NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 8 A 4.3013 8.2649 123.5827 51.0240 18.7054 176.4657 9 P 4.2802 0.0000 0.0000 60.7472 32.1185 175.1094 10 I 3.8886 8.3727 115.2808 60.3466 39.0796 175.5060 11 A 4.0355 8.3618 124.3740 52.2105 18.7668 177.6647 12 A 4.2958 8.3317 125.0762 51.8871 19.3701 176.5836 13 Y 4.3552 8.4439 121.6731 56.9489 39.6480 175.6617 14 K 4.2649 7.2434 125.9329 53.4244 32.6593 173.8930 15 P 4.2861 0.0000 0.0000 62.8140 31.7878 177.0184 16 R 4.5480 8.4172 119.4029 56.0585 31.4987 175.6996 17 S 4.7271 7.5576 110.9983 57.0294 66.0970 173.2439 18 N 5.2056 8.6602 119.2571 52.6619 39.2912 174.3630 19 E 4.7929 9.1070 120.1342 55.4505 33.5397 174.0580 20 I 4.8147 8.3811 121.9581 59.6482 39.7697 174.8710 21 L 4.6985 9.0250 128.1391 53.0044 43.2943 175.5721 22 W 5.3457 9.0221 124.7290 55.7857 30.7281 176.4954 23 D 4.8764 8.9544 124.6220 51.9702 41.3593 177.3299 24 G 3.6181 8.9055 106.5285 47.9132 0.0000 173.7449 25 Y 4.5089 8.3262 116.0037 57.5117 38.2795 175.8339 26 G 4.0377 8.3359 107.5057 46.3645 0.0000 173.6098 27 V 4.3470 8.7179 121.1116 60.7794 32.8795 172.9677 28 P 4.0844 0.0000 0.0000 62.0644 32.6435 175.2637 29 H 4.4306 8.5834 121.5415 54.0968 30.2497 173.1437 30 I 4.4941 7.7514 124.6257 60.3167 38.2351 174.9651 31 Y 4.6428 9.1967 126.0106 56.0946 40.1512 175.2925 32 G 4.6388 8.6696 110.5534 44.4429 0.0000 173.3391 33 V 3.9561 9.2808 116.0372 63.1889 32.0040 176.1045 34 D 4.7039 7.6620 118.3242 50.8476 43.3865 175.6700 35 A 4.1314 8.5991 120.4506 55.2348 18.3666 177.7809 36 P 4.4000 0.0000 0.0000 66.1014 31.3799 179.0432 37 S 4.2450 8.7997 113.8118 61.4741 62.7355 176.5943 38 A 4.1011 8.0239 123.3753 55.2538 18.0728 179.7581 39 F 4.2478 8.8118 116.4446 60.7012 38.8899 177.3422 40 Y 4.4859 8.7088 119.5390 60.8826 38.6115 178.3869 41 G 3.7138 8.5668 106.7102 47.9334 0.0000 175.0784 42 Y 4.4952 8.3806 122.0275 60.5659 38.8463 178.2018 43 G 2.6148 8.4350 106.9932 46.9381 0.0000 175.3925 44 W 3.9948 8.2223 130.7846 60.1747 30.7503 177.8465 45 A 4.5156 8.5847 120.9150 55.6215 17.8274 179.6205 46 Q 3.9073 8.2579 116.4483 58.9472 28.6897 179.0132 47 A 3.6368 7.7034 121.8279 54.9361 18.1275 179.6805 48 R 2.5100 6.6756 116.0583 59.0104 30.0792 178.4509 49 S 4.3308 7.7796 113.7358 60.5054 63.3662 174.7671 50 H 4.9033 8.6737 118.3145 54.3497 30.5833 175.7079 51 G 3.6297 8.2922 108.6121 48.1465 0.0000 175.3819 52 D 4.3262 8.0307 121.0887 57.3894 40.8186 178.9004 53 N 4.2940 7.9755 116.0222 56.1261 38.4890 177.5511 54 I 3.4668 7.6634 121.3478 64.2617 37.1569 178.4593 55 L 3.8622 7.9084 120.0001 57.5904 41.4019 179.5403 56 R 3.7040 7.8907 118.6429 59.3698 29.9163 178.5723 57 L 4.1376 8.1135 118.9467 58.2202 41.2222 179.1889 58 Y 4.4999 8.5935 117.0734 61.0176 37.6083 178.8930 59 G 4.1120 8.6851 106.9334 48.0609 0.0000 175.6739 60 E 4.2290 8.7217 120.9871 59.1943 29.3496 179.2739 61 A 4.1085 8.3327 119.5769 54.6273 18.5024 179.1038 62 R 4.1841 7.5889 114.6800 56.6745 30.3363 177.4086 63 G 3.8662 8.2344 107.1208 45.9528 0.0000 173.9590 64 K 4.2198 7.6602 116.9280 55.5180 32.9339 178.7368 65 G 3.8040 8.3677 108.0335 48.0452 0.0000 175.9372 66 A 4.3104 8.1754 123.8764 54.7749 18.1716 179.2804 67 E 3.6964 7.7375 116.0627 59.5923 29.7791 178.1586 68 Y 4.0621 7.1142 115.5681 59.4761 37.9622 176.4297 69 W 4.6842 8.0794 115.8264 55.8195 30.7723 176.3919 70 G 3.9307 8.3030 107.2827 44.0446 0.0000 171.8157 71 P 4.2575 0.0000 0.0000 66.2434 30.9755 178.0244 72 D 4.5207 8.3278 115.2174 56.2242 41.1636 176.9143 73 Y 4.5977 8.2805 115.9587 57.3981 38.9186 177.0019 74 E 4.0211 8.2048 122.1980 59.4126 29.7654 178.5797 75 Q 4.0329 8.0933 117.6241 59.4542 28.7406 178.9189 76 T 4.0686 7.9368 116.2045 66.7663 68.5213 176.8274 77 T 3.9030 7.9057 