NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 P 4.2527 0.0000 0.0000 61.6840 33.5339 175.6665 3 V 3.8439 7.7599 117.8210 60.5303 31.6480 172.9234 4 A 4.5837 9.1231 132.3738 50.4869 21.0030 175.4006 5 H 4.3763 8.9837 121.1975 55.7063 28.1468 174.9576 6 V 4.1377 8.1526 124.2035 61.0301 32.8084 174.8336 7 A 4.6246 8.4567 129.4040 50.5655 20.1990 176.2605 8 L 4.7843 8.2663 122.5824 52.7347 44.4893 175.5442 9 P 4.6267 0.0000 0.0000 61.1736 29.8552 176.2732 10 V 3.9011 7.4598 120.3498 60.2010 32.8845 177.1351 11 P 4.5931 0.0000 0.0000 62.1591 32.7294 175.4410 12 L 3.6915 9.0612 117.0390 58.7809 40.5636 177.0977 13 P 4.6563 0.0000 0.0000 62.8032 33.1146 176.4455 14 R 4.6181 8.1464 119.8284 55.9031 30.7795 176.6903 15 T 4.2272 7.9486 111.2119 62.3488 68.1414 172.5386 16 F 4.7792 8.8457 123.7889 55.7379 40.5347 175.5045 17 D 4.8156 8.7258 126.1232 54.2799 41.5106 175.2713 18 Y 4.7447 8.4672 120.2333 56.0611 42.2368 174.3068 19 L 4.5927 8.9732 124.4597 53.9298 43.9956 175.3521 20 L 4.6164 8.4837 126.3260 53.4775 42.5803 175.8102 21 P 4.4519 0.0000 0.0000 62.6125 31.5660 174.4344 22 E 4.3360 8.6156 119.1486 56.5815 30.8287 176.3535 23 G 3.6673 9.3713 112.7966 45.9713 0.0000 175.0781 24 M 4.3000 7.6594 117.6012 55.1544 33.2839 173.0563 25 T 4.5535 8.1668 120.5238 60.4843 69.2784 174.2431 26 V 4.4560 7.8601 118.2366 59.4156 35.4770 175.5029 27 K 4.1273 8.2798 122.6831 54.8449 33.1202 175.9786 28 A 3.8360 8.2700 125.5916 56.1545 18.0936 175.9374 29 G 2.5723 7.3720 111.6666 45.6659 0.0000 171.9253 30 C 4.6406 7.5384 118.7228 58.0736 30.6217 173.3186 31 R 4.6634 8.1042 120.0585 56.0914 31.4540 175.9288 32 V 4.5928 8.8670 114.6425 59.9819 36.9886 173.6922 33 R 4.8540 8.8890 123.5410 55.0579 31.9658 175.5714 34 V 4.7948 8.2904 118.0545 59.1515 36.5383 172.6409 35 P 5.1554 0.0000 0.0000 62.3717 32.3803 175.3588 36 F 4.5833 9.1829 125.1254 58.7298 43.2131 174.6026 37 G 3.5808 8.0227 112.0204 45.3996 0.0000 173.6814 38 K 4.6550 8.2334 117.9565 56.8836 40.3500 177.3897 39 Q 4.7651 7.8237 114.7469 54.9926 29.6813 174.9636 40 Q 4.7417 7.9121 114.9393 54.5113 33.9808 175.2995 41 E 5.2794 8.5163 119.8931 55.1030 33.4748 175.1951 42 R 4.5659 8.2846 118.7670 55.4899 34.1617 173.7920 43 I 4.4782 8.5419 126.6471 61.2167 38.2869 175.2454 44 G 4.4870 9.6280 114.4523 44.4066 0.0000 171.1340 45 I 5.1421 8.2256 119.0919 59.1481 40.8202 175.9822 46 V 3.7001 8.9984 128.2406 63.2503 31.7572 176.8186 47 V 4.3626 8.8005 128.1715 65.2336 32.0474 175.1567 48 S 4.5923 7.6357 110.7101 57.8287 65.3414 173.7528 49 V 4.2770 8.1116 120.0851 61.7885 33.2214 173.2037 50 S 4.8245 8.4866 121.0354 56.6639 65.9076 172.8694 51 D 4.5169 8.6209 117.3565 54.3414 41.3918 175.1908 52 A 4.7294 7.2376 120.2117 51.1604 21.7273 175.3270 53 S 4.5160 7.9797 109.1075 57.4377 64.9822 175.9962 54 E 3.8068 8.2462 126.1226 58.5481 29.5262 176.9696 55 L 4.6967 6.9507 116.5829 51.7487 43.9931 174.4345 56 P 4.2923 0.0000 0.0000 62.7445 31.5165 177.7448 57 L 4.0088 8.6776 123.5746 56.8980 41.6826 177.3692 58 N 4.7885 8.0026 114.6702 52.6716 37.5584 174.9862 59 E 4.5456 8.4649 116.7160 56.1354 30.4585 175.2929 60 L 4.4541 7.6453 119.6456 52.5928 42.9710 176.5765 61 K 4.2346 8.2887 122.9828 56.6462 33.4603 175.6198 62 A 5.8009 8.3212 123.5551 49.8539 20.4340 177.4100 63 V 3.6078 8.6265 121.4751 64.0193 31.6908 176.2254 64 V 3.8881 8.8988 128.2204 65.5995 31.9433 175.6249 65 E 4.7736 7.8654 118.4229 55.2152 33.3928 174.4625 66 V 4.3409 8.1477 124.8736 59.8251 32.6471 175.5146 67 L 4.2620 8.0651 125.7603 54.1521 41.3122 177.1687 68 D 4.0431 7.7279 120.8790 54.0008 46.1460 175.4132 *71 P 4.0779 0.0000 0.0000 61.7229 31.8055 177.4075 72 V 3.7394 7.5680 122.7035 63.0065 31.4170 176.0951 73 F 5.3602 7.2364 