NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 48 Q 4.4294 8.3293 119.7100 55.7983 30.6473 175.1222 49 N 4.5417 8.3149 115.1545 52.4234 38.9550 172.5399 50 W 5.0385 9.1850 122.2678 55.5649 31.5334 176.2196 51 R 5.3941 9.3014 124.0483 54.2875 34.2046 174.5544 52 L 5.5750 9.3144 122.3121 53.5072 46.3350 174.9247 53 L 4.7998 9.0232 126.1087 53.2868 45.2978 175.1841 54 R 4.3373 8.5301 125.6327 55.4934 31.1100 176.0467 55 D 4.6437 9.1898 126.1686 52.6622 40.6731 176.6708 56 E 4.1278 8.5753 124.9053 58.2232 29.9939 178.8121 57 S 4.0543 7.8546 113.0975 58.9599 63.3447 175.0704 58 A 3.7548 8.1618 120.5291 52.7597 16.0191 177.5599 59 Q 4.3432 8.0267 116.0252 57.2633 29.6791 176.7414 60 L 3.9372 8.0599 118.5479 55.0068 42.0494 177.5553 61 R 4.7138 8.8248 122.6052 54.1162 33.7091 177.2643 62 I 2.9696 8.0905 118.4954 64.3624 37.3971 177.3534 63 A 3.8044 7.6488 119.5042 55.2615 18.3345 178.8821 64 D 4.2626 7.7201 116.8291 57.3597 40.8624 178.9907 65 V 3.1668 7.3827 118.8818 65.7415 31.1701 178.0723 66 L 3.7557 7.3157 117.2535 57.0893 41.4411 178.6508 67 Q 4.2682 7.3606 116.2760 56.5848 29.0427 176.3967 68 R 4.8769 7.6727 119.1568 54.5696 31.2237 177.8072 69 K 4.1850 8.4033 120.9709 59.6758 32.3907 178.8765 70 E 4.1642 8.1652 115.5748 58.3567 29.8525 178.2602 71 Q 4.2277 8.0901 118.2131 57.4549 29.2153 176.2497 72 F 4.4968 7.8718 117.7590 57.4695 39.5480 175.1716 73 R 4.8767 8.8491 121.3858 53.5010 33.7629 173.5228 74 P 4.9345 0.0000 0.0000 62.7630 32.0811 176.2677 75 L 4.4395 8.9403 123.9222 54.3453 42.4743 177.2483 76 A 4.3861 8.5865 124.3907 53.4371 19.2613 177.4146 77 K 4.5668 7.5009 112.7783 55.7589 35.9868 176.3945 78 R 4.2024 8.0856 120.0426 54.1745 28.9927 175.0098 79 S 4.1189 6.9578 110.8157 57.8826 65.7159 176.3051 80 F 4.7667 7.6360 114.5422 55.9507 40.8665 173.4543 81 I 4.8275 7.5356 119.0808 59.6482 40.9935 173.9757 82 F 5.0905 9.2827 127.0765 54.7818 43.0483 172.8152 83 P 4.7445 0.0000 0.0000 62.5813 32.1475 176.0035 84 A 4.3565 8.5639 123.9544 53.0443 18.6200 176.9447 85 S 4.6040 8.3612 115.8350 56.8698 65.8971 172.7726 86 P 4.6085 0.0000 0.0000 62.8781 31.2649 176.2905 87 Q 4.3066 7.5834 117.1999 56.7179 29.5586 175.3918 88 A 4.5896 8.9162 123.0819 50.3304 21.1269 175.8221 89 V 4.3328 8.1372 122.9578 61.4888 33.3527 174.4079 90 W 5.2098 9.3516 128.4186 54.9805 31.7187 174.5352 91 L 5.2031 9.2805 127.1452 53.5207 44.0013 174.6471 92 Q 4.4246 9.3017 127.3123 53.9992 31.8327 173.9742 93 V 4.3150 8.0469 126.3829 61.0240 34.1541 173.9446 94 Q 4.6123 8.2435 127.6608 54.4827 29.7106 175.3614 95 L 4.9206 8.1559 123.3797 52.0560 45.5231 174.8985 96 P 4.4806 0.0000 0.0000 61.4589 32.6329 175.5869 97 A 4.2965 8.2664 120.3724 52.1682 18.5725 176.9331 98 Q 4.6769 8.4120 120.5543 54.3995 30.7708 175.8206 99 K 4.4834 8.5011 118.6436 56.5767 34.0712 176.6744 100 V 4.5591 7.3017 109.8430 58.2783 35.5956 173.2829 101 P 4.0290 0.0000 0.0000 63.2953 31.6774 175.9719 102 S 4.9730 7.4499 115.2333 57.0832 66.7662 172.6528 103 W 5.5339 9.5332 119.6495 54.8468 33.8101 174.3130 104 L 5.0143 9.2658 125.8585 54.5824 42.9161 175.1374 105 W 5.5227 9.8612 135.0000 56.2670 32.8409 174.8570 106 I 4.5707 8.7712 127.2208 59.3863 40.6939 173.9762 107 F 4.9617 8.2463 130.0676 56.5553 40.8419 174.1471 108 A 4.8413 8.0989 129.2068 48.8953 18.6159 172.3662 109 P 4.1521 0.0000 0.0000 63.3001 32.2464 178.0031 110 R 4.2898 8.8773 119.0429 56.6497 28.4857 176.3821 111 V 3.8285 7.5119 119.1887 63.0416 32.1899 176.5341 