NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 E 4.3867 8.3033 120.2341 56.4718 31.7312 177.9434 5 K 3.9017 7.9880 117.3507 58.2644 32.3254 177.5066 6 L 4.0964 8.6249 121.6357 58.0653 42.6336 178.5891 7 K 3.9022 8.0576 117.7398 59.5423 31.8712 179.0433 8 A 4.0600 8.2914 119.5839 54.4309 18.3396 178.6180 9 A 4.2080 7.5646 117.3564 52.0307 19.3378 177.5341 10 L 4.0836 7.2354 118.6141 53.0109 42.3621 175.2847 11 P 4.1664 0.0000 0.0000 62.4415 31.8620 175.9535 12 E 3.9868 8.2158 118.9061 59.0790 29.6841 177.0036 13 Y 4.4908 7.2262 114.8767 57.0329 38.2508 175.3346 14 A 4.7914 7.7744 122.3988 51.5028 19.9087 179.7847 15 K 4.0245 8.3541 122.1516 61.1333 32.1234 178.6191 16 D 4.3432 8.0553 118.8773 57.1409 40.7022 178.5814 17 I 3.6460 7.6645 119.8877 64.2716 37.2193 178.0236 18 K 3.8349 8.0298 120.2775 59.4208 31.9327 178.3306 19 L 3.9113 8.0967 120.6001 58.4603 42.0638 178.7002 20 N 4.3179 8.6441 116.6034 56.2128 38.4164 177.0829 21 L 3.9200 8.2421 122.0702 58.1343 42.2504 179.2776 22 S 4.0888 7.9077 114.8397 61.7256 62.6446 176.8539 23 S 4.1441 7.5984 115.1082 61.5040 62.8072 175.9904 24 I 3.7969 7.8810 122.1881 63.9633 37.4732 177.8990 25 T 3.6848 7.7002 116.0200 65.6188 68.6918 175.6947 26 R 4.6353 7.5967 119.1050 54.9128 31.3882 176.6106 27 S 4.3856 7.2526 113.3948 58.1100 63.2469 173.5529 28 S 4.7097 8.4402 119.2482 58.1009 63.7600 175.1219 29 V 3.7754 7.7854 121.4881 65.1158 31.5467 176.0408 30 L 4.7075 7.5212 118.0363 52.7115 43.6049 176.6281 31 D 4.7346 8.3146 122.4435 52.8310 42.0011 176.8666 32 Q 4.1912 8.6756 118.8501 59.5604 28.9352 177.7483 33 E 4.2805 8.4459 119.8218 59.1402 29.8656 178.5208 34 Q 4.3038 9.0762 118.7051 58.9296 28.7722 178.2363 35 L 3.8225 8.3721 121.6499 58.2534 42.1389 179.1980 36 W 3.9168 8.4784 118.7868 59.1669 28.8985 179.0092 37 G 2.4434 8.1662 106.1244 47.3971 0.0000 176.0377 38 T 3.8664 7.8207 118.0091 66.4690 68.4649 176.7655 39 L 3.8486 7.7526 120.9354 57.6362 41.4879 179.5145 40 L 3.8701 8.0211 120.1328 57.9261 42.0078 178.7897 41 A 3.8556 7.9090 121.0314 55.1874 18.4282 179.7325 42 S 3.9742 8.3854 113.7883 61.6867 62.7154 176.6254 43 A 3.9542 7.9173 121.9606 55.3146 18.3885 179.2480 44 A 4.0431 8.2057 118.9704 55.2523 18.2730 179.7149 45 A 4.0250 7.9533 118.2605 54.8812 18.4765 179.2938 46 T 3.9768 7.5550 106.6984 62.3337 69.2021 175.9156 47 R 3.7512 7.7187 118.7980 56.4734 28.8880 175.4677 48 N 4.6248 7.9612 118.6445 51.7797 38.8669 173.6837 49 P 4.2647 0.0000 0.0000 66.1063 31.2952 178.1248 50 Q 3.9359 8.0124 118.8471 58.8978 29.0649 178.2141 51 V 3.6115 7.7071 118.9114 65.7427 31.5433 177.6819 52 L 3.9472 8.0360 120.0747 57.8946 41.8854 178.7347 53 A 3.9818 8.3259 121.1307 55.3678 18.4887 179.4276 54 D 4.2973 8.0661 117.3603 57.6774 40.8425 179.1754 55 I 4.0835 8.0152 120.5212 64.2167 36.8645 178.7768 56 G 3.5675 8.3395 106.1868 47.4505 0.0000 175.4386 57 A 4.1154 8.2151 123.2511 55.1666 18.3699 179.4852 58 E 3.8344 8.1339 117.0445 59.0486 29.6711 178.7303 59 A 3.8190 8.3009 121.4823 55.0223 18.1437 179.5985 60 T 3.8561 7.3003 106.2994 64.3702 68.6886 175.3465 61 D 4.6794 7.1570 119.9330 54.2397 41.1387 176.5768 62 H 4.7835 7.9331 115.2120 54.8124 31.3076 173.5866 63 L 4.8722 7.5207 117.9901 51.7633 45.4651 176.9350 64 S 4.3772 8.4781 116.7787 57.9589 65.2095 175.2178 65 A 3.8541 8.5142 123.9151 55.1797 18.0193 179.9251 66 A 3.9508 7.9626 118.5592 55.2794 18.5024 179.5530 67 A 4.1894 8.1344 119.2902 55.3175 18.5061 179.6172 68 R 3.7214 8.0440 117.2463 60.1603 30.0322 178.4965 69 H 4.3641 8.2048 115.5793 58.7653 28.6758 