NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.2790 8.2649 123.5795 52.2057 19.9422 176.5095 2 C 4.6980 8.3565 116.9359 55.1414 41.7395 172.7734 3 D 4.2769 9.5184 125.6501 56.7153 42.5715 176.2521 4 Y 4.9032 8.4691 115.9056 56.5640 42.5710 174.5697 5 T 4.9040 9.9627 121.8967 62.3515 71.5638 172.8856 6 C 4.9872 9.3676 126.5652 55.6535 41.2342 177.3381 7 G 3.9985 8.9490 116.7162 46.5494 0.0000 172.6041 8 S 4.3894 9.2240 118.6843 59.7773 64.5601 174.3688 9 N 4.2536 8.4025 119.1386 52.5147 38.9768 172.9495 10 C 4.8425 8.1737 122.8859 55.2817 46.0740 172.1249 11 Y 5.2275 9.1157 124.9428 56.2718 40.8565 175.4331 12 S 5.1849 8.8607 117.0221 56.7605 65.9855 175.1953 13 S 4.3246 9.2566 117.2457 62.3074 62.6771 177.2828 14 S 4.0844 7.8038 113.9701 61.3057 62.1184 176.0808 15 D 4.3100 8.1677 121.6628 57.3301 40.6980 178.5945 16 V 3.3535 7.7585 118.1548 66.1885 31.4396 177.7305 17 S 4.0203 8.2468 112.8573 61.6754 62.0548 176.3635 18 T 3.8041 7.8072 117.6827 66.4236 68.1649 176.6698 19 A 4.0297 7.8089 122.4276 55.2839 18.4865 179.3030 20 Q 3.5973 8.0350 117.8385 59.3728 28.8891 178.6357 21 A 3.8241 7.8500 121.3697 54.7466 18.4300 179.5680 22 A 3.8889 7.6010 119.4964 55.0879 18.4463 180.1823 23 G 2.9357 7.5477 104.3150 47.9273 0.0000 175.4741 24 Y 4.0063 7.2611 122.0987 59.7162 38.6215 177.9893 25 K 3.8557 7.6307 121.0870 59.2511 32.2369 178.7912 26 L 3.8550 7.6088 118.9569 58.2157 41.4162 178.6754 27 H 3.8481 7.9468 116.7259 59.6072 29.6372 176.3418 28 E 3.7526 7.5219 119.9740 59.0592 29.5652 178.0657 29 D 4.4961 7.6372 117.1329 54.6736 41.1872 176.5854 30 G 3.7434 8.2595 107.2297 46.7036 0.0000 173.0913 31 E 4.7313 8.0672 116.9714 54.2196 32.6693 175.4997 32 T 4.8842 8.0526 111.0545 60.2297 71.8727 173.8242 33 V 4.1754 8.6381 118.9003 62.3950 33.9762 173.8079 34 G 4.1829 8.9937 110.8004 44.4253 0.0000 173.4857 35 S 4.4056 8.4962 111.6456 59.8184 63.4147 174.5745 36 N 4.5349 8.1338 116.7740 52.1601 39.2009 174.8124 37 S 3.7340 7.2925 112.2437 59.8053 60.8032 171.3946 38 Y 4.8861 8.3822 119.0775 56.7362 39.7656 174.8208 39 P 5.6930 0.0000 0.0000 62.0637 33.5041 174.6049 40 H 5.2909 8.3877 115.5081 54.1329 32.3276 171.8463 41 K 4.4672 8.7972 116.8966 56.3673 33.1260 175.9843 42 Y 4.4604 7.9180 125.0389 56.3322 39.1671 175.3489 43 N 4.1300 7.7436 124.7332 54.6239 39.5808 175.1589 44 N 3.8716 6.1506 114.1233 53.7403 36.3203 175.8866 45 W 4.4551 7.2421 118.0864 59.6117 29.7536 178.2023 46 E 3.7675 8.0672 117.1482 57.2247 29.3592 176.5260 47 G 3.5725 7.2151 105.0785 46.1590 0.0000 173.8473 48 F 4.5146 7.0317 115.9511 57.0006 40.1499 176.9246 49 D 4.5930 8.2012 124.6168 52.4991 39.8042 175.5307 50 F 4.6547 7.7334 124.6621 57.9450 39.8295 176.7973 *51 S 4.6522 8.8272 119.4895 58.3208 62.2600 173.5709 52 V 4.6977 7.3838 117.7441 60.6467 34.1679 175.0092 53 S 4.5545 8.4060 114.5526 57.0899 63.2090 173.6129 54 S 3.1454 8.1135 120.7083 56.8864 62.1774 171.3626 55 P 4.2457 0.0000 0.0000 62.3679 33.2425 174.2545 56 Y 5.2320 7.7598 116.1462 56.5245 41.7469 174.6326 57 Y 5.0344 8.5408 118.1386 56.2420 42.3938 174.4020 58 E 5.1358 9.0791 121.0855 55.1732 33.3592 174.1918 59 Y 4.8700 8.1996 120.4820 55.6258 42.7490 172.1512 60 P 4.3728 0.0000 0.0000 62.7671 32.1110 175.1888 61 I 4.3483 8.0910 122.5237 59.1575 40.2654 174.5552 62 L 4.8056 8.2501 128.7420 52.7224 43.6432 177.7894 63 S 4.4237 8.8623 117.3684 61.2648 63.2115 175.8419 64 S 4.1567 8.0852 114.9797 59.6611 62.8152 174.5135 65 G 4.1041 8.1230 108.4936 45.5254 0.0000 173.6870 66 D 4.6166 7.5363 118.2963 53.7556 41.5654 175.8861 67 V 4.0977 7.9550 120.4000 61.8984 32.5347 175.2112 68 Y 4.2954 8.4740 127.6488 58.0248 39.1088 176.1495 69 S 4.3055 7.9842 118.6022 57.5165 64.3674 172.8201 70 G 3.8578 7.1520 105.7297 44.2745 0.0000 174.3553 71 G 3.8539 8.3113 108.8576 