NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 D 4.6172 8.2185 119.5595 53.4391 42.2555 177.1552 6 A 4.0722 7.6754 121.7787 53.1207 19.1229 177.4935 7 H 4.0887 9.1107 116.5230 58.8733 30.6216 175.7188 8 I 3.6730 7.5644 122.0300 64.0273 37.0420 176.3471 9 P 4.2278 0.0000 0.0000 65.7961 31.0975 178.7035 10 Q 3.9652 7.6154 116.5932 58.6823 28.5352 178.4148 11 L 3.8344 7.7856 121.2549 58.2729 42.1171 178.8010 12 I 3.6739 7.9806 119.7399 64.4640 37.0017 178.2329 13 A 3.9639 8.1187 121.1488 55.4455 18.3903 179.6626 14 S 4.0919 8.4912 114.0019 62.0353 62.7867 177.0670 15 E 4.2660 8.8461 122.4275 58.5728 29.1978 179.0689 16 A 4.1383 8.2793 121.0304 55.2979 18.4670 179.3626 17 N 4.2662 8.4374 115.1356 56.4876 38.6207 177.2891 18 F 4.1233 8.3193 121.9427 61.3296 39.4309 177.3761 19 G 3.6608 8.6554 105.4921 47.5902 0.0000 175.5424 20 A 3.9385 8.2925 123.2629 55.1104 18.2650 179.9687 21 K 3.7877 7.6593 115.2852 59.1829 32.0611 179.1824 22 A 3.8885 7.4846 120.2283 55.1717 18.6294 179.2428 23 A 4.1027 7.8472 119.1719 54.9584 18.3589 179.6931 24 L 4.0353 7.9655 117.7405 55.2024 42.0926 179.5899 *26 R 4.2119 8.0296 119.7845 56.4157 32.3935 178.2419 27 S 4.1027 8.0876 111.9328 61.6394 62.3198 176.3119 28 T 3.8726 8.2148 118.7901 66.6946 68.2103 176.5495 29 I 3.8361 7.8608 120.9870 64.5014 37.1932 178.2002 30 A 4.0603 7.9445 120.9587 55.3756 18.2395 179.7883 31 Q 4.0121 8.4839 116.5567 58.9267 28.7074 178.8326 32 A 4.0512 8.3346 122.1495 54.8563 18.1453 179.3530 33 E 3.9668 8.1132 117.2910 59.5474 29.8590 178.6405 34 Q 4.1703 7.9001 116.6761 59.1123 28.8900 178.5741 35 A 4.2124 7.7391 119.8437 54.7669 18.5867 179.2650 36 A 4.3165 7.7901 117.4366 52.8813 18.1347 178.9517 *38 S 4.3340 7.9238 113.5222 59.2593 64.6710 174.0703 39 S 4.9625 8.0026 114.0870 58.3602 63.6306 175.0454 40 Q 3.0243 8.3501 123.0627 60.0861 29.1975 178.5861 41 A 3.6614 7.2446 119.0172 55.0643 18.9936 178.4223 42 F 4.2322 7.4092 113.1109 60.7827 39.4548 175.6001 43 H 4.7781 7.6795 118.9649 54.9534 31.9435 174.1896 *45 G 4.0041 8.7275 111.8844 46.4200 0.0000 174.4378 46 E 3.8924 9.4759 124.3303 59.1369 30.1990 176.3380 47 A 4.0207 7.9394 120.4114 55.0331 18.4377 179.4498 48 S 4.0530 8.0566 110.9708 61.5042 62.5846 175.9011 49 A 3.9943 8.3081 123.5221 55.2419 18.1191 179.2473 50 A 3.9598 7.9727 119.0409 55.3350 18.3641 179.6668 51 F 3.8736 8.0707 118.3746 61.6679 39.5150 177.2977 52 Q 4.1874 9.0669 117.8556 59.0075 28.5985 178.9616 53 A 3.9816 8.5134 121.8749 55.2155 18.6160 179.6253 54 A 3.9472 8.0985 119.2255 55.1760 18.2702 179.5222 55 H 4.0639 8.4544 117.2259 59.4969 30.1910 177.2883 56 A 4.0384 8.3593 122.9784 55.1103 18.0750 179.6918 57 R 3.8049 7.9534 117.0045 59.5170 30.2409 178.4811 58 F 4.0923 8.0605 120.1108 61.4002 39.0158 177.2086 59 V 3.4258 8.2419 118.2710 65.7285 31.0851 177.6525 60 E 3.8595 8.0072 118.8195 59.3688 29.5304 179.0845 61 V 3.5383 7.7944 118.2790 65.7669 31.4633 177.9382 62 S 3.8658 7.7466 114.8900 61.4821 62.5519 176.3664 63 A 3.9757 7.6202 125.1729 55.9403 18.0098 180.5697 64 K 3.9250 7.6488 122.0484 59.8862 31.7103 181.3637 65 V 3.7753 8.1622 120.0745 65.7880 31.3597 177.9504 66 N 4.2796 8.8597 116.5245 56.2708 37.8815 177.1951 67 A 3.9862 8.3027 122.4817 55.1557 18.4195 179.7549 68 L 4.0178 8.2279 117.9186 57.8742 41.6568 179.6297 69 L 4.0862 8.3128 119.3742 57.8973 40.9932 179.1342 70 D 4.4253 8.3555 118.9583 57.4830 40.5590 179.1612 71 I 3.7653 7.4649 118.9561 64.1806 37.2123 178.0727 72 A 4.0144 8.0547 121.6480 55.3912 18.3449 179.5685 73 Q 4.0747 8.5370 116.7547 59.4140 28.6382 179.3970 74 L 4.0554 7.4649 117.3985 57.3705 41.6289 178.8454 75 N 4.6565 7.7312 115.9166 54.9148 38.6576 176.5696 76 I 4.6586 8.2623 111.2538 60.3916 39.6509 174.1187 77 G 4.7861 7.7462 111.3663 44.7370 0.0000 174.1280 78 D 4.3671 10.0339 118.7606 57.7502 41.1735 179.3170 79 A 3.9983 8.0106 120.1451 54.9306 18.5669 179.0082 80 A 3.9769 7.8697 119.1797 55.5060 18.3950 179.9219 81 S 4.2546 8.3386 114.1739 61.0489 62.9549 176.3859 82 S 4.0714 8.0371 116.8138 61.3299 62.1308 175.5088 83 Y 3.9465 8.1559 121.9497 60.7955 38.4723 178.3039 84 V 3.7161 8.1887 118.8845 65.8168 31.5031 177.8962 85 A 