117.6636 66.6999 68.5205 176.8578 78 V 3.6025 8.1461 120.3584 65.5202 31.5069 177.8344 79 W 4.3200 8.4569 128.2211 60.6682 30.5322 178.0546 80 L 3.5531 8.2864 119.1712 57.5580 41.0586 179.5330 81 L 3.8538 7.9938 119.0525 58.0456 41.3300 179.6948 82 T 3.8547 7.6786 114.7307 66.0943 68.3831 175.4937 83 N 4.4521 7.2435 115.5066 51.7598 38.8130 175.0842 84 G 3.8475 7.7650 108.8203 46.3466 0.0000 176.8324 85 V 3.3019 7.5962 120.0851 65.1236 31.5038 175.2873 86 P 4.1540 0.0000 0.0000 65.6281 31.2072 178.2457 87 E 3.8771 7.9378 117.5083 59.2357 29.6677 178.5701 88 R 3.8895 8.0214 118.6111 59.1699 29.9977 178.3452 89 A 3.8710 7.8857 120.6950 55.1981 18.3838 179.5933 90 Q 4.0956 7.9018 116.1155 59.1494 28.7709 179.2029 91 Q 4.0835 8.0681 119.0375 58.9060 28.6241 178.6621 92 W 4.4248 8.6521 118.9389 59.9895 29.4719 177.6099 93 Y 4.2966 8.8572 119.6027 60.8471 38.1012 178.1647 94 A 4.0041 8.1992 120.0672 54.6346 18.5372 178.5997 95 Q 4.2754 7.7804 114.2512 55.5358 29.3348 176.3318 96 Q 4.2164 6.9627 119.6725 55.2269 29.6068 176.8246 97 S 4.3196 8.3268 115.2607 57.5404 65.3514 173.2837 98 P 4.1815 0.0000 0.0000 66.1333 30.9855 178.6176 99 D 4.3261 8.0294 116.7100 57.5376 40.8821 178.6314 100 F 3.9335 7.9869 121.2005 61.0790 39.2616 177.1135 101 R 3.7836 8.3885 118.6139 59.2223 29.7776 178.3706 102 A 3.9640 7.8424 120.3549 55.0752 18.2341 179.4280 103 N 3.9578 7.3847 115.1418 56.1113 38.3838 177.6597 104 L 3.9539 7.4722 120.3689 57.8824 41.6332 179.3007 105 D 4.4922 8.4907 118.8368 57.3523 40.6865 178.7043 106 A 4.2073 8.1651 121.3316 55.0740 18.5432 179.3118 107 F 4.4442 8.7695 119.1365 61.6953 39.4747 177.1901 108 A 4.0898 8.4388 120.0681 55.1997 18.1139 179.3455 109 A 4.1618 8.6059 119.8113 55.3681 18.4830 180.1167 110 G 2.8152 8.4132 104.4548 47.6542 0.0000 176.0555 111 I 3.5279 7.3678 121.7838 64.1586 37.0403 178.3120 112 N 4.3419 8.4102 117.2576 56.1404 38.2847 177.3651 113 A 4.0792 8.4356 122.5703 55.3125 18.5453 178.9375 114 Y 3.5200 7.9161 117.7719 60.6638 38.4978 178.2164 115 A 3.7267 7.5299 119.9163 55.2277 18.5415 179.1159 116 Q 3.9853 8.0292 117.1257 59.2929 29.1969 178.0182 117 Q 4.2068 8.0526 118.2449 57.2903 30.3426 175.9740 118 N 4.9062 7.7477 116.6090 50.6934 38.7814 173.4279 119 P 4.1707 0.0000 0.0000 65.8609 31.8293 178.3416 120 D 4.4189 7.8996 115.8758 55.6321 41.3285 175.8371 121 D 4.6503 7.8202 117.0071 54.7677 41.4417 176.0363 122 I 4.3720 7.0222 120.7633 59.1746 38.4895 175.6334 123 S 4.0846 9.1544 120.6123 58.2742 62.8565 172.9877 124 P 4.2622 0.0000 0.0000 66.0637 30.8660 178.4275 125 D 4.5276 8.1800 115.7804 55.6313 39.6026 177.7448 126 V 4.4931 7.6841 111.9854 61.2981 32.1346 177.7014 127 R 3.9585 7.8108 120.1119 59.0471 29.6601 178.5827 128 Q 3.9607 7.8486 115.3167 58.2960 28.8236 177.6902 129 V 3.4396 7.2540 118.6166 65.3333 31.7761 176.6628 130 L 4.1672 7.3593 118.9683 53.9539 41.9720 175.0500 131 P 4.7186 0.0000 0.0000 62.3143 32.5940 175.8589 132 V 4.5054 8.9216 113.5030 60.2674 33.4165 175.6656 133 S 4.9521 9.2342 116.5804 55.9909 67.1991 175.2997 134 G 3.7017 8.4041 106.9546 47.7607 0.0000 175.6647 135 A 3.8785 7.2235 122.5554 54.9381 18.3131 179.2529 136 D 4.1265 7.6431 117.5377 57.3504 40.9713 179.0928 137 V 3.1774 7.3526 118.6623 65.9635 31.5342 178.2866 138 V 3.7632 7.8900 117.7426 65.8786 31.2983 177.8314 139 A 3.9859 8.1886 120.8620 55.3974 18.1609 179.1080 140 H 4.1561 8.3496 116.6244 59.4591 29.7727 177.3652 141 A 4.0661 7.7875 120.9665 55.3611 18.2478 178.8350 142 H 4.5853 8.3831 116.1798 59.3631 30.2238 177.2305 143 R 4.1887 8.2904 120.7127 59.3914 30.0450 178.0293 144 L 4.1282 8.0829 117.5484 57.2173 41.9675 177.7850 *146 N 4.5377 8.0223 115.5276 53.1606 40.3928 175.5896 147 F 5.9387 8.2738 114.1782 56.4396 