NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 7 T 4.3147 8.1744 110.9425 60.7469 70.7534 173.4603 8 K 3.9136 7.8536 123.9008 56.1072 32.9539 174.2509 9 L 4.8843 8.8770 126.4966 53.5284 44.2393 174.6673 10 Y 4.5965 8.9187 119.6827 56.6050 42.5891 175.2150 11 C 3.7396 8.5756 122.4884 58.3137 32.3495 173.8228 12 I 3.9452 8.6129 121.5175 64.3579 36.6605 177.2906 13 C 4.3087 8.2434 112.3504 58.1041 30.4360 173.2044 14 K 3.8953 7.6779 119.5734 58.1337 29.5938 173.7625 15 T 4.8036 8.0350 108.9326 58.7149 72.2936 172.8531 16 P 4.9358 0.0000 0.0000 62.3244 32.1135 175.9192 17 Y 3.9208 8.7699 121.7929 57.7315 39.2260 174.3772 18 D 4.6695 8.4713 127.1461 52.0203 41.8043 175.8937 19 E 3.7235 8.6326 128.3329 58.1037 29.5082 177.8070 20 S 4.4401 8.2173 110.8515 58.4919 63.7435 174.1049 21 K 4.4372 7.7061 121.1421 54.9224 33.7187 175.4106 22 F 4.7718 8.3494 123.5326 57.9573 40.5913 174.0331 23 Y 5.0016 7.9929 122.1621 56.1052 41.9791 174.5458 24 I 4.5807 8.9720 120.9696 59.3499 41.5964 174.1293 25 G 3.2831 8.2067 115.8611 44.5716 0.0000 172.4359 26 C 4.7230 8.5978 124.6553 58.5409 32.2406 174.4402 27 D 4.4178 9.0232 126.8614 56.8463 40.9344 178.2899 28 R 4.0687 7.9720 117.8663 58.8147 29.4721 177.2499 29 C 4.3317 7.9050 110.5060 57.7016 30.6356 174.6506 30 Q 3.6230 8.0475 118.0197 56.6085 26.4676 172.8063 31 N 4.8693 7.4492 117.7012 52.8928 41.0184 173.6141 32 W 5.1884 8.7250 121.3520 55.1001 32.3617 174.4938 33 Y 5.1730 9.3367 120.7891 56.2187 41.6733 174.7560 34 H 4.2583 8.9591 120.1591 55.7744 29.6558 176.3468 35 G 4.0038 8.7451 110.6278 48.3667 0.0000 175.9182 36 R 3.9321 8.0632 120.8873 59.2916 29.9292 178.1855 37 C 4.3068 8.2223 115.0710 62.0065 28.1990 174.7610 38 V 4.1961 7.4033 111.3925 60.3481 31.7545 175.7225 39 G 3.9038 7.8762 106.9632 46.6955 0.0000 174.9099 40 I 4.5684 8.0729 118.3524 58.3216 41.0176 176.8291 41 L 4.1975 8.3586 125.3363 54.3551 43.4296 177.9480 42 Q 3.2371 8.2706 122.5540 58.9503 29.3697 178.5137 43 S 4.6824 7.7305 115.9893 60.1437 62.9545 175.7178 44 E 4.0868 7.9505 122.1825 58.5645 29.2883 178.0385 45 A 4.1479 7.8794 120.6767 54.5194 18.3914 179.0899 46 E 4.0232 7.9115 115.5879 58.6417 29.7408 178.1664 47 L 4.6677 7.4873 117.0499 54.1514 41.9133 176.1752 48 I 4.6664 7.3647 112.2783 59.2311 39.9661 175.1742 49 D 4.6960 8.7387 122.0035 54.9040 41.8489 176.1419 50 E 4.9853 7.9819 118.5794 54.3778 32.4502 174.1914 51 Y 4.8752 9.7678 126.6501 55.7510 42.5707 173.9300 52 V 4.2315 7.3123 125.5638 60.5838 33.7329 175.0437 53 C 3.8631 7.8779 121.9678 56.4733 30.5552 172.6027 54 P 4.1252 0.0000 0.0000 66.1114 30.7941 178.9125 55 Q 3.9549 7.8642 115.7899 59.2807 28.6815 178.5205 56 C 4.1022 7.8846 117.2083 62.8001 28.0976 175.8153 57 Q 3.8673 8.3306 121.6359 59.0510 28.5847 178.2254 58 S 4.0397 8.1959 114.3439 61.6809 62.2141 176.3238 59 T 3.8814 7.7950 117.3896 66.6820 68.2481 176.2772 60 E 4.0934 8.2244 119.9587 59.4872 29.5161 178.8632 61 D 4.5107 8.2268 118.2735 56.8268 40.9600 178.0269 62 A 4.2454 7.7266 120.7308 52.6896 19.0548 178.5525 *64 T 4.3144 7.9358 113.3225 63.1456 70.9023 175.0413 65 V 4.0457 7.6315 112.9574 61.6934 32.1438 176.9106 66 L 4.5230 7.6358 118.6241 55.1861 43.3554 177.0231 67 T 4.1781 7.6644 107.6895 60.3887 69.5144 172.2557 68 P 4.6805 0.0000 0.0000 62.7681 32.2044 176.0960 69 L 4.6157 8.4148 124.1584 54.8282 42.4374 177.4406 70 T 4.3583 9.7880 115.6327 60.7629 70.8845 175.7728 71 E 4.0693 8.8083 120.2517 59.5043 29.3293 179.7358 72 K 4.0522 8.0103 118.1835 59.3414 32.0773 178.9233 73 D 4.2023 8.1916 119.2761 57.6930 40.8036 178.4434 74 Y 3.7751 8.2810 117.1258 61.0934 37.8582 178.6430 75 E 4.1963 8.3819 119.2755 