43.9380 0.0000 172.8095 72 S 4.1144 8.6703 112.2528 58.6395 62.2646 172.7957 73 P 3.7082 0.0000 0.0000 62.5939 32.1126 177.5199 74 G 3.7376 7.5610 107.5066 44.9899 0.0000 172.3408 75 A 4.7206 8.4444 117.6832 51.9016 21.6045 176.4299 76 D 5.4325 8.0083 115.7649 52.8524 43.2929 175.8958 77 R 4.9814 9.0137 121.2326 54.2061 34.8880 174.3471 78 V 4.3477 8.5739 120.9704 59.8709 34.0654 174.5614 79 V 4.5540 8.7882 125.8010 60.9827 33.4749 174.3998 80 F 6.0733 8.7824 122.0095 54.3025 42.2505 172.7880 81 N 5.6959 8.5795 115.5919 50.7905 40.2606 174.5450 82 E 4.3376 8.3939 115.6326 59.2828 29.5961 177.3758 83 N 4.6567 8.4525 113.3514 52.6543 39.1589 173.7742 84 N 3.8686 8.3779 116.0163 54.8074 37.3830 173.6487 85 Q 4.5583 8.1671 114.8475 53.6549 31.2911 175.2587 86 L 4.5167 8.2470 122.6538 54.2494 42.3512 176.4789 87 A 3.7995 9.1541 131.0439 53.0961 18.7195 177.1866 88 G 3.6198 6.1157 100.8655 45.6970 0.0000 170.3098 89 V 4.5252 7.3308 118.5077 60.8872 34.4137 175.4766 90 I 4.9404 8.2068 120.5331 59.5357 41.2120 174.0306 91 T 5.2891 8.9411 115.8282 61.4945 70.7397 174.1488 92 H 4.5800 9.1611 122.5497 57.0260 29.3593 176.2058 93 T 4.0868 7.5763 116.3700 64.9463 68.5632 174.0618 94 G 3.9440 9.0102 112.5041 46.0559 0.0000 172.7017 95 A 4.7187 7.8520 121.5115 49.4149 21.5576 177.1582 96 S 4.2208 8.8014 117.5422 59.5978 64.1541 174.4800 97 G 4.1761 8.1115 115.3735 47.3933 0.0000 173.4805 98 N 4.6746 8.7781 120.8732 52.6726 38.4626 174.2244 99 N 4.8037 8.3436 118.1983 53.4170 39.3218 173.4883 100 F 5.3492 8.8284 117.2009 56.1148 42.5058 175.4706 101 V 4.9368 9.0937 114.5050 59.7433 35.7467 174.9270 102 E 4.5611 8.7389 122.1661 55.8314 30.7360 176.9612 103 C 4.7600 8.7341 120.9274 56.8996 39.6992 174.1847 104 T 4.1314 8.8263 112.5919 61.9297 68.6731 174.5318 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 A 8.26 4.28 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 2 C 8.36 4.70 0.00 3.02 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 3 D 9.52 4.28 0.00 2.74 2.45 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 4 Y 8.47 4.90 0.00 2.99 2.86 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 0.00 0.00 0.00 5 T 9.96 4.90 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 1.22 0.00 0.00 6 C 9.37 4.99 0.00 3.27 3.35 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 7 G 8.95 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 9.22 4.39 0.00 3.86 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 9 N 8.40 4.25 0.00 2.24 1.96 0.00 0.00 6.35 7.30 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 10 C 8.17 4.84 0.00 2.85 2.86 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 0.00 0.00 0.00 11 Y 9.12 5.23 0.00 2.97 2.76 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 12 S 8.86 5.18 0.00 3.97 4.02 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 13 S 9.26 4.32 0.00 3.94 4.03 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 0.00 0.00 0.00 0.00 14 S 7.80 4.08 0.00 3.96 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 15 D 8.17 4.31 0.00 3.13 2.76 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 16 V 7.76 3.35 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 0.76 0.00 0.00 0.38 0.00 0.00 17 S 8.25 4.02 0.00 3.98 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 18 T 7.81 3.80 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 1.21 0.00 0.00 19 A 7.81 4.03 1.37 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 0.00 0.00 0.00 20 Q 8.03 3.60 0.00 2.01 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.75 0.00 0.00 0.00 0.00 0.00 2.01 1.89 0.00 21 A 7.85 3.82 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 22 A 7.60 3.89 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 23 G 7.55 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 