39.6056 175.6050 148 L 4.6842 8.0387 119.0784 56.8777 44.3965 177.6036 149 Y 4.1074 8.0374 115.2279 61.0908 38.2484 177.8857 150 V 3.5654 7.9503 118.8178 65.2828 32.2203 176.4744 151 A 4.6532 8.1924 129.7939 50.0651 19.2729 175.3476 152 S 4.7721 8.2933 117.2795 57.7450 65.8896 173.3943 153 P 2.9700 0.0000 0.0000 65.0973 30.8200 178.9446 154 G 4.0445 7.5137 106.3689 47.4352 0.0000 175.7337 155 R 3.9526 7.6001 120.7923 59.0167 29.7943 179.4503 156 T 4.0405 7.2728 113.5562 66.5895 68.7671 176.4813 157 L 4.3112 8.0623 117.9303 54.5509 41.7117 177.5044 158 G 3.9846 7.1711 105.9497 46.6277 0.0000 173.7831 159 E 4.4359 7.9949 117.0758 55.7038 30.2360 176.6701 160 G 4.2107 8.0817 113.5857 46.1740 0.0000 174.3704 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 8 A 8.26 4.30 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 9 P 0.00 4.28 0.00 2.14 2.01 0.00 3.69 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.13 0.00 10 I 8.37 3.89 1.89 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 1.36 0.55 0.92 0.00 0.00 11 A 8.36 4.04 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 12 A 8.33 4.30 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 13 Y 8.44 4.36 0.00 2.97 3.01 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 0.00 0.00 0.00 14 K 7.24 4.26 0.00 1.48 1.55 0.00 1.65 0.00 0.00 1.69 0.00 0.00 3.07 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.25 1.40 7.81 15 P 0.00 4.29 0.00 2.29 2.22 0.00 3.64 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 2.33 2.62 0.00 16 R 8.42 4.55 0.00 1.73 1.91 0.00 3.16 0.00 0.00 3.24 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.47 0.00 17 S 7.56 4.73 0.00 3.83 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 N 8.66 5.21 0.00 2.64 2.84 0.00 0.00 6.77 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 19 E 9.11 4.79 0.00 2.04 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 2.26 2.36 0.00 20 I 8.38 4.81 1.89 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.60 0.07 0.00 0.00 21 L 9.02 4.70 0.00 1.68 1.66 0.80 0.69 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 22 W 9.02 5.35 0.00 3.18 3.23 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 23 D 8.95 4.88 0.00 2.90 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 24 G 8.91 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 25 Y 8.33 4.51 0.00 3.14 3.01 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 0.00 0.00 0.00 26 G 8.34 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 27 V 8.72 4.35 2.50 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 0.86 0.00 0.00 1.07 0.00 0.00 28 P 0.00 4.08 0.00 1.40 0.49 0.00 3.72 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 1.74 1.81 0.00 29 H 8.58 4.43 0.00 3.27 3.21 0.00 5.60 0.00 0.00 0.00 0.00 6.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 I 7.75 4.49 1.65 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 1.24 0.25 0.95 0.00 0.00 31 Y 9.20 4.64 0.00 3.08 2.98 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 32 G 8.67 4.64 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 0.00 0.00 0.00 33 V 9.28 3.96 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 0.78 0.00 0.00 1.01 0.00 0.00 34 D 7.66 4.70 0.00 2.93 2.77 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 35 A 8.60 4.13 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 36 P 0.00 4.40 0.00 2.21 2.17 0.00 3.84 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.31 0.00 37 S 8.80 4.25 0.00 4.14 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 38 A 8.02 4.10 1.38 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 0.00 0.00 39 F 8.81 4.25 0.00 3.43 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 40 Y 8.71 4.49 0.00 3.30 3.26 