NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.5128 8.2893 120.3345 55.8687 33.4233 174.5754 2 T 4.9448 8.2924 110.1702 58.8702 70.0660 170.6594 3 E 4.4333 8.2580 119.9736 56.1407 30.9750 175.9476 4 P 4.3531 0.0000 0.0000 63.4974 32.6982 174.9116 5 I 4.6307 8.3823 123.2275 59.8104 39.6377 174.5149 6 F 5.2104 9.0322 127.2826 56.5081 40.8636 175.0835 7 M 5.0202 9.0790 124.6885 54.5298 33.1822 176.0079 8 V 4.9477 10.0000 117.3351 57.9147 35.8753 175.5141 9 G 3.9180 7.9259 111.6036 44.7705 0.0000 171.7839 10 A 4.7834 7.2077 122.1051 49.7162 19.7885 176.8948 11 R 4.0782 8.4663 119.4171 58.5345 30.1246 176.9328 12 G 3.9815 9.0876 113.3184 45.5173 0.0000 173.3586 13 C 4.1880 7.9972 113.4419 58.5093 30.3115 174.3796 14 G 3.8785 8.2366 109.0441 46.2565 0.0000 175.6435 15 K 3.8985 8.4423 119.8185 59.8070 31.9330 178.7545 16 T 4.1791 7.9670 114.8601 67.0836 68.5179 176.7158 17 T 3.7782 7.7975 116.9308 66.7120 68.6322 176.8781 18 V 3.6407 8.1696 120.6484 65.6786 31.6696 178.0653 19 G 3.7532 8.3783 106.0098 48.0878 0.0000 175.6359 20 R 2.8404 7.8690 121.9238 58.5532 29.7950 178.4360 21 E 3.9133 8.0583 118.4922 59.0507 29.5003 179.0350 22 L 3.8944 8.4365 120.7905 57.7657 42.0415 178.7386 23 A 4.0209 7.8158 120.5412 55.0992 18.3730 179.6380 24 R 3.7483 7.8200 116.5271 59.5457 30.2110 178.6652 25 A 3.9842 7.7939 120.5896 54.5739 18.1356 178.8450 26 L 4.1847 7.6032 115.2012 54.1171 42.1921 177.0104 27 G 3.8112 7.6639 106.2292 46.8635 0.0000 173.1653 28 Y 4.8780 8.4592 117.8053 56.2152 40.9542 175.2612 29 E 4.7967 9.0955 120.5832 56.1744 31.4085 175.9122 30 F 5.5212 8.5322 122.3348 56.7918 42.5055 173.9265 31 V 3.9942 7.7026 124.5511 61.0398 35.5209 173.0177 32 D 5.1606 8.1996 126.6966 52.4515 42.9835 176.3832 33 T 3.9017 8.7510 118.6432 65.2460 68.4683 176.0586 34 D 4.5229 8.7854 121.8179 57.2730 40.8303 178.7439 35 I 3.8151 8.0424 119.8912 64.2681 37.0989 177.9332 36 F 4.1074 8.5947 121.8070 61.6251 39.1131 176.9160 37 M 3.8669 8.1513 117.9537 58.4768 31.8487 178.5263 38 Q 4.2748 8.1141 120.7440 58.8807 29.0833 177.2263 39 H 4.6983 8.0666 113.8501 56.2527 28.9673 176.1757 40 T 4.2729 7.2937 112.1522 62.8243 70.2258 175.9868 41 S 4.2946 8.2005 115.9453 58.5202 63.5965 175.5225 42 G 3.9248 8.4156 110.3095 45.2144 0.0000 173.0513 43 M 4.6975 7.7805 119.8611 53.8138 33.9709 176.1355 44 T 4.6214 8.3845 114.8665 60.3296 71.5539 176.4913 45 V 3.3236 8.0432 113.4643 64.2595 31.3814 178.6880 46 A 3.6343 7.7109 120.1262 54.8890 18.2545 179.1952 47 D 4.1960 7.8313 117.4076 57.5969 40.9003 179.0793 48 V 3.5380 7.9325 118.9053 65.9838 31.4174 178.2890 49 V 3.0971 8.1954 118.1372 65.7804 31.0882 177.5724 50 A 3.8244 7.6021 118.9136 55.4125 18.2162 179.1261 51 A 4.2058 7.7022 117.6005 54.2300 18.7518 178.0856 52 E 4.4316 8.0028 112.7538 54.8412 31.9032 175.7609 53 G 3.9493 8.5907 112.7635 44.1966 0.0000 175.1354 54 W 4.6881 8.5606 118.3406 59.6666 28.8299 176.9906 55 P 4.4922 0.0000 0.0000 65.6935 30.8318 178.9250 56 G 3.6285 8.5759 104.8891 47.4828 0.0000 175.5726 57 F 4.1500 8.2173 122.5092 61.3582 39.4689 177.3501 58 R 3.9014 8.7823 118.0333 59.0835 29.8270 179.3561 59 R 3.8651 7.7936 117.7185 59.3437 30.1416 179.3188 60 R 3.8423 7.8152 117.8286 59.0479 29.9299 178.6829 61 E 3.7151 7.7882 119.1284 59.4280 29.7176 178.9998 62 S 3.9395 7.9512 115.0153 61.6787 62.7678 176.6787 63 E 3.8794 8.1121 121.0121 59.1025 29.1377 179.2228 64 A 4.0014 7.9489 120.8790 54.9348 18.6148 179.0898 65 L 3.7436 7.9064 