112 Q 4.0415 8.9711 126.2466 57.6541 30.2820 175.3963 113 Y 5.0098 7.4323 114.3601 55.9143 40.9636 175.2091 114 L 4.8181 8.9017 126.3517 53.3039 45.2052 174.5702 115 D 5.1871 8.9848 126.7226 52.5200 43.8376 174.4378 116 Y 4.8318 8.5484 124.9562 55.7861 41.5646 173.8835 117 Y 4.9376 8.3118 123.4185 55.9454 42.3764 173.8754 118 L 4.9042 8.6385 125.9003 53.0820 44.9369 174.9400 119 V 4.9283 8.6529 126.3450 61.2674 33.8270 174.9034 120 Q 4.4603 8.7254 125.7363 55.5949 32.6941 174.8556 121 D 4.4006 9.7553 121.1398 55.5224 38.4262 174.8577 122 G 3.9296 8.3280 103.9302 45.6971 0.0000 173.5294 123 Q 4.5662 7.6046 117.8001 53.5478 30.9695 174.8951 124 L 4.4988 8.4158 122.0744 55.4793 41.8526 176.2720 125 V 4.2932 8.8617 126.9394 63.6081 32.9799 175.9633 126 R 4.7880 7.7192 117.8123 55.0056 34.9214 174.3305 127 D 4.5983 8.5863 121.8504 53.9046 42.9282 173.7971 128 Q 4.7282 9.1599 125.5163 54.1280 32.3847 174.3051 129 H 5.1904 8.9076 120.5084 54.6157 30.7983 173.1725 130 T 4.3599 9.2907 120.6611 61.3638 71.1068 172.0678 131 G 4.7198 9.3835 105.1134 43.9076 0.0000 174.4674 132 E 3.9676 8.8801 118.0388 58.8639 29.4305 179.1293 133 S 4.4594 7.7422 113.3650 58.3985 63.0199 175.0689 134 R 4.4633 7.2523 120.8154 53.8379 29.6615 173.6995 135 P 4.2171 0.0000 0.0000 62.2540 33.0283 177.2888 136 F 4.1059 8.2955 115.8136 58.2783 36.1736 174.6938 137 Q 4.5468 7.4389 120.0990 54.0107 29.6723 174.9787 138 E 4.3010 8.7700 121.8165 55.4805 30.5279 175.8967 139 R 4.6374 8.2193 122.9375 53.3053 32.5577 174.5680 140 P 4.3187 0.0000 0.0000 65.3569 31.9092 177.0051 141 L 4.2228 7.6187 119.4032 53.1083 42.3431 175.7448 142 P 4.2356 0.0000 0.0000 65.7150 31.3451 177.6069 143 S 4.2509 7.9481 110.2043 58.7511 63.3617 174.4812 144 R 3.7910 8.2012 119.2395 57.1375 27.8568 176.4019 145 S 4.5696 7.6924 113.0054 59.3524 63.8966 173.2601 146 Y 4.5928 9.3074 119.6316 56.3403 40.2813 175.0023 147 L 5.2887 8.0317 121.9868 52.9429 45.3635 175.8940 148 F 4.7717 9.0558 121.3438 55.4121 42.2371 174.3513 149 S 4.2003 9.0642 119.6299 58.1626 63.0397 172.9910 150 L 4.7768 8.1888 128.1461 52.1406 42.6391 174.9702 151 P 4.2076 0.0000 0.0000 62.8045 31.8373 176.8461 152 V 4.1122 8.0277 121.6547 61.6084 30.3005 174.4159 153 D 4.6860 8.0221 122.0470 52.4875 40.4326 177.2077 154 G 3.9737 8.6063 106.4936 45.8268 0.0000 173.8862 155 K 4.6552 7.6899 119.2943 53.3983 35.4088 175.7955 156 P 4.4163 0.0000 0.0000 62.6862 32.3550 174.7398 *158 T 4.0822 8.2515 113.1011 64.0196 69.9856 173.0776 159 L 4.8991 8.3834 126.4218 53.2758 44.4394 175.1352 160 Y 5.2087 8.9159 119.8392 56.2339 42.0368 174.7088 161 V 4.8024 8.9913 122.8762 61.2960 34.8180 174.9660 162 R 4.2396 8.7610 128.6564 53.8293 32.7890 174.5422 *164 T 4.4702 8.0937 109.8831 62.0074 70.2711 172.9503 165 S 4.8744 8.2986 115.2774 57.5854 65.2315 173.9656 166 N 4.5262 8.4014 121.2945 54.6677 38.7017 175.0739 167 H 4.9542 7.7303 115.2083 52.9619 31.3381 172.8886 168 P 4.4531 0.0000 0.0000 63.6954 31.5757 176.0568 169 L 4.5000 8.9403 125.8878 54.2729 43.9709 175.3080 *171 A 4.2911 8.3432 125.2486 51.5338 20.3436 175.3268 172 W 4.7046 8.8203 119.7870 54.9425 32.4459 174.9306 173 F 5.0864 7.5063 116.3816 56.3183 40.6806 172.5647 174 D 4.5412 9.2839 117.9816 53.8728 45.4721 174.3030 175 Q 5.3099 9.3778 124.3166 55.7953 30.0170 174.9025 176 I 4.9094 9.2913 119.6927 59.4207 41.4529 174.9473 177 D 5.3840 8.4346 123.6158 52.4519 42.4539 175.8851 178 E 4.0590 9.3115 117.1597 60.0125 29.2264 179.0508 179 