0.00 0.00 0.00 24 Y 7.26 4.01 0.00 2.27 2.66 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 25 K 7.63 3.86 0.00 1.83 1.95 0.00 1.76 0.00 0.00 1.60 0.00 0.00 3.00 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.38 1.45 7.81 26 L 7.61 3.86 0.00 1.84 1.93 0.97 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 27 H 7.95 3.85 0.00 3.04 3.40 0.00 5.95 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 E 7.52 3.75 0.00 2.07 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 2.17 2.00 0.00 29 D 7.64 4.50 0.00 2.63 2.66 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 30 G 8.26 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 31 E 8.07 4.73 0.00 1.92 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 0.00 2.19 2.23 0.00 32 T 8.05 4.88 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 1.28 0.00 0.00 33 V 8.64 4.18 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 0.87 0.00 0.00 0.98 0.00 0.00 34 G 8.99 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 0.00 0.00 0.00 35 S 8.50 4.41 0.00 4.02 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 36 N 8.13 4.53 0.00 2.18 2.40 0.00 0.00 7.08 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 37 S 7.29 3.73 0.00 3.99 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 38 Y 8.38 4.89 0.00 3.24 2.99 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 39 P 0.00 5.69 0.00 2.31 2.52 0.00 3.48 0.00 0.00 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.14 0.00 40 H 8.39 5.29 0.00 3.27 3.62 0.00 5.64 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 K 8.80 4.47 0.00 1.58 1.56 0.00 1.67 0.00 0.00 1.63 0.00 0.00 2.96 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.20 1.25 7.81 42 Y 7.92 4.46 0.00 2.81 2.86 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 0.00 0.00 0.00 43 N 7.74 4.13 0.00 1.54 2.83 0.00 0.00 7.31 8.00 0.00 0.00 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 N 6.15 3.87 0.00 2.90 3.03 0.00 0.00 7.21 7.95 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 45 W 7.24 4.46 0.00 3.39 3.08 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 0.00 0.00 0.00 46 E 8.07 3.77 0.00 1.16 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 2.43 2.43 0.00 47 G 7.22 3.57 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 0.00 0.00 0.00 48 F 7.03 4.51 0.00 1.82 2.48 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.20 4.59 0.00 2.61 2.61 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 0.00 0.00 0.00 0.00 50 F 7.73 4.65 0.00 3.22 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 *51 S 8.83 4.65 0.00 3.63 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 52 V 7.38 4.70 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 1.04 0.00 0.00 1.00 0.00 0.00 53 S 8.41 4.55 0.00 3.90 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 54 S 8.11 3.15 0.00 3.59 3.52 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 55 P 0.00 4.25 0.00 1.81 1.99 0.00 3.71 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 1.98 0.00 56 Y 7.76 5.23 0.00 3.12 2.75 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 57 Y 8.54 5.03 0.00 1.94 2.46 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 58 E 9.08 5.14 0.00 1.88 1.87 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 2.15 2.23 0.00 59 Y 8.20 4.87 0.00 3.26 2.93 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 60 P 0.00 4.37 0.00 1.33 1.03 0.00 2.20 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.44 0.00 61 I 8.09 4.35 1.54 0.00 0.00 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.73 0.17 0.00 0.00 62 L 8.25 4.81 0.00 1.97 1.59 1.08 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 63 S 8.86 4.42 0.00 4.01 4.08 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 0.00 0.00 0.00 64 S 8.09 4.16 0.00 4.03 4.09 