119.1663 58.7295 41.8423 179.4106 66 Q 3.5472 7.1776 115.3997 58.5768 28.5876 178.4779 67 A 4.0876 7.6958 121.2477 55.0865 18.5818 179.6106 68 V 3.6691 7.4424 108.4273 61.5604 32.0566 176.8048 69 A 4.1894 7.3595 122.4544 52.5138 18.7150 176.6005 70 T 4.2987 7.7933 114.8025 60.5173 70.0695 171.1028 71 P 4.3318 0.0000 0.0000 63.4346 32.1459 175.4757 72 N 3.1400 8.4135 114.9212 53.5809 36.6896 174.1886 73 R 5.0525 7.0539 116.1682 54.8200 34.2617 173.4161 74 V 4.6355 9.2409 126.8837 61.7486 33.5851 174.4917 75 V 4.5824 8.7272 128.3027 61.0412 33.6881 174.2032 76 A 4.9546 8.9986 131.5107 51.7674 19.4599 176.2060 77 T 5.3169 7.9796 111.6317 58.6851 72.3529 174.5964 78 G 3.8853 8.7265 111.4003 45.1889 0.0000 174.8134 79 G 4.4270 8.9955 109.7218 47.8072 0.0000 174.5625 80 G 4.1983 8.0272 108.0101 45.3861 0.0000 174.8323 81 M 4.3030 8.0466 121.7491 57.5711 32.3744 177.2140 82 V 4.1127 7.6728 109.6749 61.4118 32.1075 176.8174 83 L 4.0133 7.6845 121.6544 57.1743 41.8321 177.5729 84 L 4.2960 7.6857 119.5234 53.5960 42.3952 176.8851 85 E 3.8884 9.0193 125.0742 59.5260 29.4973 178.7066 86 Q 3.9969 8.0936 116.9860 59.4308 28.4345 178.4978 87 N 4.3070 8.2696 118.4399 56.1491 38.7200 177.6024 88 R 3.8890 7.8797 119.0313 59.2002 30.1010 178.7739 89 Q 3.9351 8.4297 119.7206 59.0584 29.0130 177.8159 90 F 3.9907 8.2723 121.6921 61.6082 39.2607 177.1024 91 M 3.4665 7.9603 118.0273 58.4223 31.5395 179.0117 92 R 3.9744 7.5914 116.0400 59.4597 30.2302 178.5192 93 A 4.0319 8.0879 120.2932 55.4928 18.4512 179.0181 94 H 4.2104 8.4862 114.9878 60.0291 29.4130 175.6921 95 G 4.1320 8.9065 109.0585 45.7539 0.0000 171.8223 96 T 5.0473 8.7324 117.9700 61.8091 71.8613 173.6301 97 V 5.1022 8.8811 125.1553 61.1802 34.5479 174.0939 98 V 5.1132 9.3336 127.5069 61.3324 34.6415 173.2511 99 Y 5.2775 8.9168 128.9937 56.1047 40.7069 174.3450 100 L 4.5812 8.9758 128.4193 53.8598 42.3167 175.8468 101 F 4.2995 8.3774 127.3447 56.2291 41.1711 174.4891 102 A 4.3862 7.3478 126.6172 49.0646 22.1847 174.0998 103 P 4.0713 0.0000 0.0000 62.2343 32.2957 177.0348 104 A 3.9347 8.7630 122.1781 55.8000 18.0404 179.2598 105 E 3.8182 8.2833 116.7185 60.2286 29.3467 179.0457 106 E 3.9933 7.9232 117.4023 59.0507 29.4666 178.9995 107 L 4.0799 7.9512 119.3150 57.3868 41.3990 179.1962 108 A 3.9895 8.0003 120.0974 55.3664 18.5300 179.3356 109 L 4.2122 7.7713 115.8815 56.7500 41.7109 177.9438 110 R 4.1316 7.2865 116.8569 55.3794 29.4874 176.7224 111 L 4.3834 8.3091 126.8450 55.5196 40.9748 175.8883 112 Q 4.4326 8.4387 121.2017 55.2354 29.1863 174.0559 *128 I 4.1850 7.6489 119.7279 61.8632 39.6683 177.1236 129 A 4.2086 7.9267 124.0191 54.1769 18.7631 179.1329 130 E 4.3325 8.0307 111.3780 57.4750 30.8966 183.3913 131 E 4.2029 7.9664 117.5622 59.4796 29.8704 178.2115 132 M 4.1418 8.1895 118.8249 58.1100 31.8424 178.3270 133 E 3.9112 7.9055 118.1019 59.2516 29.9789 178.6659 134 A 4.0798 7.7631 119.2714 54.3932 18.5368 179.8934 135 V 3.5120 7.7806 117.2565 66.2992 31.6432 178.2974 136 L 4.4286 8.2154 118.3129 57.1783 41.1531 179.4599 137 R 3.9439 7.4267 118.8530 59.0409 30.0948 177.8060 138 E 3.9824 7.8907 117.7319 59.2148 30.0863 178.2412 139 R 4.0137 8.2777 117.2569 56.9806 30.9405 178.2523 140 E 4.0596 7.8662 119.2999 59.6399 29.7622 179.1534 141 A 4.0168 7.8992 119.8945 54.9709 18.5990 179.3773 142 L 3.9179 8.2263 117.9635 57.7227 41.4619 179.1545 143 Y 4.0798 7.2755 116.4047 61.1135 37.4779 178.4513 144 Q 4.0205 7.6964 117.8962 58.9546 