3.9495 8.2580 120.6577 55.4236 18.4058 179.7348 86 Q 3.8843 8.4556 117.0081 59.0335 28.8811 178.4355 87 D 4.1006 8.3379 119.3128 57.1637 41.3139 178.1744 88 A 3.9976 8.2283 121.2444 54.9636 18.3864 179.5082 89 A 3.9494 7.7572 119.0592 55.1401 18.3116 179.7635 90 A 3.9367 7.9512 119.0024 55.1349 18.2167 179.7450 91 A 3.9663 7.7107 118.1896 55.0768 18.5011 179.8613 92 S 4.2125 7.6332 112.8016 62.1362 63.0304 176.6524 93 T 4.1601 7.6871 119.1853 67.0491 68.3730 175.0514 *94 Y 4.1553 7.4492 122.8203 56.9881 36.8717 177.6729 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 D 8.22 4.62 0.00 2.62 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 A 7.68 4.07 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 7 H 9.11 4.09 0.00 3.27 3.32 0.00 5.87 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 8 I 7.56 3.67 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 1.57 0.84 0.92 0.00 0.00 9 P 0.00 4.23 0.00 2.15 2.11 0.00 3.72 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.19 0.00 10 Q 7.62 3.97 0.00 2.07 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.81 0.00 0.00 0.00 0.00 0.00 2.37 2.50 0.00 11 L 7.79 3.83 0.00 1.71 1.79 0.93 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 12 I 7.98 3.67 2.01 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 1.47 0.56 0.92 0.00 0.00 13 A 8.12 3.96 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 14 S 8.49 4.09 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 15 E 8.85 4.27 0.00 2.03 2.21 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 2.46 2.29 0.00 16 A 8.28 4.14 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 17 N 8.44 4.27 0.00 2.93 2.92 0.00 0.00 6.69 8.51 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 18 F 8.32 4.12 0.00 3.20 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 19 G 8.66 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 0.00 0.00 0.00 20 A 8.29 3.94 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 21 K 7.66 3.79 0.00 1.58 1.71 0.00 1.66 0.00 0.00 1.65 0.00 0.00 3.01 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.41 1.54 7.81 22 A 7.48 3.89 1.16 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 0.00 0.00 23 A 7.85 4.10 1.35 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 24 L 7.97 4.04 0.00 1.77 1.66 0.90 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 *26 R 8.03 4.21 0.00 2.05 2.00 0.00 3.11 0.00 0.00 3.38 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.79 0.00 27 S 8.09 4.10 0.00 3.99 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 28 T 8.21 3.87 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 1.24 0.00 0.00 29 I 7.86 3.84 2.02 0.00 0.00 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 1.59 0.81 0.83 0.00 0.00 30 A 7.94 4.06 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 31 Q 8.48 4.01 0.00 2.25 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.76 0.00 0.00 0.00 0.00 0.00 2.40 2.59 0.00 32 A 8.33 4.05 1.45 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 33 E 8.11 3.97 0.00 2.36 2.34 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 2.45 2.52 0.00 34 Q 7.90 4.17 0.00 2.28 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.76 0.00 0.00 0.00 0.00 0.00 2.43 2.64 0.00 35 A 7.74 4.21 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 36 A 7.79 4.32 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 *38 S 7.92 4.33 0.00 4.03 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 39 S 8.00 4.96 0.00 4.14 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 40 Q 8.35 3.02 0.00 1.81 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.64 0.00 0.00 0.00 0.00 0.00 2.36 2.26 0.00 41 A 7.24 3.66 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 F 7.41 4.23 0.00 2.69 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 43 H 7.68 4.78 0.00 3.09 3.23 0.00 5.69 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 *45 G 8.73 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 46 E 9.48 3.89 0.00 2.06 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 2.39 2.39 0.00 47 A 7.94 4.02 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 48 S 8.06 4.05 0.00 3.94 4.12 