59.2935 29.4923 179.6514 76 G 3.6949 8.1220 105.9219 47.8064 0.0000 175.7982 77 L 3.6289 8.3321 121.8422 57.3301 41.5045 179.7681 78 K 4.0977 8.1126 118.4514 59.5760 31.9152 179.6495 79 R 4.0131 7.9036 117.9492 59.1068 29.9943 179.2345 80 V 3.7020 8.1108 118.1943 66.0507 31.5710 178.0337 81 L 4.1448 8.1852 118.6496 58.1063 41.3921 179.8079 82 R 4.4283 8.2496 119.2805 58.7458 29.7258 179.1099 83 S 4.2574 8.2958 112.4888 61.3547 62.6930 175.9881 84 L 4.2962 8.3153 121.7237 58.0570 41.3337 179.4856 85 Q 4.0811 8.8093 117.8932 58.3433 28.3839 178.0032 86 A 4.3559 7.5879 120.0261 52.1004 19.6204 177.0645 87 H 4.1055 7.6460 117.8647 55.6634 30.3940 177.3447 88 K 4.1432 8.2424 126.5418 56.2081 31.0879 177.7830 *90 A 4.5573 8.0887 121.5718 51.0939 20.5055 179.1629 91 W 4.4406 8.4993 112.9315 58.8853 27.7969 175.4160 92 P 4.0261 0.0000 0.0000 63.1785 31.1070 176.2498 93 F 4.8989 7.7166 117.6358 57.2799 40.0616 177.1800 94 L 4.0574 7.9672 122.6306 57.1470 41.6619 176.6264 95 E 4.7878 7.6325 114.7020 53.3142 33.5291 173.4199 96 P 4.3587 0.0000 0.0000 62.2685 31.9466 177.0303 97 V 3.3571 8.0246 121.3791 63.1008 31.9814 174.8151 98 D 4.7198 8.3827 125.6518 52.6064 41.8666 175.0148 99 P 4.4673 0.0000 0.0000 66.1731 31.0994 178.1375 100 N 4.5787 8.6565 113.9549 55.5650 38.4877 176.4529 101 D 4.8339 8.2529 119.8241 54.9011 42.4963 176.4063 102 A 4.6441 7.4745 121.5175 49.2288 19.4525 174.0088 103 P 4.5015 0.0000 0.0000 64.4387 31.9532 177.2928 104 D 4.7605 8.0561 115.4503 53.4710 40.4252 177.3259 105 Y 3.5205 7.9686 121.9645 61.4029 38.4746 177.5945 106 Y 4.2650 7.9203 115.5555 59.9602 38.1452 177.7570 107 G 3.8183 8.0095 105.7119 46.4457 0.0000 175.4057 108 V 4.1708 7.3794 119.3211 63.5995 32.0706 175.9189 109 I 4.0273 7.3256 120.6902 59.6088 36.9302 175.8783 110 K 4.1502 8.4571 126.2215 58.5139 32.4340 177.5529 111 E 4.5786 7.5431 117.1961 53.2292 29.5176 172.8893 112 P 4.3349 0.0000 0.0000 62.2201 32.5482 175.7614 *114 D 4.3811 8.0991 117.5360 52.7947 40.2054 175.6278 115 L 3.9932 8.6587 119.5068 57.6941 41.9810 179.1354 116 A 4.1688 8.0645 121.9887 55.5424 18.5327 180.0989 117 T 3.8999 8.3582 111.5125 64.0147 67.9410 176.1386 *119 E 4.3110 8.3091 124.5190 56.3125 31.6972 177.3328 120 E 3.9575 8.3228 118.9946 59.4013 29.5541 179.0362 121 R 3.8238 8.2203 118.3292 59.1347 30.0146 179.2472 122 V 4.0594 8.0352 117.6745 66.2061 31.4557 177.5989 123 Q 4.1584 8.3626 118.7145 58.7918 28.9093 177.5426 124 R 4.4176 7.8163 114.2844 55.0963 30.0482 176.1982 125 R 4.4620 8.0209 115.7351 56.7873 28.2233 177.2778 126 Y 4.1184 8.4963 120.7622 60.5277 39.1143 175.8792 127 Y 4.6821 8.0048 116.2041 57.6456 39.0469 174.8891 128 E 4.8622 10.0472 121.0907 55.8948 32.2605 176.0188 129 K 5.0695 7.9361 117.1892 53.3492 36.5160 176.7373 130 L 3.9226 8.7473 123.6099 58.6248 41.9545 179.3564 131 T 3.9052 8.0956 109.6508 65.2512 68.2228 176.1306 132 E 4.1213 8.2510 120.6926 58.9760 29.2608 179.1001 133 F 3.1665 7.8696 119.6276 61.0110 39.6173 177.0352 134 V 3.7927 7.9270 116.4929 65.8433 31.5569 177.5463 135 A 4.1738 8.1503 120.7739 54.9333 18.2643 179.5699 136 D 4.1182 7.5799 115.2601 55.3204 40.7118 178.5786 *138 T 4.2571 7.9141 118.7539 63.5022 70.7015 176.3404 139 K 3.8372 7.6910 121.9462 59.3257 31.9740 178.8388 140 I 3.4190 7.0347 119.5484 64.4382 36.9587 178.4927 141 F 4.2591 7.0607 117.8731 60.5630 38.9198 177.4965 142 D 4.3986 8.4990 119.0691 57.2860 40.4923 178.5609 143 N 4.3834 8.4499 117.4576 56.3593 38.5657 176.9864 144 C 4.2719 7.9504 119.8047 62.7834 31.5650 175.9312 145 R 3.7328 7.8567 117.8022 58.5259 29.5419 178.1333 146 Y 4.3160 7.6130 118.6702 60.6844 39.0898 176.4319 147 Y 