28.8968 178.0594 145 D 4.4609 7.7421 118.9726 57.1292 40.9199 178.6922 146 V 3.7896 7.4841 117.8867 62.8538 32.2447 176.7996 147 A 4.2656 7.4066 122.0207 52.4379 19.0282 176.5945 148 H 4.5551 8.7574 118.8211 57.3351 30.1756 175.6038 149 Y 4.9130 7.8737 114.5005 55.9741 41.6382 174.8769 150 V 5.1486 8.6612 122.5429 61.0895 34.3148 174.9093 151 V 4.5289 8.5644 126.4918 59.4257 34.7125 174.1983 152 D 4.5486 8.7895 121.9954 54.8065 41.5206 176.2834 153 A 4.2657 8.8047 129.2159 53.2502 18.5179 177.9778 154 T 4.1272 8.1752 106.1125 62.5934 69.4570 175.2619 155 Q 4.2548 7.3238 120.6216 54.6409 29.7970 174.5776 156 P 4.4012 0.0000 0.0000 61.9193 33.2299 175.8163 157 P 4.2028 0.0000 0.0000 65.9187 31.3121 178.8472 158 A 3.9481 8.0017 118.6092 55.1049 18.2097 179.3626 159 A 3.9152 7.8838 118.7166 55.4056 18.5489 179.7893 160 I 3.6184 7.6407 117.9331 64.3397 37.0615 178.7764 161 V 3.5386 7.8744 119.1434 66.1631 31.4613 177.9310 162 C 4.0708 7.9735 116.3355 62.8240 28.0219 175.6920 163 E 3.9197 8.3473 121.0644 59.2814 29.1156 178.8870 164 L 3.9000 8.3752 119.4126 58.0403 41.6816 179.3540 165 M 3.9450 8.3320 119.0475 58.1617 31.8397 178.7598 166 Q 3.8570 7.8873 119.3146 59.5390 29.1204 178.3169 167 T 3.8258 8.0978 115.5294 66.8433 68.4975 175.5308 168 M 3.7469 7.9679 118.1760 54.9568 32.6713 176.0710 169 R 3.7494 7.1811 116.8642 57.2220 28.1470 176.2555 170 L 4.6296 7.6544 116.3358 52.1605 43.8054 175.8406 171 P 4.3976 0.0000 0.0000 62.3168 32.2743 175.6940 172 A 4.4378 8.1092 122.0537 50.6382 20.1165 177.5003 173 A 4.1809 8.2683 121.8990 52.8848 18.3653 177.9156 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 1 M 8.29 4.51 0.00 2.12 2.10 0.00 0.00 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.61 0.00 2 T 8.29 4.94 4.48 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 0.00 0.00 0.00 1.26 0.00 0.00 3 E 8.26 4.43 0.00 2.15 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 2.31 0.00 4 P 0.00 4.35 0.00 1.33 2.09 0.00 3.79 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.02 0.00 5 I 8.38 4.63 1.94 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 1.32 0.94 0.98 0.00 0.00 6 F 9.03 5.21 0.00 3.09 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 7 M 9.08 5.02 0.00 2.06 2.13 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.81 0.00 8 V 10.00 4.95 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 1.05 0.00 0.00 1.11 0.00 0.00 9 G 7.93 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 0.00 0.00 0.00 10 A 7.21 4.78 1.41 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 0.00 0.00 11 R 8.47 4.08 0.00 1.85 1.94 0.00 3.29 0.00 0.00 3.28 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.70 0.00 12 G 9.09 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 13 C 8.00 4.19 0.00 3.09 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 14 G 8.24 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 0.00 0.00 0.00 15 K 8.44 3.90 0.00 1.88 2.00 0.00 1.94 0.00 0.00 1.96 0.00 0.00 3.01 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.62 1.60 7.81 16 T 7.97 4.18 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 1.53 0.00 0.00 17 T 7.80 3.78 4.22 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 0.00 0.00 1.17 0.00 0.00 18 V 8.17 3.64 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 0.87 0.00 0.00 0.93 0.00 0.00 19 G 8.38 3.75 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 0.00 0.00 0.00 20 R 7.87 2.84 0.00 0.67 1.48 0.00 2.95 0.00 