NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 Q 4.2883 8.4445 118.8281 55.4647 29.9554 175.5285 4 L 4.2463 8.3574 119.7154 52.8463 41.7785 175.9604 5 T 4.7893 7.9015 110.2537 59.5106 73.9944 174.6263 6 E 4.0465 8.7985 122.1771 60.3666 29.3722 179.8767 7 E 3.9487 8.0240 118.5594 61.1265 29.9775 181.7365 8 Q 3.8194 7.9434 119.4214 58.3635 28.6344 178.6311 9 I 3.9090 7.8582 120.7640 64.4866 37.1869 178.2168 10 A 3.9652 7.8168 120.8355 55.2237 18.2629 179.4196 11 E 3.9235 7.8984 116.8284 59.8290 29.5341 179.8116 12 F 5.0716 8.1126 117.6078 60.5056 38.7251 177.7005 13 K 3.8740 8.4265 119.0315 59.2210 32.2039 178.5916 14 E 4.1072 8.4680 118.8051 59.4173 29.0506 178.7462 15 A 4.2529 8.7356 121.1668 55.7050 18.3727 179.3583 16 F 3.3107 8.8778 119.1478 61.3991 39.1943 177.5192 17 S 4.0620 8.2287 114.7396 61.5277 62.4258 176.4947 18 L 3.7724 7.4658 119.3417 57.0855 41.2999 178.5785 19 F 4.5985 7.1953 115.6736 57.7146 41.3448 176.3641 20 D 4.4778 7.7821 121.4554 53.5332 38.9569 177.3674 21 K 3.9442 8.0948 125.4280 57.2591 32.2374 177.7735 22 D 4.5732 7.9077 114.8809 52.8100 39.2874 176.3723 23 G 3.9940 7.4845 107.6182 46.9518 0.0000 174.2546 24 D 4.5389 8.4226 117.2194 53.0986 39.5906 177.1638 25 G 4.2405 10.3224 110.2418 45.2786 0.0000 172.9688 26 T 5.1854 7.6025 108.8775 59.9590 72.0157 173.4041 27 I 4.6527 9.1615 126.0844 60.3666 39.1464 175.3646 28 T 4.8411 9.0026 117.6601 59.9608 71.4907 175.7136 29 T 3.9537 8.7210 114.7387 65.7086 68.4649 176.7975 30 K 3.9552 8.0560 125.8296 59.7964 31.6898 180.7502 31 E 4.1872 8.3201 119.6313 59.1719 29.4400 179.5991 32 L 4.2368 8.2309 120.5137 58.1861 42.2474 179.2554 33 G 3.7021 8.3997 105.8257 47.9518 0.0000 175.8466 34 T 3.8712 8.0208 117.9661 66.6040 68.4177 176.9440 35 V 3.5124 7.5402 120.2665 66.1478 31.4723 177.8777 36 M 4.1000 8.0573 118.3995 58.5588 31.7804 178.9095 37 R 4.4368 8.3405 119.6931 58.7276 30.0788 178.9619 38 S 4.3747 7.8427 111.8953 60.0054 63.1970 175.2344 39 L 4.5641 7.3819 121.4118 53.9611 41.7046 176.4249 40 G 3.8626 8.3679 107.2332 46.5552 0.0000 173.7178 41 Q 4.7754 8.3911 117.7418 53.9188 31.8355 174.8906 42 N 5.2612 8.2508 116.5797 50.9483 38.7105 172.5412 43 P 4.5072 0.0000 0.0000 62.2700 33.2219 177.9773 44 T 4.2478 8.1828 110.8464 61.0147 71.2926 175.1138 45 E 3.8680 8.8573 122.8097 59.9942 29.5025 179.4089 46 A 4.0996 8.1393 122.2906 55.5638 18.4555 179.8209 47 E 3.9446 7.9764 117.1553 61.3832 29.7529 182.1796 48 L 4.2049 7.8581 119.9568 57.6015 41.6110 179.4666 49 Q 4.0106 7.9979 117.8771 59.3886 28.6372 179.0320 50 D 4.3097 8.1365 119.5823 57.4072 40.5436 178.8561 51 M 4.0080 7.8178 118.4866 58.4766 32.3420 178.3632 52 I 3.8537 7.8377 119.8729 64.7051 36.8580 178.2362 53 N 4.3708 8.7777 117.4874 56.3690 38.1325 177.1379 54 E 4.1413 7.9225 118.4080 58.1901 29.5847 177.6318 55 V 4.2788 7.5664 115.6655 62.2583 33.6614 175.6913 56 D 4.5997 7.6064 119.3761 52.9442 39.4280 175.8773 57 A 3.9657 8.2428 126.0257 54.8176 18.7709 178.7818 58 D 4.4824 8.6445 112.2610 53.2441 39.8881 177.1346 59 G 3.9004 8.0829 107.9305 46.5405 0.0000 174.2457 60 N 4.5360 8.4790 115.6531 52.7278 37.7993 175.9298 61 G 4.0385 9.5157 108.5748 45.1592 0.0000 172.9643 62 T 4.8972 7.7018 107.5763 59.9702 72.7570 173.2490 63 I 4.8482 8.4581 122.1833 59.7688 39.8581 175.7967 64 D 5.3813 9.0535 127.4500 51.2468 42.0561 177.3820 65 F 3.4522 8.5182 119.0687 60.7400 39.1258 175.1497 66 P 3.9271 0.0000 0.0000 65.2924 31.1036 178.4153 67 E 3.8643 8.7311 117.8476 59.2076 29.3540 179.0725 68 F 3.9348 8.2288 120.6385 61.2149 39.4855 176.8015 69 L 3.6062 7.9600 120.1634 58.2664 41.7996 178.7931 70 T 3.7053 7.7663 115.7474 66.8885 68.2502 175.9359 71 M 3.7884 7.6189 119.5824 59.0211 32.1149 178.2239 72 M 3.5364 7.5197 118.4526 