119.8880 55.7255 41.3734 175.6284 74 T 4.1503 8.5189 121.0897 63.7527 68.9711 174.8758 75 H 4.3716 8.9379 123.1930 59.1795 29.7137 177.7823 76 S 4.2456 8.0679 115.9145 61.1712 63.3619 176.0238 77 V 3.5573 7.9076 122.4697 65.3965 31.1232 177.2772 78 W 4.1748 8.7787 128.0587 60.6023 30.4582 177.5316 79 R 3.8997 8.2137 118.4151 59.7699 29.3888 178.1259 80 L 4.0190 8.3436 120.4930 57.7319 42.1900 178.4522 81 L 3.8885 8.5909 119.1553 58.0425 41.6272 179.6883 82 L 3.6929 7.4900 118.3188 57.5044 41.4378 179.1950 83 W 4.0551 7.8882 127.9020 60.5782 30.5324 177.2504 84 A 2.8807 8.6518 120.4728 55.1480 17.7310 179.1450 85 A 3.8783 8.3012 118.6121 55.4120 18.4759 179.4726 86 D 4.0444 7.9687 116.2467 57.6791 41.1833 177.7603 87 Y 4.1141 7.9439 119.6917 60.2131 38.6039 176.7212 88 Y 4.6426 7.4591 115.0547 56.4629 39.7589 175.8820 89 H 3.9378 7.3490 114.5337 57.1568 26.4279 173.6434 90 H 4.9335 8.8054 115.6368 52.2808 32.7377 172.9514 91 P 4.2667 0.0000 0.0000 62.7520 32.0638 177.0676 92 I 3.7085 8.7307 123.4283 64.4702 37.7858 177.8696 93 G 3.6338 8.0630 105.7330 47.6496 0.0000 174.7782 94 D 4.3158 8.0412 120.1592 57.2793 41.1529 178.2564 95 V 3.5581 7.9371 118.4173 66.0576 31.6285 177.6450 96 L 3.8970 7.9388 118.3903 58.2137 41.4163 179.8829 97 F 3.9870 8.3920 115.9595 60.6925 38.8894 177.1378 98 H 4.6014 8.1164 114.4810 58.2898 28.9683 177.3040 99 A 4.1217 8.4940 123.0185 54.3219 17.8953 179.4539 100 L 3.8819 7.5163 118.1727 58.1072 42.3526 176.2417 101 P 4.3841 0.0000 0.0000 65.8614 31.6295 177.8825 102 I 3.9076 7.8219 117.4095 64.0882 37.4538 175.8002 103 L 4.1332 7.6973 123.3641 55.3736 41.5144 177.0550 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 P 0.00 4.25 0.00 2.06 2.18 0.00 3.62 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 2.08 0.00 3 V 7.76 3.84 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 0.71 0.00 0.00 0.93 0.00 0.00 4 A 9.12 4.58 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 5 H 8.98 4.38 0.00 3.12 3.34 0.00 5.89 0.00 0.00 0.00 0.00 6.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 V 8.15 4.14 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 0.80 0.00 0.00 0.94 0.00 0.00 7 A 8.46 4.62 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 8 L 8.27 4.78 0.00 1.62 1.57 0.91 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 9 P 0.00 4.63 0.00 2.03 2.00 0.00 3.67 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.05 0.00 10 V 7.46 3.90 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 0.72 0.00 0.00 0.91 0.00 0.00 11 P 0.00 4.59 0.00 2.06 2.09 0.00 3.70 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 2.02 2.11 0.00 12 L 9.06 3.69 0.00 1.63 1.49 0.94 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 13 P 0.00 4.66 0.00 2.09 2.01 0.00 3.67 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.11 0.00 14 R 8.15 4.62 0.00 1.82 1.92 0.00 3.23 0.00 0.00 3.16 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.60 0.00 15 T 7.95 4.23 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 1.30 0.00 0.00 16 F 8.85 4.78 0.00 3.17 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 0.00 17 D 8.73 4.82 0.00 2.68 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 18 Y 8.47 4.74 0.00 2.82 2.91 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 19 L 8.97 4.59 0.00 1.78 1.66 1.03 0.66 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 20 L 8.48 4.62 0.00 1.60 1.61 0.94 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 21 P 0.00 4.45 0.00 2.05 2.07 0.00 3.69 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.12 0.00 22 E 8.62 4.34 0.00 1.91 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 2.24 2.36 0.00 23 G 9.37 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 