177.7442 70 A 4.2672 8.4352 122.6244 55.1064 18.3787 179.5317 71 A 3.8348 8.3587 119.7139 55.3499 18.3664 179.9545 72 L 4.0949 8.0717 117.6793 57.7592 41.6011 179.9585 73 G 3.7695 8.6718 105.7965 47.3654 0.0000 175.7799 74 A 4.0066 8.1461 122.3287 55.0089 18.4269 179.1272 75 A 4.0584 7.6449 117.4067 55.2399 18.5237 179.4724 76 A 4.1627 7.8296 118.2140 54.9805 18.8803 180.9249 77 I 4.1569 7.9705 111.6125 61.0358 37.9089 177.0029 *79 G 3.7737 7.8422 106.3114 46.7991 0.0000 173.7683 *81 N 4.9900 8.0158 118.6617 53.2368 40.4277 176.5950 82 N 4.3994 8.1552 114.9170 55.9624 38.4817 177.4954 83 V 3.5420 7.6996 119.3259 65.6227 31.8820 177.4748 84 F 3.8573 8.0688 119.7910 61.6995 39.2694 176.5694 85 Y 3.7998 8.1240 116.3395 60.8034 37.6026 178.4866 86 R 3.6508 7.5690 119.5337 59.1434 30.0464 178.8571 87 G 3.3346 7.6715 105.4922 47.6594 0.0000 175.5210 88 R 3.7666 7.5952 121.5060 59.1086 30.0551 178.8802 89 G 3.5584 7.9428 105.4285 47.7363 0.0000 175.7601 90 F 4.7358 7.8839 119.2694 59.9753 38.9862 176.4162 91 L 4.5399 7.7271 117.6483 53.8079 41.7482 176.5641 92 E 3.8934 9.0316 116.3703 57.5066 27.9250 175.8597 93 G 4.2362 8.0326 103.5648 46.5103 0.0000 176.2446 94 R 4.1846 8.4102 117.9587 57.7956 30.3810 176.7754 95 Y 4.5910 7.8651 114.6019 57.6372 39.2358 176.7795 96 D 4.6488 8.2160 121.5172 56.2377 40.9484 177.4854 97 D 4.7214 7.8768 117.2638 54.0427 40.3216 177.6922 98 L 3.9038 7.5896 119.3731 55.9822 41.6996 174.9689 99 R 3.9316 8.2939 119.3933 55.6445 27.6670 173.3712 100 P 4.0984 0.0000 0.0000 65.6630 31.3264 178.7946 101 G 3.8200 8.0441 102.9192 46.4362 0.0000 172.6814 102 L 4.5513 7.5486 118.6567 52.0994 43.6935 176.4995 103 R 4.1565 8.4115 124.2092 56.5250 31.0471 176.9776 104 M 4.8196 8.0751 122.9068 52.7714 31.1916 176.0152 105 N 4.3227 8.2392 118.7557 57.4647 39.2438 174.8935 106 I 3.5097 7.7738 119.1698 64.0411 37.9695 177.3423 107 I 3.4468 7.2730 119.6628 64.2196 37.0366 177.9400 108 A 4.1935 7.7926 119.9112 53.5268 19.7034 177.0361 109 N 4.8388 7.8858 115.1033 51.0341 38.6141 172.0835 110 P 4.0260 0.0000 0.0000 63.5808 32.1253 178.7196 111 G 4.0043 9.3079 106.8604 45.0336 0.0000 172.3459 112 I 4.7172 7.0189 110.8082 58.0280 41.1244 172.7716 113 P 4.1936 0.0000 0.0000 63.1798 31.6608 177.8466 114 K 3.9406 8.8281 121.8397 59.5597 31.8540 179.1838 115 A 3.8990 7.9706 120.4766 55.2373 18.1563 179.2694 116 N 3.7318 7.8217 114.8724 55.9098 38.5455 177.4602 117 F 3.7362 7.6090 121.4995 61.1340 39.4066 176.9005 118 E 4.2138 8.4115 120.0188 58.5608 29.2216 178.9929 119 L 3.8566 7.2607 120.4845 58.0500 42.2080 179.1586 120 W 4.4178 7.7772 119.1110 59.8560 28.9404 178.7682 121 S 4.0585 8.2133 114.5480 61.1216 62.4075 176.4052 122 F 4.1421 8.4962 124.5154 61.0911 39.0306 177.0065 123 A 3.9377 8.4395 120.5539 55.1909 18.1139 179.8363 124 V 3.5341 7.9467 116.7789 66.1678 31.6004 178.4781 125 S 4.0604 8.2113 114.7592 61.3168 62.3370 176.5752 126 A 3.8175 7.3227 122.8541 55.0636 18.1463 179.4588 127 I 3.7679 7.2163 117.1873 64.5848 37.2884 178.1572 128 N 4.5237 8.2795 116.1014 53.6151 39.0548 174.9651 129 G 3.5345 8.1347 107.5327 47.2504 0.0000 174.6668 130 C 4.5390 7.6289 119.5005 57.1008 33.2645 172.6425 131 S 4.0648 8.4552 124.6451 61.7183 62.7329 175.4227 132 H 3.9474 8.2479 121.6132 59.3792 29.5119 176.7867 133 C 4.1096 8.0554 117.7232 62.4635 28.0910 175.6020 134 L 3.9257 8.2427 122.6442 58.0470 41.6122 179.4880 135 V 3.5828 8.2192 119.2477 64.6969 31.3070 177.9276 136 A 3.7937 7.7766 121.8020 55.2912 18.1363 179.4725 137 H 4.3539 8.2275 114.4276 58.7476 28.7109 177.7457 138 