58.0422 31.6651 178.7015 73 A 3.9886 7.8088 120.4703 54.9916 18.5882 179.2929 74 R 3.9250 7.6455 116.4091 58.7228 30.2217 177.9037 75 K 4.5533 7.2468 114.9927 55.2481 32.7495 176.1614 76 M 4.5630 7.5210 121.8613 54.5994 35.2041 175.7015 *82 E 4.3215 8.8860 121.5981 55.9703 32.2663 174.7710 83 E 4.0647 8.2815 119.8497 62.8048 29.7178 184.7005 84 E 4.1035 8.3839 120.4169 61.7574 29.8698 181.4201 85 I 4.1489 7.4903 122.1767 65.9492 35.6394 182.2395 86 R 4.0676 7.6194 122.0443 61.2277 28.8876 180.4256 87 E 4.0451 8.2488 116.5000 60.0874 29.2355 178.9078 88 A 4.1470 8.2226 122.6084 55.8636 18.2577 180.2096 *89 F 3.5194 7.7918 120.1509 62.4573 37.9810 180.2937 90 R 4.4474 7.4210 119.4166 60.5348 29.8257 180.1430 91 V 3.8231 7.1513 122.3844 62.9050 30.0221 176.0496 *101 S 4.2948 8.1311 124.7144 59.2440 64.9717 172.4117 102 A 4.1719 8.5011 126.7735 55.1672 17.9590 180.1311 103 A 3.9823 8.0068 119.6656 56.0540 18.7912 179.8751 104 E 4.0984 8.3844 117.5867 61.3853 29.9984 181.5545 105 L 4.6327 8.8471 124.0413 60.0391 40.6754 184.3532 106 R 4.3530 7.8315 124.0269 61.5036 28.9320 180.5940 *107 H 4.2456 7.9482 115.5705 59.0785 28.3910 183.3034 108 V 3.7788 8.0617 119.0429 63.9292 31.5812 179.1596 109 M 4.5033 7.1720 116.1848 53.2139 33.5069 178.4229 *115 K 4.3709 8.5795 120.2393 56.1386 33.8299 177.0189 116 L 4.4470 7.7340 120.1634 53.8734 41.3631 178.6860 117 T 4.5818 8.5114 115.5682 63.7107 71.0414 174.9704 118 D 4.5397 8.5523 122.3686 60.6309 39.9345 176.7488 119 E 4.1814 8.2066 119.1303 61.3730 29.6864 181.3671 120 E 4.4766 7.8450 118.6804 59.5522 29.4175 180.6266 121 V 3.6752 7.6843 119.9991 66.0374 31.6550 182.3774 122 D 4.7127 8.1044 119.2519 57.0101 40.5285 178.5387 123 E 3.9821 8.0226 119.6998 59.5941 29.5088 178.6164 124 M 4.0113 7.7005 117.2517 58.6288 32.2225 178.5680 125 I 3.7749 8.3542 120.0507 64.3273 37.3605 178.0872 126 R 3.8344 8.7763 120.3134 59.8685 29.5894 178.0891 127 E 3.9893 8.3391 117.8791 59.2914 29.7353 178.4274 128 A 4.2593 7.9406 119.9669 54.0282 19.2991 177.6015 129 D 4.5155 7.4814 118.2382 55.0104 39.3067 176.6407 130 I 3.9478 8.1571 122.1328 62.4379 35.9895 177.0996 131 D 4.4491 9.6477 120.4701 54.1784 39.4589 176.2054 132 G 3.7251 8.1826 107.8353 46.9052 0.0000 173.5816 133 D 4.6676 8.8385 116.5426 52.5635 40.3452 176.8389 134 G 3.9867 11.3000 111.8127 46.1831 0.0000 173.8287 135 Q 4.5781 8.0258 118.2278 54.1150 32.4264 179.9843 136 V 4.4071 8.3828 115.6570 61.2029 33.4785 175.3861 137 N 5.1294 8.7549 127.7357 52.6154 40.2396 173.4896 *138 Y 4.3595 8.5197 129.9519 62.2498 36.5654 177.3088 139 E 4.1473 8.3659 120.0305 61.2764 29.5534 180.6761 140 E 4.4159 8.0361 118.3735 58.2805 30.0331 178.3501 141 F 4.0292 8.9225 123.8144 61.8658 39.2763 178.1716 142 V 3.8278 8.9000 122.3019 66.9892 31.2853 181.2591 143 Q 4.2638 7.5369 119.4263 59.9963 27.9368 179.7702 144 M 4.3271 8.1379 117.2755 57.9302 32.3397 177.2365 145 M 4.3897 7.9232 119.9525 57.0032 33.0208 176.7007 146 T 4.2389 8.1509 115.4767 60.7209 69.1466 177.0407 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 3 Q 8.44 4.29 0.00 2.19 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.96 0.00 0.00 0.00 0.00 0.00 2.24 2.38 0.00 4 L 8.36 4.25 0.00 1.77 1.50 0.92 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 5 T 7.90 4.79 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 1.21 0.00 0.00 6 E 8.80 4.05 0.00 2.21 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 0.00 2.36 2.38 0.00 7 E 8.02 3.95 0.00 2.00 2.00 0.00 0.00 0.00 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 1.97 0.00 8 Q 7.94 3.82 0.00 2.14 1.