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 49 A 8.31 3.99 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.97 3.96 1.45 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 51 F 8.07 3.87 0.00 3.22 3.24 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 52 Q 9.07 4.19 0.00 2.31 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.58 0.00 0.00 0.00 0.00 0.00 2.52 2.69 0.00 53 A 8.51 3.98 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 54 A 8.10 3.95 1.22 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 55 H 8.45 4.06 0.00 3.14 3.48 0.00 5.62 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 A 8.36 4.04 1.36 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 0.00 0.00 57 R 7.95 3.80 0.00 2.04 2.17 0.00 3.15 0.00 0.00 3.09 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.70 0.00 58 F 8.06 4.09 0.00 3.22 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 59 V 8.24 3.43 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 0.90 0.00 0.00 0.91 0.00 0.00 60 E 8.01 3.86 0.00 2.08 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 2.26 2.28 0.00 61 V 7.79 3.54 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 0.95 0.00 0.00 0.92 0.00 0.00 62 S 7.75 3.87 0.00 3.78 3.68 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 63 A 7.62 3.98 1.35 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 64 K 7.65 3.93 0.00 1.72 1.83 0.00 1.82 0.00 0.00 1.57 0.00 0.00 2.85 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.37 1.31 7.81 65 V 8.16 3.78 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 1.02 0.00 0.00 0.91 0.00 0.00 66 N 8.86 4.28 0.00 2.91 2.82 0.00 0.00 6.88 7.75 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 67 A 8.30 3.99 1.36 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 0.00 0.00 68 L 8.23 4.02 0.00 1.88 1.74 0.92 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 69 L 8.31 4.09 0.00 1.82 1.72 0.94 1.00 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 70 D 8.36 4.43 0.00 2.97 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 71 I 7.46 3.77 2.03 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 1.45 1.14 0.90 0.00 0.00 72 A 8.05 4.01 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 0.00 0.00 0.00 0.00 0.00 0.00 73 Q 8.54 4.07 0.00 2.25 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.75 0.00 0.00 0.00 0.00 0.00 2.67 2.59 0.00 74 L 7.46 4.06 0.00 1.64 1.71 0.92 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 75 N 7.73 4.66 0.00 2.57 2.78 0.00 0.00 6.77 7.53 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 76 I 8.26 4.66 1.55 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.15 0.75 0.00 0.00 77 G 7.75 4.79 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 0.00 0.00 0.00 78 D 10.03 4.37 0.00 2.79 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 79 A 8.01 4.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.87 3.98 1.52 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 0.00 0.00 81 S 8.34 4.25 0.00 4.18 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 82 S 8.04 4.07 0.00 4.06 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 83 Y 8.16 3.95 0.00 3.16 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 84 V 8.19 3.72 2.27 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 1.06 0.00 0.00 1.04 0.00 0.00 85 A 8.26 3.95 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 86 Q 8.46 3.88 0.00 1.91 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.75 0.00 0.00 0.00 0.00 0.00 2.34 2.46 0.00 87 D 8.34 4.10 0.00 2.14 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 88 A 8.23 4.00 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 89 A 7.76 3.95 1.35 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 90 A 7.95 3.94 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 91 A 7.71 3.97 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 92 S 7.63 4.21 0.00 4.01 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 93 T 7.69 4.16 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 *94 Y 7.45 4.16 0.00 2.31 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 * Residues marked with a * may have inaccurate shift predictions.