0.00 0.00 0.00 24 M 7.66 4.30 0.00 1.95 1.96 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.50 0.00 25 T 8.17 4.55 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 1.19 0.00 0.00 26 V 7.86 4.46 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 0.78 0.00 0.00 0.92 0.00 0.00 27 K 8.28 4.13 0.00 1.66 1.58 0.00 1.58 0.00 0.00 1.74 0.00 0.00 2.88 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.42 1.35 7.81 28 A 8.27 3.84 1.11 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 0.00 0.00 29 G 7.37 2.57 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 30 C 7.54 4.64 0.00 2.76 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 31 R 8.10 4.66 0.00 1.65 1.72 0.00 2.92 0.00 0.00 3.21 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.40 0.00 32 V 8.87 4.59 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 0.71 0.00 0.00 0.82 0.00 0.00 33 R 8.89 4.85 0.00 1.88 1.84 0.00 3.23 0.00 0.00 3.16 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.63 0.00 34 V 8.29 4.79 1.08 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 0.30 0.00 0.00 0.57 0.00 0.00 35 P 0.00 5.16 0.00 2.10 2.06 0.00 4.08 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 2.14 2.17 0.00 36 F 9.18 4.58 0.00 3.00 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 37 G 8.02 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.23 4.65 0.00 1.65 1.76 0.00 1.65 0.00 0.00 1.68 0.00 0.00 2.88 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.29 1.36 7.81 39 Q 7.82 4.77 0.00 1.98 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.60 6.77 0.00 0.00 0.00 0.00 0.00 2.24 2.33 0.00 40 Q 7.91 4.74 0.00 2.31 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.33 6.65 0.00 0.00 0.00 0.00 0.00 2.29 2.34 0.00 41 E 8.52 5.28 0.00 1.83 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 2.22 2.29 0.00 42 R 8.28 4.57 0.00 1.85 1.59 0.00 2.96 0.00 0.00 2.86 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.53 0.00 43 I 8.54 4.48 2.00 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 1.31 0.94 0.94 0.00 0.00 44 G 9.63 4.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.23 5.14 2.11 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.74 1.09 0.00 0.00 46 V 9.00 3.70 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 0.93 0.00 0.00 0.95 0.00 0.00 47 V 8.80 4.36 2.26 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 1.09 0.00 0.00 1.17 0.00 0.00 48 S 7.64 4.59 0.00 4.05 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 49 V 8.11 4.28 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 0.84 0.00 0.00 0.94 0.00 0.00 50 S 8.49 4.82 0.00 3.99 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 51 D 8.62 4.52 0.00 2.66 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 52 A 7.24 4.73 1.24 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 53 S 7.98 4.52 0.00 3.82 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 54 E 8.25 3.81 0.00 1.92 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 2.31 2.29 0.00 55 L 6.95 4.70 0.00 1.74 1.53 0.87 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 56 P 0.00 4.29 0.00 2.30 1.98 0.00 3.65 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.10 0.00 57 L 8.68 4.01 0.00 1.63 1.75 0.93 1.06 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 58 N 8.00 4.79 0.00 2.82 2.90 0.00 0.00 5.87 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 59 E 8.46 4.55 0.00 1.99 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 2.20 2.21 0.00 60 L 7.65 4.45 0.00 1.59 1.51 0.92 0.88 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 61 K 8.29 4.23 0.00 1.62 1.80 0.00 1.66 0.00 0.00 1.86 0.00 0.00 2.83 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.53 1.40 7.81 62 A 