E 3.8317 8.5027 121.3649 59.5729 29.5245 178.5677 139 H 4.1904 8.5954 116.5866 59.3125 28.8752 177.8991 140 T 3.8933 8.1452 117.5355 66.5129 68.2768 176.5657 141 L 3.9298 8.2552 121.2344 58.0932 41.5696 179.9675 142 R 4.1056 7.9416 117.7356 59.4415 29.7316 179.1316 143 T 4.0433 7.7932 114.4708 65.3578 68.4300 176.1845 144 V 4.2967 7.3474 112.3826 60.7169 32.1058 176.7152 145 G 3.9038 7.8142 107.4529 45.0396 0.0000 174.3520 146 V 3.7184 7.3573 120.3033 62.3284 32.2289 176.1064 147 D 4.7306 8.3617 127.1288 52.4117 42.1667 177.6620 148 R 3.9623 8.3364 116.6900 59.2353 29.3844 178.6939 149 E 3.9954 8.1753 118.9695 59.3487 29.5647 178.9571 150 A 4.0449 8.2143 120.6244 55.0938 18.4859 179.7589 151 I 3.4029 7.7069 118.4200 64.3823 37.1437 178.4203 152 F 4.2871 8.8542 121.8541 61.3657 39.1408 176.7715 153 E 3.9845 8.4304 118.7550 59.1425 29.3180 178.7158 154 A 4.0253 7.9517 120.9097 54.8272 18.4386 179.3436 155 L 3.9345 8.0932 118.8748 58.2077 42.1589 179.2475 156 K 3.6764 8.2206 118.5054 59.4062 31.9245 179.0018 157 A 3.8734 8.1955 120.9241 55.2041 18.2790 179.4661 158 A 4.2004 8.5896 120.6660 54.6870 18.4041 179.7875 159 A 3.8673 7.9200 119.2036 55.2595 18.3846 179.8511 160 I 3.5850 8.0056 118.7693 64.6693 37.1963 178.8801 161 V 3.5305 7.9776 119.1106 65.9389 31.2374 178.3009 162 S 4.1879 8.0492 115.2558 61.4341 62.6848 176.7541 163 G 3.6206 8.1749 108.4657 47.7881 0.0000 175.7296 164 V 3.5796 8.0719 120.8085 65.8013 31.4959 178.0261 165 A 4.0185 8.1613 120.4638 54.9701 18.1662 179.4897 166 Q 3.8471 8.2975 117.9104 59.2473 29.0969 178.0873 167 A 4.0494 8.3769 122.2011 55.2614 18.4755 179.3726 168 L 3.8748 8.3502 118.9430 58.1643 42.2187 178.9051 169 A 4.0165 8.2123 121.0736 55.3004 18.3237 179.7284 170 T 3.8596 8.0201 108.4831 65.0537 68.8361 176.8098 171 I 3.7961 7.6169 116.5405 63.6439 37.3386 178.0358 172 E 4.1011 8.0871 119.0002 58.6656 29.3075 178.6516 173 A 4.2604 7.6929 119.7667 53.9382 18.6674 178.5140 174 L 4.4043 7.6462 115.2852 54.1933 42.0357 176.9383 175 S 4.1899 7.4795 120.1081 59.1301 63.3632 170.8639 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 4 E 8.30 4.39 0.00 2.04 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 2.31 0.00 5 K 7.99 3.90 0.00 1.81 1.87 0.00 1.75 0.00 0.00 1.67 0.00 0.00 2.94 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.45 1.56 7.81 6 L 8.62 4.10 0.00 1.91 1.67 0.92 0.49 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 7 K 8.06 3.90 0.00 1.99 1.84 0.00 1.75 0.00 0.00 1.91 0.00 0.00 2.95 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.53 1.52 7.81 8 A 8.29 4.06 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 9 A 7.56 4.21 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 10 L 7.24 4.08 0.00 1.71 1.53 0.89 0.80 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 11 P 0.00 4.17 0.00 0.49 1.50 0.00 3.61 0.00 0.00 3.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.57 0.00 12 E 8.22 3.99 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 2.34 2.23 0.00 13 Y 7.23 4.49 0.00 3.04 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 14 A 7.77 4.79 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 15 K 8.35 4.02 0.00 1.78 1.87 0.00 1.66 0.00 0.00 1.79 0.00 0.00 2.94 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.78 1.55 7.81 16 D 8.06 4.34 0.00 2.69 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 17 I 7.66 3.65 2.03 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 1.54 1.01 0.95 0.00 0.00 18 K 8.03 3.83 0.00 1.80 1.92 0.00 1.62 0.00 0.00 1.75 0.00 0.00 2.86 