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.73 0.00 0.00 0.00 0.00 0.00 2.19 2.28 0.00 9 I 7.86 3.91 2.08 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.70 1.08 0.00 0.00 10 A 7.82 3.97 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 11 E 7.90 3.92 0.00 1.84 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 2.27 2.47 0.00 12 F 8.11 5.07 0.00 3.53 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 13 K 8.43 3.87 0.00 1.56 1.96 0.00 0.61 0.00 0.00 0.61 0.00 0.00 2.61 0.00 0.00 2.64 0.00 0.00 0.00 0.00 1.22 1.32 7.81 14 E 8.47 4.11 0.00 2.36 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 2.35 2.48 0.00 15 A 8.74 4.25 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 0.00 0.00 0.00 0.00 0.00 16 F 8.88 3.31 0.00 2.90 3.11 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 0.00 0.00 0.00 0.00 17 S 8.23 4.06 0.00 4.15 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 18 L 7.47 3.77 0.00 1.43 1.38 0.98 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 19 F 7.20 4.60 0.00 2.89 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 20 D 7.78 4.48 0.00 1.95 2.32 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 21 K 8.09 3.94 0.00 1.82 1.71 0.00 1.86 0.00 0.00 1.76 0.00 0.00 2.96 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.36 1.00 7.81 22 D 7.91 4.57 0.00 2.82 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 23 G 7.48 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 0.00 0.00 0.00 24 D 8.42 4.54 0.00 2.86 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 25 G 10.32 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 0.00 0.00 0.00 0.00 26 T 7.60 5.19 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 1.35 0.00 0.00 27 I 9.16 4.65 1.88 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.30 0.93 0.00 0.00 28 T 9.00 4.84 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 1.23 0.00 0.00 29 T 8.72 3.95 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 1.22 0.00 0.00 30 K 8.06 3.96 0.00 1.78 1.85 0.00 1.81 0.00 0.00 1.82 0.00 0.00 2.89 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.45 1.11 7.81 31 E 8.32 4.19 0.00 2.03 2.16 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 2.32 2.33 0.00 32 L 8.23 4.24 0.00 1.89 1.93 1.06 0.87 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 33 G 8.40 3.70 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 0.00 0.00 0.00 34 T 8.02 3.87 4.39 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 1.18 0.00 0.00 35 V 7.54 3.51 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 0.73 0.00 0.00 0.72 0.00 0.00 36 M 8.06 4.10 0.00 2.16 2.14 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.81 2.66 0.00 37 R 8.34 4.44 0.00 2.04 1.98 0.00 3.13 0.00 0.00 3.32 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.67 0.00 38 S 7.84 4.37 0.00 4.02 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 39 L 7.38 4.56 0.00 1.76 1.74 0.96 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 40 G 8.37 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 41 Q 8.39 4.78 0.00 2.19 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.44 6.82 0.00 0.00 0.00 0.00 0.00 2.28 2.30 0.00 42 N 8.25 5.26 0.00 2.64 2.73 0.00 0.00 6.99 8.02 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 43 P 0.00 4.51 0.00 2.19 2.06 0.00 3.77 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.97 0.00 44 T 8.18 4.25 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 1.21 0.00 0.00 45 E 8.86 3.87 0.00 2.10 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 0.00 2.39 2.48 0.00 46 A 8.14 4.10 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 47 E 7.98 3.94 0.00 1.94 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 2.25 2.23 0.00 48 L 7.86 4.20 0.00 1.88 1.76 1.02 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 49 Q 8.00 4.01 0.00 2.25 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.80 