8.32 5.80 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 63 V 8.63 3.61 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 0.84 0.00 0.00 1.00 0.00 0.00 64 V 8.90 3.89 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 0.77 0.00 0.00 0.97 0.00 0.00 65 E 7.87 4.77 0.00 2.08 1.69 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 2.24 2.31 0.00 66 V 8.15 4.34 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 0.67 0.00 0.00 0.93 0.00 0.00 67 L 8.07 4.26 0.00 1.47 1.68 0.90 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 68 D 7.73 4.04 0.00 2.51 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 0.00 0.00 0.00 0.00 *71 P 0.00 4.08 0.00 2.24 1.81 0.00 3.58 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 1.89 1.90 0.00 72 V 7.57 3.74 1.88 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 -0.13 0.00 0.00 0.93 0.00 0.00 73 F 7.24 5.36 0.00 3.17 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 74 T 8.52 4.15 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 1.31 0.00 0.00 75 H 8.94 4.37 0.00 3.26 3.37 0.00 5.86 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 S 8.07 4.25 0.00 4.10 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 77 V 7.91 3.56 2.26 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 0.90 0.00 0.00 0.95 0.00 0.00 78 W 8.78 4.17 0.00 3.69 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 79 R 8.21 3.90 0.00 2.06 2.11 0.00 3.11 0.00 0.00 3.07 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.69 0.00 80 L 8.34 4.02 0.00 1.86 1.83 1.10 0.29 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 81 L 8.59 3.89 0.00 1.36 1.51 0.52 0.79 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 82 L 7.49 3.69 0.00 1.47 1.55 0.78 0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 0.00 0.00 0.00 0.00 0.00 0.00 83 W 7.89 4.06 0.00 3.24 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 84 A 8.65 2.88 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 85 A 8.30 3.88 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 86 D 7.97 4.04 0.00 2.71 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 87 Y 7.94 4.11 0.00 1.75 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 88 Y 7.46 4.64 0.00 2.99 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 89 H 7.35 3.94 0.00 3.08 3.23 0.00 5.79 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 H 8.81 4.93 0.00 3.03 3.13 0.00 5.67 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 91 P 0.00 4.27 0.00 2.17 2.02 0.00 3.68 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 2.13 2.16 0.00 92 I 8.73 3.71 1.88 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.59 0.98 0.00 0.00 93 G 8.06 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 0.00 0.00 0.00 94 D 8.04 4.32 0.00 2.77 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 95 V 7.94 3.56 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 0.97 0.00 0.00 0.97 0.00 0.00 96 L 7.94 3.90 0.00 2.00 2.01 1.12 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 97 F 8.39 3.99 0.00 3.06 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 98 H 8.12 4.60 0.00 3.29 3.34 0.00 5.65 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 A 8.49 4.12 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 0.00 100 L 7.52 3.88 0.00 1.89 1.71 1.19 0.88 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 0.00 101 P 0.00 4.38 0.00 2.11 2.16 0.00 3.89 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 2.10 2.18 0.00 102 I 7.82 3.91 2.00 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 0.35 0.91 0.00 0.00 103 L 7.70 4.13 0.00 1.85 1.66 0.63 0.66 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 * Residues marked with a * may have inaccurate shift predictions.