4.0850 8.4058 119.3825 59.0534 39.2850 175.4943 148 N 4.9440 7.6138 115.7439 50.3164 41.2441 172.9236 149 P 4.4845 0.0000 0.0000 62.2902 32.1437 177.6187 150 S 2.0000 8.3036 114.5380 59.9908 62.6978 174.5908 151 D 4.5971 7.6252 118.6186 53.1832 40.0781 176.8988 152 S 4.4338 7.9759 115.8930 57.6636 64.3996 172.9456 153 P 4.3772 0.0000 0.0000 65.5078 31.2023 179.1108 154 F 4.0356 8.0854 116.5578 60.5368 38.8148 176.9245 155 Y 4.0731 8.1903 118.6306 61.0620 38.6854 178.0853 156 Q 4.2523 8.4482 118.8547 59.1177 28.6456 178.6256 157 C 4.2076 8.3718 117.8915 62.5895 28.0657 175.9196 158 A 3.9559 8.1427 122.0318 55.1017 17.9984 179.4683 159 E 3.7189 8.0545 117.0798 59.4716 29.5645 179.8031 160 V 3.5278 7.9216 118.2201 66.0720 31.6694 177.8479 161 L 3.8543 8.0479 120.3226 57.9562 41.7663 178.5610 162 E 3.4029 7.4868 119.4614 58.8924 29.3152 178.6427 163 S 4.0427 7.8578 113.2387 61.2554 62.4232 175.9176 164 F 4.1334 8.4070 123.3149 61.3194 39.2022 176.6880 165 F 4.2756 8.8766 120.7213 61.4989 38.9538 177.1144 166 V 3.2793 7.8477 116.7477 65.9999 31.6647 177.4788 167 Q 3.9630 7.6854 119.2889 59.0668 28.6634 178.2526 168 K 3.7827 7.5241 118.5452 59.1824 32.4498 178.6130 169 L 3.9990 7.5321 119.5690 55.3769 41.8334 176.6962 170 K 3.9762 7.0443 118.3334 58.1950 32.1842 176.6764 171 G 3.8887 8.8745 111.9626 46.5192 0.0000 174.7985 172 F 4.1220 8.0465 121.8974 60.8583 39.6534 175.2350 173 K 3.9761 7.9814 122.8258 56.5916 31.8598 176.9805 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 7 T 8.17 4.31 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 1.22 0.00 0.00 8 K 7.85 3.91 0.00 1.71 1.45 0.00 1.55 0.00 0.00 1.21 0.00 0.00 2.43 0.00 0.00 2.72 0.00 0.00 0.00 0.00 0.58 1.21 7.81 9 L 8.88 4.88 0.00 1.47 1.43 0.95 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 10 Y 8.92 4.60 0.00 2.88 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 11 C 8.58 3.74 0.00 3.23 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 12 I 8.61 3.95 2.03 0.00 0.00 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 1.68 1.04 1.00 0.00 0.00 13 C 8.24 4.31 0.00 3.15 3.13 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 14 K 7.68 3.90 0.00 1.94 1.87 0.00 1.65 0.00 0.00 1.76 0.00 0.00 3.04 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.62 1.52 7.81 15 T 8.04 4.80 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 1.35 0.00 0.00 16 P 0.00 4.94 0.00 2.14 2.11 0.00 3.75 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 2.07 2.12 0.00 17 Y 8.77 3.92 0.00 2.53 2.76 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.47 4.67 0.00 2.65 2.46 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 19 E 8.63 3.72 0.00 1.95 1.93 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 2.33 2.36 0.00 20 S 8.22 4.44 0.00 3.99 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 21 K 7.71 4.44 0.00 1.57 1.49 0.00 1.58 0.00 0.00 1.56 0.00 0.00 2.89 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.48 1.38 7.81 22 F 8.35 4.77 0.00 3.12 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 23 Y 7.99 5.00 0.00 2.80 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 24 I 8.97 4.58 1.62 0.00 0.00 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 1.57 0.72 0.00 0.00 25 G 8.21 3.28 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 0.00 26 C 8.60 4.72 0.00 3.09 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 27 D 9.02 4.42 0.00 2.63 2.68 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 28 R 7.97 4.07 0.00 1.73 1.92 0.00 3.30 0.00 0.00 3.22 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.55 0.00 29 C 7.91 4.33 0.00 3.12 3.18 