0.00 0.00 0.00 0.00 0.00 2.39 2.57 0.00 50 D 8.14 4.31 0.00 2.87 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 51 M 7.82 4.01 0.00 2.00 2.27 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.82 2.58 0.00 52 I 7.84 3.85 2.01 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 1.70 0.96 0.96 0.00 0.00 53 N 8.78 4.37 0.00 2.68 2.86 0.00 0.00 7.09 8.31 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 54 E 7.92 4.14 0.00 1.88 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 2.32 2.30 0.00 55 V 7.57 4.28 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 0.74 0.00 0.00 0.84 0.00 0.00 56 D 7.61 4.60 0.00 2.97 2.55 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 0.00 57 A 8.24 3.97 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 58 D 8.64 4.48 0.00 2.79 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 59 G 8.08 3.90 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 0.00 0.00 0.00 60 N 8.48 4.54 0.00 2.87 3.02 0.00 0.00 7.13 6.52 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 61 G 9.52 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 62 T 7.70 4.90 4.41 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 1.24 0.00 0.00 63 I 8.46 4.85 2.00 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 1.34 0.73 1.14 0.00 0.00 64 D 9.05 5.38 0.00 2.86 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 65 F 8.52 3.45 0.00 2.03 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 66 P 0.00 3.93 0.00 2.13 2.01 0.00 3.85 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.19 0.00 67 E 8.73 3.86 0.00 2.15 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 2.31 2.40 0.00 68 F 8.23 3.93 0.00 3.39 3.05 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 69 L 7.96 3.61 0.00 0.73 1.28 1.10 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 70 T 7.77 3.71 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 1.13 0.00 0.00 71 M 7.62 3.79 0.00 1.90 1.85 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.22 0.00 72 M 7.52 3.54 0.00 0.51 0.93 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.78 0.00 73 A 7.81 3.99 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 74 R 7.65 3.92 0.00 1.92 2.01 0.00 3.24 0.00 0.00 3.22 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.62 0.00 75 K 7.25 4.55 0.00 1.60 1.75 0.00 1.68 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.28 1.48 7.81 76 M 7.52 4.56 0.00 2.05 2.23 0.00 0.00 0.00 0.00 0.00 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.45 0.00 *82 E 8.89 4.32 0.00 1.92 1.99 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 2.21 1.88 0.00 83 E 8.28 4.06 0.00 1.97 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 2.31 1.94 0.00 84 E 8.38 4.10 0.00 2.06 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 2.24 1.96 0.00 85 I 7.49 4.15 1.87 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 1.38 0.54 0.91 0.00 0.00 86 R 7.62 4.07 0.00 1.84 1.99 0.00 3.26 0.00 0.00 3.17 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.56 0.00 87 E 8.25 4.05 0.00 2.16 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 0.00 2.32 1.97 0.00 88 A 8.22 4.15 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 *89 F 7.79 3.52 0.00 2.39 2.23 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 0.00 90 R 7.42 4.45 0.00 1.89 1.88 0.00 3.23 0.00 0.00 3.15 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.51 0.00 91 V 7.15 3.82 2.14 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 0.87 0.00 0.00 1.00 0.00 0.00 *101 S 8.13 4.29 0.00 3.80 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 0.00 102 A 8.50 4.17 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 0.00 103 A 8.01 3.98 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 0.00 