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 41 G 8.57 3.71 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 0.00 0.00 0.00 42 Y 8.38 4.50 0.00 3.10 3.33 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 43 G 8.44 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 0.00 0.00 0.00 44 W 8.22 3.99 0.00 3.31 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 45 A 8.58 4.52 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 46 Q 8.26 3.91 0.00 2.04 2.02 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 2.30 2.16 0.00 47 A 7.70 3.64 0.97 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 0.00 0.00 48 R 6.68 2.51 0.00 0.67 1.79 0.00 3.17 0.00 0.00 2.55 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 1.33 0.00 49 S 7.78 4.33 0.00 3.85 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 50 H 8.67 4.90 0.00 3.01 3.12 0.00 5.64 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 G 8.29 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 52 D 8.03 4.33 0.00 2.66 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 53 N 7.98 4.29 0.00 2.71 2.80 0.00 0.00 7.02 7.24 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 54 I 7.66 3.47 1.72 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 1.37 0.70 0.20 0.00 0.00 55 L 7.91 3.86 0.00 1.76 1.73 0.88 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 56 R 7.89 3.70 0.00 1.59 1.82 0.00 2.51 0.00 0.00 2.52 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 57 L 8.11 4.14 0.00 1.86 1.78 0.93 1.27 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 58 Y 8.59 4.50 0.00 3.12 3.07 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 59 G 8.69 4.11 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 0.00 60 E 8.72 4.23 0.00 2.46 2.24 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 2.80 2.85 0.00 61 A 8.33 4.11 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.59 4.18 0.00 2.05 1.98 0.00 3.39 0.00 0.00 3.31 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.95 0.00 63 G 8.23 3.87 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 0.00 0.00 0.00 0.00 0.00 0.00 64 K 7.66 4.22 0.00 1.14 0.74 0.00 1.53 0.00 0.00 1.28 0.00 0.00 2.81 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.04 1.13 7.81 65 G 8.37 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 0.00 0.00 0.00 66 A 8.18 4.31 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 67 E 7.74 3.70 0.00 1.68 1.50 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 2.07 2.24 0.00 68 Y 7.11 4.06 0.00 1.43 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 69 W 8.08 4.68 0.00 2.58 2.83 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 70 G 8.30 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 0.00 0.00 0.00 71 P 0.00 4.26 0.00 2.22 2.19 0.00 3.70 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.25 0.00 72 D 8.33 4.52 0.00 2.74 2.50 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 73 Y 8.28 4.60 0.00 3.38 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 74 E 8.20 4.02 0.00 2.13 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.38 0.00 75 Q 8.09 4.03 0.00 2.09 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.68 0.00 0.00 0.00 0.00 0.00 2.45 2.38 0.00 76 T 7.94 4.07 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 1.38 0.00 0.00 77 T 7.91 3.90 4.