A 4.1069 8.1964 119.2776 55.1687 18.6107 179.4123 180 G 3.5603 8.1599 104.2557 47.6409 0.0000 175.5831 181 L 3.6779 7.8689 122.9177 57.9743 41.8362 179.4164 182 V 3.6637 7.6777 109.9044 63.0562 31.6422 177.0086 183 G 3.8524 7.3475 107.5433 44.9916 0.0000 174.1577 184 L 4.0299 7.2101 119.5980 54.5490 42.3091 177.0224 185 E 4.1370 8.1073 119.5056 56.7388 30.5120 175.5521 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 48 Q 8.33 4.43 0.00 2.12 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.92 0.00 0.00 0.00 0.00 0.00 2.34 2.42 0.00 49 N 8.31 4.54 0.00 2.91 3.06 0.00 0.00 6.02 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 50 W 9.19 5.04 0.00 3.41 3.46 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 51 R 9.30 5.39 0.00 1.70 2.07 0.00 3.24 0.00 0.00 3.21 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.58 0.00 52 L 9.31 5.58 0.00 1.93 1.60 1.16 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 53 L 9.02 4.80 0.00 0.35 0.66 0.61 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 54 R 8.53 4.34 0.00 1.54 1.70 0.00 2.86 0.00 0.00 2.92 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 1.38 0.00 55 D 9.19 4.64 0.00 2.82 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 56 E 8.58 4.13 0.00 1.93 1.94 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 2.19 2.15 0.00 57 S 7.85 4.05 0.00 3.92 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 58 A 8.16 3.75 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 59 Q 8.03 4.34 0.00 2.05 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.61 6.75 0.00 0.00 0.00 0.00 0.00 2.41 2.44 0.00 60 L 8.06 3.94 0.00 1.92 1.45 0.82 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 61 R 8.82 4.71 0.00 1.97 1.79 0.00 3.16 0.00 0.00 3.09 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.62 0.00 62 I 8.09 2.97 0.66 0.00 0.00 0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.68 0.62 0.00 0.00 63 A 7.65 3.80 1.18 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 64 D 7.72 4.26 0.00 2.69 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 65 V 7.38 3.17 1.10 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 0.64 0.00 0.00 -0.75 0.00 0.00 66 L 7.32 3.76 0.00 1.56 1.53 0.69 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 67 Q 7.36 4.27 0.00 2.03 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 7.37 0.00 0.00 0.00 0.00 0.00 2.51 2.44 0.00 68 R 7.67 4.88 0.00 1.76 1.72 0.00 3.11 0.00 0.00 3.07 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.39 0.00 69 K 8.40 4.18 0.00 1.84 1.92 0.00 1.67 0.00 0.00 1.90 0.00 0.00 3.19 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.60 1.61 7.81 70 E 8.17 4.16 0.00 2.13 2.22 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 2.35 2.27 0.00 71 Q 8.09 4.23 0.00 2.05 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.87 0.00 0.00 0.00 0.00 0.00 2.31 2.26 0.00 72 F 7.87 4.50 0.00 3.03 3.02 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 73 R 8.85 4.88 0.00 1.77 1.85 0.00 3.33 0.00 0.00 3.22 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.73 0.00 74 P 0.00 4.93 0.00 2.02 2.09 0.00 3.74 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 2.17 2.20 0.00 75 L 8.94 4.44 0.00 1.97 1.96 1.47 1.23 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 76 A 8.59 4.39 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 77 K 7.50 4.57 0.00 1.78 1.73 0.00 1.54 0.00 0.00 1.69 0.00 0.00 2.95 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.31 