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.42 1.44 7.81 19 L 8.10 3.91 0.00 1.87 1.93 0.92 0.97 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 20 N 8.64 4.32 0.00 2.89 2.82 0.00 0.00 6.73 7.01 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 21 L 8.24 3.92 0.00 1.81 1.85 0.86 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 22 S 7.91 4.09 0.00 4.01 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 23 S 7.60 4.14 0.00 3.99 3.99 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 I 7.88 3.80 1.79 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 1.40 1.05 0.85 0.00 0.00 25 T 7.70 3.68 4.46 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 1.34 0.00 0.00 26 R 7.60 4.64 0.00 1.80 1.94 0.00 3.47 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.70 0.00 27 S 7.25 4.39 0.00 3.86 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 28 S 8.44 4.71 0.00 4.00 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 29 V 7.79 3.78 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 0.81 0.00 0.00 0.96 0.00 0.00 30 L 7.52 4.71 0.00 1.66 1.59 0.93 1.08 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 31 D 8.31 4.73 0.00 3.01 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 32 Q 8.68 4.19 0.00 2.31 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.67 6.97 0.00 0.00 0.00 0.00 0.00 2.56 2.70 0.00 33 E 8.45 4.28 0.00 2.24 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 2.91 2.78 0.00 34 Q 9.08 4.30 0.00 2.19 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.58 0.00 0.00 0.00 0.00 0.00 2.37 2.74 0.00 35 L 8.37 3.82 0.00 2.02 1.53 0.70 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 36 W 8.48 3.92 0.00 3.63 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 G 8.17 2.44 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 0.00 38 T 7.82 3.87 4.38 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 1.24 0.00 0.00 39 L 7.75 3.85 0.00 1.49 1.46 -0.27 0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 40 L 8.02 3.87 0.00 1.78 1.62 0.90 0.99 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 41 A 7.91 3.86 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 42 S 8.39 3.97 0.00 3.95 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 43 A 7.92 3.95 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 44 A 8.21 4.04 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 45 A 7.95 4.02 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 46 T 7.56 3.98 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 1.22 0.00 0.00 47 R 7.72 3.75 0.00 1.98 2.10 0.00 3.20 0.00 0.00 3.24 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.59 0.00 48 N 7.96 4.62 0.00 2.81 2.70 0.00 0.00 6.91 7.87 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 49 P 0.00 4.26 0.00 2.30 2.29 0.00 3.75 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 2.07 2.02 0.00 50 Q 8.01 3.94 0.00 2.18 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.94 0.00 0.00 0.00 0.00 0.00 2.65 2.48 0.00 51 V 7.71 3.61 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 0.97 0.00 0.00 0.93 0.00 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0.00 0.00 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 61 D 7.16 4.68 0.00 2.22 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 62 H 7.93 4.78 0.00 2.71 2.96 0.00 5.60 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 63 L 7.52 4.87 0.00 1.55 1.53 0.88 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 64 S 8.48 4.38 0.00 4.06 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 65 A 8.51 3.85 