0.00 3.08 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.38 0.00 21 E 8.06 3.91 0.00 2.06 1.90 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 2.45 2.39 0.00 22 L 8.44 3.89 0.00 1.70 1.82 0.81 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 23 A 7.82 4.02 1.62 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 24 R 7.82 3.75 0.00 1.86 2.02 0.00 3.06 0.00 0.00 3.14 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.63 0.00 25 A 7.79 3.98 1.23 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 0.00 0.00 26 L 7.60 4.18 0.00 1.01 0.84 0.27 0.54 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 27 G 7.66 3.81 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 0.00 0.00 0.00 28 Y 8.46 4.88 0.00 2.98 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 29 E 9.10 4.80 0.00 1.88 1.89 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 2.34 2.26 0.00 30 F 8.53 5.52 0.00 2.98 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 31 V 7.70 3.99 1.83 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 0.76 0.00 0.00 0.80 0.00 0.00 32 D 8.20 5.16 0.00 2.72 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 33 T 8.75 3.90 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 1.18 0.00 0.00 34 D 8.79 4.52 0.00 2.98 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 35 I 8.04 3.82 2.06 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.68 1.00 0.00 0.00 36 F 8.59 4.11 0.00 3.09 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 37 M 8.15 3.87 0.00 2.20 2.46 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 2.92 2.62 0.00 38 Q 8.11 4.27 0.00 2.16 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.88 0.00 0.00 0.00 0.00 0.00 2.21 1.96 0.00 39 H 8.07 4.70 0.00 3.12 3.31 0.00 5.85 0.00 0.00 0.00 0.00 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 T 7.29 4.27 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 0.63 0.00 0.00 41 S 8.20 4.29 0.00 3.97 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 42 G 8.42 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 0.00 0.00 0.00 43 M 7.78 4.70 0.00 2.05 1.95 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.41 0.00 44 T 8.38 4.62 4.18 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 1.21 0.00 0.00 45 V 8.04 3.32 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 0.00 0.00 0.76 0.00 0.00 0.53 0.00 0.00 46 A 7.71 3.63 1.22 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 0.00 0.00 0.00 0.00 0.00 47 D 7.83 4.20 0.00 2.83 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 48 V 7.93 3.54 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 1.20 0.00 0.00 1.06 0.00 0.00 49 V 8.20 3.10 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 0.39 0.00 0.00 -0.58 0.00 0.00 50 A 7.60 3.82 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 51 A 7.70 4.21 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 52 E 8.00 4.43 0.00 1.98 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 2.22 2.21 0.00 53 G 8.59 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 0.00 0.00 0.00 54 W 8.56 4.69 0.00 3.47 3.30 0.00 0.00 0.00 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0.00 4.33 0.00 1.98 1.97 0.00 3.84 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.06 0.00 72 N 8.41 3.14 0.00 2.61 2.42 0.00 0.00 6.65 8.52 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 73 R 7.05 5.05 0.00 1.71 1.73 0.00 3.18 0.00 0.00 3.15 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.58 