104 E 8.38 4.10 0.00 2.08 1.91 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 2.24 1.97 0.00 105 L 8.85 4.63 0.00 1.57 1.68 0.92 0.87 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 0.00 106 R 7.83 4.35 0.00 1.75 1.99 0.00 3.24 0.00 0.00 3.20 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.53 0.00 *107 H 7.95 4.25 0.00 2.96 2.99 0.00 7.19 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 V 8.06 3.78 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 0.86 0.00 0.00 0.93 0.00 0.00 109 M 7.17 4.50 0.00 2.02 1.87 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.33 0.00 *115 K 8.58 4.37 0.00 1.79 1.79 0.00 1.76 0.00 0.00 1.74 0.00 0.00 2.99 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.26 1.01 7.81 116 L 7.73 4.45 0.00 1.66 1.50 0.92 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 117 T 8.51 4.58 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 1.21 0.00 0.00 118 D 8.55 4.54 0.00 2.68 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 E 8.21 4.18 0.00 1.96 2.01 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 2.32 1.99 0.00 120 E 7.85 4.48 0.00 2.00 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 0.00 2.33 2.32 0.00 121 V 7.68 3.68 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 0.82 0.00 0.00 0.93 0.00 0.00 122 D 8.10 4.71 0.00 2.87 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 0.00 123 E 8.02 3.98 0.00 2.11 1.99 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 2.29 2.34 0.00 124 M 7.70 4.01 0.00 2.01 2.27 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.81 2.56 0.00 125 I 8.35 3.77 1.87 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 1.42 0.52 0.95 0.00 0.00 126 R 8.78 3.83 0.00 2.03 2.09 0.00 3.09 0.00 0.00 3.09 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.67 0.00 127 E 8.34 3.99 0.00 2.08 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 2.29 2.34 0.00 128 A 7.94 4.26 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 0.00 129 D 7.48 4.52 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 0.00 130 I 8.16 3.95 1.87 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 1.47 0.80 0.91 0.00 0.00 131 D 9.65 4.45 0.00 2.79 2.89 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 0.00 132 G 8.18 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 0.00 133 D 8.84 4.67 0.00 2.77 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 0.00 134 G 11.30 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 0.00 0.00 0.00 135 Q 8.03 4.58 0.00 2.04 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.99 6.56 0.00 0.00 0.00 0.00 0.00 2.20 2.16 0.00 136 V 8.38 4.41 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 0.89 0.00 0.00 0.93 0.00 0.00 137 N 8.75 5.13 0.00 2.67 2.70 0.00 0.00 6.75 8.89 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 *138 Y 8.52 4.36 0.00 2.31 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 0.00 0.00 0.00 0.00 139 E 8.37 4.15 0.00 1.96 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 2.01 0.00 140 E 8.04 4.42 0.00 2.05 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 2.38 2.38 0.00 141 F 8.92 4.03 0.00 3.11 3.10 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 0.00 142 V 8.90 3.83 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 0.72 0.00 0.00 0.93 0.00 0.00 143 Q 7.54 4.26 0.00 2.17 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.99 0.00 0.00 0.00 0.00 0.00 2.31 2.24 0.00 144 M 8.14 4.33 0.00 1.73 2.04 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.36 0.00 145 M 7.92 4.39 0.00 2.14 2.32 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.90 3.19 0.00 146 T 8.15 4.24 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 1.21 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.