1.55 7.81 78 R 8.09 4.20 0.00 1.56 1.63 0.00 2.47 0.00 0.00 2.25 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.25 0.00 79 S 6.96 4.12 0.00 2.97 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 80 F 7.64 4.77 0.00 2.54 3.04 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 81 I 7.54 4.83 1.61 0.00 0.00 0.81 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 0.79 0.73 0.00 0.00 82 F 9.28 5.09 0.00 2.99 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 83 P 0.00 4.74 0.00 1.99 2.05 0.00 3.89 0.00 0.00 3.78 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 84 A 8.56 4.36 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 85 S 8.36 4.60 0.00 3.83 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 86 P 0.00 4.61 0.00 2.18 2.17 0.00 3.75 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 1.95 1.93 0.00 87 Q 7.58 4.31 0.00 1.89 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.65 0.00 0.00 0.00 0.00 0.00 2.24 2.16 0.00 88 A 8.92 4.59 1.20 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 0.00 0.00 0.00 0.00 0.00 0.00 89 V 8.14 4.33 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 0.37 0.00 0.00 0.49 0.00 0.00 90 W 9.35 5.21 0.00 3.38 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 91 L 9.28 5.20 0.00 1.69 1.48 0.98 0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 92 Q 9.30 4.42 0.00 0.93 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.52 0.00 0.00 0.00 0.00 0.00 1.49 1.16 0.00 93 V 8.05 4.32 1.48 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 -0.66 0.00 0.00 0.24 0.00 0.00 94 Q 8.24 4.61 0.00 1.84 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.90 6.40 0.00 0.00 0.00 0.00 0.00 2.13 2.06 0.00 95 L 8.16 4.92 0.00 1.39 1.49 0.88 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 96 P 0.00 4.48 0.00 2.18 2.09 0.00 3.80 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 2.00 1.98 0.00 97 A 8.27 4.30 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 98 Q 8.41 4.68 0.00 2.14 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.82 0.00 0.00 0.00 0.00 0.00 2.38 2.29 0.00 99 K 8.50 4.48 0.00 1.72 1.83 0.00 1.70 0.00 0.00 1.72 0.00 0.00 3.03 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.35 1.43 7.81 100 V 7.30 4.56 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 0.76 0.00 0.00 0.96 0.00 0.00 101 P 0.00 4.03 0.00 2.01 1.71 0.00 3.68 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 2.06 2.03 0.00 102 S 7.45 4.97 0.00 4.07 3.92 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 0.00 0.00 0.00 103 W 9.53 5.53 0.00 3.37 3.06 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 0.00 0.00 0.00 104 L 9.27 5.01 0.00 2.03 1.86 1.41 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 105 W 9.86 5.52 0.00 3.51 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 0.00 106 I 8.77 4.57 2.05 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.11 1.00 0.00 0.00 107 F 8.25 4.96 0.00 3.16 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 0.00 108 A 8.10 4.84 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 0.00 109 P 0.00 4.15 0.00 2.07 1.72 0.00 3.52 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.64 0.00 110 R 8.88 4.29 0.00 2.00 2.12 0.00 2.92 0.00 0.00 2.91 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.46 0.00 111 V 7.51 3.83 2.22 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 0.98 0.00 0.00 1.01 0.00 0.00 112 Q 8.97 4.04 0.00 2.04 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.52 