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 30 Q 8.05 3.62 0.00 2.27 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.93 0.00 0.00 0.00 0.00 0.00 2.26 2.43 0.00 31 N 7.45 4.87 0.00 3.00 2.76 0.00 0.00 7.04 7.83 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 32 W 8.73 5.19 0.00 3.03 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 33 Y 9.34 5.17 0.00 3.00 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 34 H 8.96 4.26 0.00 3.12 3.11 0.00 5.66 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 G 8.75 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 36 R 8.06 3.93 0.00 1.91 1.95 0.00 3.19 0.00 0.00 3.33 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.74 0.00 37 C 8.22 4.31 0.00 3.29 3.13 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 38 V 7.40 4.20 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 0.68 0.00 0.00 1.05 0.00 0.00 39 G 7.88 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 40 I 8.07 4.57 1.83 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 1.32 0.89 0.90 0.00 0.00 41 L 8.36 4.20 0.00 1.64 1.52 0.90 0.73 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 42 Q 8.27 3.24 0.00 1.27 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.94 7.13 0.00 0.00 0.00 0.00 0.00 1.87 1.16 0.00 43 S 7.73 4.68 0.00 4.04 4.02 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 44 E 7.95 4.09 0.00 2.04 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 2.38 2.37 0.00 45 A 7.88 4.15 1.53 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 0.00 0.00 0.00 0.00 0.00 0.00 46 E 7.91 4.02 0.00 2.23 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 2.34 2.47 0.00 47 L 7.49 4.67 0.00 1.78 1.69 0.92 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 48 I 7.36 4.67 1.93 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 1.48 0.72 0.95 0.00 0.00 49 D 8.74 4.70 0.00 2.68 2.78 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 50 E 7.98 4.99 0.00 1.92 1.77 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 2.15 2.42 0.00 51 Y 9.77 4.88 0.00 2.98 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 52 V 7.31 4.23 1.79 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 0.74 0.00 0.00 0.78 0.00 0.00 53 C 7.88 3.86 0.00 2.13 2.42 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 54 P 0.00 4.13 0.00 2.11 2.13 0.00 3.23 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.16 0.00 55 Q 7.86 3.95 0.00 2.07 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.90 0.00 0.00 0.00 0.00 0.00 2.47 2.44 0.00 56 C 7.88 4.10 0.00 2.95 2.88 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 57 Q 8.33 3.87 0.00 2.07 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.81 0.00 0.00 0.00 0.00 0.00 2.28 2.35 0.00 58 S 8.20 4.04 0.00 3.99 4.01 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 1.21 0.00 0.00 68 P 0.00 4.68 0.00 1.99 2.06 0.00 3.69 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 2.04 2.14 0.00 69 L 8.41 4.62 0.00 1.86 1.89 0.98 0.94 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 70 T 9.79 4.36 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 1.25 0.00 0.00 71 E 8.81 4.07 0.00 2.01 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 2.38 2.34 0.00 72 K 8.01 4.05 0.00 1.76 1.79 0.00 1.63 0.00 0.00 1.77 0.00 0.00 2.92 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.51 1.51 7.81 73 D 8.19 4.20 0.00 3.06 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 74 Y 8.28 3.78 0.00 3.26 3.12 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 75 E 8.38 4.20 0.00 2.20 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 2.39 2.63 0.00 76 G 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*138 