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 78 V 8.15 3.60 2.29 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 1.05 0.00 0.00 1.00 0.00 0.00 79 W 8.46 4.32 0.00 3.45 3.25 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 80 L 8.29 3.55 0.00 1.66 1.55 1.03 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 81 L 7.99 3.85 0.00 1.62 1.63 0.87 0.49 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 82 T 7.68 3.85 4.14 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 0.00 0.00 0.00 1.14 0.00 0.00 83 N 7.24 4.45 0.00 1.57 1.63 0.00 0.00 7.03 8.66 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 84 G 7.77 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 85 V 7.60 3.30 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 0.90 0.00 0.00 0.16 0.00 0.00 86 P 0.00 4.15 0.00 2.11 2.12 0.00 3.50 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.26 0.00 87 E 7.94 3.88 0.00 2.01 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 2.33 2.38 0.00 88 R 8.02 3.89 0.00 1.76 1.48 0.00 2.57 0.00 0.00 2.95 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.27 0.00 89 A 7.89 3.87 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 90 Q 7.90 4.10 0.00 2.27 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.76 0.00 0.00 0.00 0.00 0.00 2.54 2.53 0.00 91 Q 8.07 4.08 0.00 2.38 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.78 0.00 0.00 0.00 0.00 0.00 2.42 2.65 0.00 92 W 8.65 4.42 0.00 3.35 3.27 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 93 Y 8.86 4.30 0.00 3.17 3.29 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 94 A 8.20 4.00 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 0.00 0.00 95 Q 7.78 4.28 0.00 2.27 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.88 0.00 0.00 0.00 0.00 0.00 2.38 2.51 0.00 96 Q 6.96 4.22 0.00 1.99 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.90 0.00 0.00 0.00 0.00 0.00 2.62 2.47 0.00 97 S 8.33 4.32 0.00 4.04 3.96 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 0.00 0.00 0.00 98 P 0.00 4.18 0.00 2.16 2.14 0.00 3.59 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.17 0.00 99 D 8.03 4.33 0.00 2.72 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 0.00 100 F 7.99 3.93 0.00 3.02 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 0.00 101 R 8.39 3.78 0.00 1.80 1.94 0.00 2.33 0.00 0.00 2.58 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.17 0.00 102 A 7.84 3.96 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 0.00 103 N 7.38 3.96 0.00 1.59 1.42 0.00 0.00 6.97 6.63 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 0.00 104 L 7.47 3.95 0.00 1.91 1.83 1.07 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 105 D 8.49 4.49 0.00 2.91 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 0.00 106 A 8.17 4.21 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 0.00 107 F 8.77 4.44 0.00 3.52 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 A 8.44 4.09 1.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 A 8.61 4.16 1.70 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 0.00 110 G 8.41 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 0.00 0.00 0.00 111 I 7.37 3.53 1.92 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.71 0.78 0.00 0.00 112 N 8.41 4.34 0.00 2.92 2.90 0.00 0.00 6.95 7.33 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 0.00 113 A 8.44 4.08 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 0.00 0.00 0.00 0.00 0.00 114 Y 7.92 3.52 0.00 1.69 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 0.00 115 A 7.53 3.73 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 0.00 116 Q 8.03 3.99 0.00 2.16 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.98 0.00 0.00 0.00 0.00 0.00 2.37 2.55 0.00 117 Q 8.05 4.21 0.00 2.24 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 7.10 0.00 0.00 0.00 0.00 0.00 2.63 2.77 0.00 118 N 7.75 4.91 0.00 1.76 2.57 0.00 0.00 6.59 7.59 0.00 0.00 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 P 0.00 4.17 0.00 2.15 2.25 0.00 3.65 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 2.01 1.91 0.00 120 D 7.90 4.42 0.00 2.61 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 