0.00 0.00 0.00 0.00 0.00 2.28 2.47 0.00 113 Y 7.43 5.01 0.00 2.84 2.81 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.90 4.82 0.00 1.44 1.17 0.36 0.79 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 0.00 115 D 8.98 5.19 0.00 2.45 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 0.00 0.00 0.00 116 Y 8.55 4.83 0.00 2.04 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 0.00 0.00 0.00 0.00 117 Y 8.31 4.94 0.00 2.84 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 0.00 118 L 8.64 4.90 0.00 1.51 1.42 0.91 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 119 V 8.65 4.93 2.25 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 0.89 0.00 0.00 1.00 0.00 0.00 120 Q 8.73 4.46 0.00 2.09 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.06 6.02 0.00 0.00 0.00 0.00 0.00 2.40 2.30 0.00 121 D 9.76 4.40 0.00 2.77 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 0.00 122 G 8.33 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 0.00 123 Q 7.60 4.57 0.00 2.22 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.94 6.93 0.00 0.00 0.00 0.00 0.00 2.41 2.28 0.00 124 L 8.42 4.50 0.00 1.60 1.67 1.12 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 125 V 8.86 4.29 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 0.85 0.00 0.00 0.99 0.00 0.00 126 R 7.72 4.79 0.00 1.84 1.90 0.00 3.42 0.00 0.00 3.42 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.71 0.00 127 D 8.59 4.60 0.00 2.75 2.60 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 0.00 128 Q 9.16 4.73 0.00 2.12 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.83 6.53 0.00 0.00 0.00 0.00 0.00 2.39 2.42 0.00 129 H 8.91 5.19 0.00 3.06 3.27 0.00 5.66 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 T 9.29 4.36 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 1.34 0.00 0.00 131 G 9.38 4.72 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 0.00 0.00 0.00 132 E 8.88 3.97 0.00 2.06 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 0.00 2.31 2.44 0.00 133 S 7.74 4.46 0.00 2.73 3.46 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 0.00 134 R 7.25 4.46 0.00 1.80 1.87 0.00 3.29 0.00 0.00 3.57 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.68 0.00 135 P 0.00 4.22 0.00 0.52 1.49 0.00 3.32 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.78 0.00 136 F 8.30 4.11 0.00 3.28 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 0.00 137 Q 7.44 4.55 0.00 2.20 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.81 0.00 0.00 0.00 0.00 0.00 2.39 2.35 0.00 138 E 8.77 4.30 0.00 2.08 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 2.26 2.28 0.00 139 R 8.22 4.64 0.00 1.69 1.73 0.00 2.93 0.00 0.00 2.97 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.51 0.00 140 P 0.00 4.32 0.00 2.10 2.13 0.00 3.67 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.91 0.00 141 L 7.62 4.22 0.00 1.68 1.72 0.92 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 142 P 0.00 4.24 0.00 1.97 2.09 0.00 3.50 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 2.17 2.05 0.00 143 S 7.95 4.25 0.00 3.86 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 0.00 144 R 8.20 3.79 0.00 1.90 1.89 0.00 3.43 0.00 0.00 3.18 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.69 0.00 145 S 7.69 4.57 0.00 3.94 4.20 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 0.00 0.00 0.00 0.00 146 Y 9.31 4.59 0.00 2.89 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 0.00 147 L 