0.00 74 V 9.24 4.64 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 1.07 0.00 0.00 1.14 0.00 0.00 75 V 8.73 4.58 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 1.03 0.00 0.00 0.76 0.00 0.00 76 A 9.00 4.95 1.56 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 77 T 7.98 5.32 4.34 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 1.37 0.00 0.00 78 G 8.73 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 79 G 9.00 4.43 0.00 0.00 0.00 0.00 0.00 0.00 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4.02 0.00 2.17 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.97 0.00 0.00 0.00 0.00 0.00 2.60 2.57 0.00 145 D 7.74 4.46 0.00 2.75 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 0.00 146 V 7.48 3.79 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 0.85 0.00 0.00 0.90 0.00 0.00 147 A 7.41 4.27 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 0.00 148 H 8.76 4.56 0.00 3.02 2.62 0.00 5.62 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 149 Y 7.87 4.91 0.00 2.98 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 0.00 150 V 8.66 5.15 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 0.79 0.00 0.00 1.15 0.00 0.00 151 V 8.56 4.53 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 0.72 0.00 0.00 1.03 0.00 0.00 152 D 8.79 4.55 0.00 2.87 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 0.00 153 A 8.80 4.27 1.21 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 0.00 154 T 8.18 4.13 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 1.18 0.00 0.00 155 Q 7.32 4.25 0.00 2.08 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.91 0.00 0.00 0.00 0.00 0.00 2.39 2.47 0.00 156 P 0.00 4.40 0.00 2.13 1.95 0.00 3.60 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 2.09 2.16 0.00 157 P 0.00 4.20 0.00 2.11 2.07 0.00 3.58 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 2.09 2.14 0.00 158 A 8.00 3.95 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 0.00 159 A 7.88 3.92 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 0.00 160 I 7.64 3.62 1.95 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.70 0.89 0.00 0.00 161 V 7.87 3.54 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 1.04 0.00 0.00 0.87 0.00 0.00 162 C 7.97 4.07 0.00 3.19 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 0.00 163 E 8.35 3.92 0.00 2.08 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 0.00 2.28 2.34 0.00 164 L 8.38 3.90 0.00 1.84 1.60 0.91 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 165 M 8.33 3.94 0.00 2.12 2.05 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.76 2.43 0.00 166 Q 7.89 3.86 0.00 2.30 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.81 0.00 0.00 0.00 0.00 0.00 2.33 2.42 0.00 167 T 8.10 3.83 4.07 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 1.18 0.00 0.00 168 M 7.97 3.75 0.00 1.67 1.92 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 1.23 0.00 169 R 7.18 3.75 0.00 1.93 1.95 0.00 3.14 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 1.55 1.55 0.00 170 L 7.65 4.63 0.00 1.51 1.45 0.80 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 171 P 0.00 4.40 0.00 2.16 2.03 0.00 3.72 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 1.98 1.96 0.00 172 A 8.11 4.44 1.21 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 0.00 173 A 8.27 4.18 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 * Residues marked with a * may have inaccurate shift predictions.