 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.92 0.94 0.00 0.00 95 L 9.10 4.77 0.00 1.61 1.53 0.93 0.32 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 96 L 8.40 4.82 0.00 1.48 1.58 0.92 1.08 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 97 P 0.00 4.21 0.00 1.97 2.09 0.00 3.65 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.05 0.00 98 T 7.88 4.00 3.38 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 0.92 0.00 0.00 99 D 8.27 4.52 0.00 2.82 2.82 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 0.00 100 F 6.75 4.83 0.00 3.09 3.17 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 0.00 101 S 7.39 4.39 0.00 3.67 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 0.00 102 P 0.00 4.30 0.00 2.08 2.13 0.00 3.74 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.13 0.00 103 L 7.72 4.23 0.00 1.57 1.57 0.90 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 104 R 8.27 4.13 0.00 1.86 1.68 0.00 3.30 0.00 0.00 3.23 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.75 0.00 * Residues marked with a * may have inaccurate shift predictions.