8.03 5.29 0.00 1.38 1.57 0.65 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 148 F 9.06 4.77 0.00 2.62 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 0.00 0.00 0.00 0.00 149 S 9.06 4.20 0.00 3.92 3.79 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 0.00 150 L 8.19 4.78 0.00 1.49 1.59 1.02 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 151 P 0.00 4.21 0.00 2.31 2.05 0.00 3.76 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 1.98 1.97 0.00 152 V 8.03 4.11 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 0.92 0.00 0.00 0.87 0.00 0.00 153 D 8.02 4.69 0.00 2.73 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 0.00 154 G 8.61 3.97 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 0.00 155 K 7.69 4.66 0.00 1.87 1.65 0.00 1.67 0.00 0.00 1.82 0.00 0.00 2.98 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.33 1.32 7.81 156 P 0.00 4.42 0.00 2.14 2.09 0.00 3.78 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.97 0.00 *158 T 8.25 4.08 4.15 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 0.63 0.00 0.00 159 L 8.38 4.90 0.00 1.37 1.41 0.95 0.45 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 0.00 160 Y 8.92 5.21 0.00 3.06 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 0.00 161 V 8.99 4.80 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 0.88 0.00 0.00 0.94 0.00 0.00 162 R 8.76 4.24 0.00 0.67 1.11 0.00 2.91 0.00 0.00 3.26 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.50 0.00 *164 T 8.09 4.47 4.28 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 1.16 0.00 0.00 165 S 8.30 4.87 0.00 3.85 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 0.00 166 N 8.40 4.53 0.00 2.52 2.75 0.00 0.00 6.88 8.03 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 0.00 167 H 7.73 4.95 0.00 3.07 3.23 0.00 5.69 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 168 P 0.00 4.45 0.00 1.96 2.07 0.00 3.74 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 2.08 2.16 0.00 169 L 8.94 4.50 0.00 1.92 1.87 0.93 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 *171 A 8.34 4.29 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 172 W 8.82 4.70 0.00 3.23 2.95 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 0.00 173 F 7.51 5.09 0.00 3.27 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 0.00 174 D 9.28 4.54 0.00 3.06 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 0.00 175 Q 9.38 5.31 0.00 2.58 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.51 0.00 0.00 0.00 0.00 0.00 2.54 2.70 0.00 176 I 9.29 4.91 1.93 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.19 0.95 0.00 0.00 177 D 8.43 5.38 0.00 2.94 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 0.00 178 E 9.31 4.06 0.00 2.25 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 0.00 2.45 2.44 0.00 179 A 8.20 4.11 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 0.00 180 G 8.16 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 181 L 7.87 3.68 0.00 1.50 1.68 0.57 0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 182 V 7.68 3.66 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 0.73 0.00 0.00 0.94 0.00 0.00 183 G 7.35 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 0.00 184 L 7.21 4.03 0.00 1.54 1.42 0.72 0.29 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 0.00 185 E 8.11 4.14 0.00 1.73 1.65 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 2.08 2.12 0.00 * Residues marked with a * may have inaccurate shift predictions.