T 7.91 4.26 4.32 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 1.25 0.00 0.00 139 K 7.69 3.84 0.00 1.89 1.81 0.00 1.56 0.00 0.00 1.82 0.00 0.00 2.96 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.38 1.39 7.81 140 I 7.03 3.42 0.81 0.00 0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 1.02 0.10 0.00 0.00 141 F 7.06 4.26 0.00 2.92 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 0.00 142 D 8.50 4.40 0.00 2.66 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 0.00 143 N 8.45 4.38 0.00 2.76 2.89 0.00 0.00 6.63 7.97 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 0.00 144 C 7.95 4.27 0.00 3.33 3.20 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 0.00 145 R 7.86 3.73 0.00 1.72 1.79 0.00 2.89 0.00 0.00 2.95 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.29 0.00 146 Y 7.61 4.32 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 0.00 147 Y 8.41 4.09 0.00 3.06 3.08 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 0.00 148 N 7.61 4.94 0.00 2.96 2.86 0.00 0.00 7.08 7.43 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 0.00 149 P 0.00 4.48 0.00 2.37 2.12 0.00 3.72 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 2.09 1.93 0.00 150 S 8.30 2.00 0.00 3.19 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 0.00 151 D 7.63 4.60 0.00 2.76 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 0.00 152 S 7.98 4.43 0.00 4.04 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 0.00 153 P 0.00 4.38 0.00 2.09 2.09 0.00 3.70 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 2.10 2.19 0.00 154 F 8.09 4.04 0.00 3.19 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 0.00 155 Y 8.19 4.07 0.00 3.23 3.15 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 0.00 156 Q 8.45 4.25 0.00 2.35 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.58 0.00 0.00 0.00 0.00 0.00 2.49 2.61 0.00 157 C 8.37 4.21 0.00 3.17 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 0.00 158 A 8.14 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 0.00 159 E 8.05 3.72 0.00 2.22 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 2.53 2.69 0.00 160 V 7.92 3.53 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 1.05 0.00 0.00 1.00 0.00 0.00 161 L 8.05 3.85 0.00 1.92 1.51 0.74 1.29 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 0.00 162 E 7.49 3.40 0.00 1.16 1.58 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 2.20 2.29 0.00 163 S 7.86 4.04 0.00 4.02 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 0.00 164 F 8.41 4.13 0.00 3.19 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 0.00 165 F 8.88 4.28 0.00 3.37 3.41 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 0.00 166 V 7.85 3.28 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 0.78 0.00 0.00 1.04 0.00 0.00 167 Q 7.69 3.96 0.00 2.04 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.57 0.00 0.00 0.00 0.00 0.00 2.24 2.28 0.00 168 K 7.52 3.78 0.00 1.66 1.73 0.00 1.77 0.00 0.00 1.52 0.00 0.00 3.08 0.00 0.00 3.02 0.00 0.00 0.00 0.00 0.77 1.35 7.81 169 L 7.53 4.00 0.00 1.23 1.32 0.38 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 170 K 7.04 3.98 0.00 1.97 1.71 0.00 1.67 0.00 0.00 1.74 0.00 0.00 3.02 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.42 1.40 7.81 171 G 8.87 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 0.00 0.00 0.00 172 F 8.05 4.12 0.00 3.09 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 0.00 173 K 7.98 3.98 0.00 1.79 1.69 0.00 2.07 0.00 0.00 1.90 0.00 0.00 3.21 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.64 1.60 7.81 * Residues marked with a * may have inaccurate shift predictions.