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 0.00 0.00 0.00 65 G 8.12 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 66 D 7.54 4.62 0.00 2.74 2.64 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 67 V 7.96 4.10 2.15 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 0.93 0.00 0.00 0.97 0.00 0.00 68 Y 8.47 4.30 0.00 2.63 2.48 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.98 4.31 0.00 3.85 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 70 G 7.15 3.86 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 0.00 0.00 0.00 0.00 0.00 0.00 71 G 8.31 3.85 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 0.00 0.00 0.00 72 S 8.67 4.11 0.00 3.89 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 73 P 0.00 3.71 0.00 1.75 1.71 0.00 3.91 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 2.07 0.00 74 G 7.56 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 75 A 8.44 4.72 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 76 D 8.01 5.43 0.00 2.71 2.53 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 77 R 9.01 4.98 0.00 1.27 1.53 0.00 3.21 0.00 0.00 2.93 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.69 0.00 78 V 8.57 4.35 1.90 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 0.89 0.00 0.00 0.73 0.00 0.00 79 V 8.79 4.55 1.37 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 0.43 0.00 0.00 0.23 0.00 0.00 80 F 8.78 6.07 0.00 3.22 3.03 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 0.00 0.00 0.00 0.00 81 N 8.58 5.70 0.00 3.09 3.21 0.00 0.00 5.54 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 82 E 8.39 4.34 0.00 2.10 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 0.00 2.44 2.47 0.00 83 N 8.45 4.66 0.00 2.90 2.83 0.00 0.00 6.91 8.00 0.00 0.00 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 N 8.38 3.87 0.00 1.44 2.37 0.00 0.00 7.00 6.85 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 85 Q 8.17 4.56 0.00 2.29 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.72 0.00 0.00 0.00 0.00 0.00 2.27 2.31 0.00 86 L 8.25 4.52 0.00 1.55 1.54 0.83 0.95 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 87 A 9.15 3.80 0.02 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 0.00 0.00 88 G 6.12 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 89 V 7.33 4.53 1.82 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 0.86 0.00 0.00 0.09 0.00 0.00 90 I 8.21 4.94 1.57 0.00 0.00 -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 0.42 0.44 0.46 0.00 0.00 91 T 8.94 5.29 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 1.30 0.00 0.00 92 H 9.16 4.58 0.00 3.19 3.22 0.00 5.69 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 T 7.58 4.09 4.30 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 1.24 0.00 0.00 94 G 9.01 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 95 A 7.85 4.72 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 96 S 8.80 4.22 0.00 3.88 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 G 8.11 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 0.00 0.00 0.00 98 N 8.78 4.67 0.00 2.75 2.86 0.00 0.00 6.79 8.00 0.00 0.00 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 N 8.34 4.80 0.00 2.94 2.84 0.00 0.00 6.77 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 0.00 100 F 8.83 5.35 0.00 3.34 3.09 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 0.00 0.00 0.00 101 V 9.09 4.94 2.20 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 0.90 0.00 0.00 1.14 0.00 0.00 102 E 8.74 4.56 0.00 1.55 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 2.19 1.47 0.00 103 C 8.73 4.76 0.00 2.95 3.19 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 0.00 104 T 8.83 4.13 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 1.22 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.