0.00 121 D 7.82 4.65 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 0.00 122 I 7.02 4.37 1.82 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.74 0.88 0.00 0.00 123 S 9.15 4.08 0.00 4.13 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 0.00 124 P 0.00 4.26 0.00 2.20 2.10 0.00 3.64 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.15 0.00 125 D 8.18 4.53 0.00 3.03 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 0.00 126 V 7.68 4.49 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 0.69 0.00 0.00 0.98 0.00 0.00 127 R 7.81 3.96 0.00 1.85 1.94 0.00 3.10 0.00 0.00 3.18 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.85 0.00 128 Q 7.85 3.96 0.00 1.87 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 7.10 0.00 0.00 0.00 0.00 0.00 2.00 1.31 0.00 129 V 7.25 3.44 2.19 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 0.95 0.00 0.00 0.90 0.00 0.00 130 L 7.36 4.17 0.00 1.72 1.58 0.88 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 131 P 0.00 4.72 0.00 2.20 2.06 0.00 3.75 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 1.98 1.99 0.00 132 V 8.92 4.51 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 0.93 0.00 0.00 1.09 0.00 0.00 133 S 9.23 4.95 0.00 3.80 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 0.00 134 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 0.00 135 A 7.22 3.88 0.95 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 0.00 0.00 136 D 7.64 4.13 0.00 2.69 2.41 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 0.00 137 V 7.35 3.18 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 1.06 0.00 0.00 1.27 0.00 0.00 138 V 7.89 3.76 2.39 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 1.29 0.00 0.00 1.28 0.00 0.00 139 A 8.19 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 0.00 140 H 8.35 4.16 0.00 3.31 3.35 0.00 5.79 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 0.00 141 A 7.79 4.07 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 0.00 142 H 8.38 4.59 0.00 3.22 3.56 0.00 5.96 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 R 8.29 4.19 0.00 1.97 2.16 0.00 3.32 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.83 0.00 144 L 8.08 4.13 0.00 1.84 1.87 1.06 0.78 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 *146 N 8.02 4.54 0.00 2.82 2.42 0.00 0.00 6.89 8.13 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 0.00 147 F 8.27 5.94 0.00 3.10 3.43 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 0.00 148 L 8.04 4.68 0.00 1.77 1.52 0.98 0.92 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 0.00 149 Y 8.04 4.11 0.00 3.10 2.96 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 0.00 0.00 0.00 150 V 7.95 3.57 2.19 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 0.75 0.00 0.00 0.96 0.00 0.00 151 A 8.19 4.65 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 0.00 152 S 8.29 4.77 0.00 3.92 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 0.00 153 P 0.00 2.97 0.00 1.55 0.49 0.00 3.39 0.00 0.00 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.48 0.00 154 G 7.51 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 0.00 155 R 7.60 3.95 0.00 1.81 2.00 0.00 3.13 0.00 0.00 3.17 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.63 0.00 156 T 7.27 4.04 4.35 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 1.45 0.00 0.00 157 L 8.06 4.31 0.00 1.54 1.68 0.83 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 158 G 7.17 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 0.00 159 E 7.99 4.44 0.00 1.91 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 2.23 0.00 160 G 8.08 4.21 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 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.