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 66 A 7.96 3.95 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 67 A 8.13 4.19 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 68 R 8.04 3.72 0.00 1.83 2.02 0.00 3.06 0.00 0.00 3.11 7.55 0.00 0.00 0.00 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0.00 77 I 7.97 4.16 2.00 0.00 0.00 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 1.70 0.95 0.99 0.00 0.00 *79 G 7.84 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 0.00 0.00 0.00 *81 N 8.02 4.99 0.00 3.13 3.30 0.00 0.00 7.05 6.92 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 82 N 8.16 4.40 0.00 2.76 2.89 0.00 0.00 6.76 7.68 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 83 V 7.70 3.54 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 1.04 0.00 0.00 1.00 0.00 0.00 84 F 8.07 3.86 0.00 2.99 2.70 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 85 Y 8.12 3.80 0.00 3.07 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 86 R 7.57 3.65 0.00 1.80 1.76 0.00 3.07 0.00 0.00 3.21 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.88 0.00 87 G 7.67 3.33 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 G 8.13 3.53 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 0.00 130 C 7.63 4.54 0.00 3.09 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 0.00 131 S 8.46 4.06 0.00 4.09 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 0.00 132 H 8.25 3.95 0.00 3.19 3.33 0.00 5.67 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 0.00 133 C 8.06 4.11 0.00 3.06 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 0.00 134 L 8.24 3.93 0.00 1.74 1.72 0.12 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 135 V 8.22 3.58 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 0.89 0.00 0.00 0.68 0.00 0.00 136 A 7.78 3.79 1.12 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 0.00 0.00 137 H 8.23 4.35 0.00 3.46 3.48 0.00 5.63 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 E 8.50 3.83 0.00 2.51 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 2.21 2.68 0.00 139 H 8.60 4.19 0.00 3.34 3.31 0.00 5.70 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 0.00 140 T 8.15 3.89 4.52 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 1.23 0.00 0.00 141 L 8.26 3.93 0.00 1.90 1.60 0.85 0.59 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 0.00 142 R 7.94 4.11 0.00 1.99 1.94 0.00 3.09 0.00 0.00 3.21 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.77 0.00 143 T 7.79 4.04 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 1.20 0.00 0.00 144 V 7.35 4.30 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 0.75 0.00 0.00 0.97 0.00 0.00 145 G 7.81 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 0.00 146 V 7.36 3.72 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 0.73 0.00 0.00 0.85 0.00 0.00 147 D 8.36 4.73 0.00 2.96 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 0.00 148 R 8.34 3.96 0.00 2.03 2.20 0.00 2.87 0.00 0.00 3.27 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.65 0.00 149 E 8.18 4.00 0.00 2.13 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 0.00 2.38 2.32 0.00 150 A 8.21 4.04 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.71 3.40 1.89 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.87 0.26 0.00 0.00 152 F 8.85 4.29 0.00 3.15 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 0.00 153 E 8.43 3.98 0.00 2.34 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 0.00 2.30 2.35 0.00 154 A 7.95 4.03 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 0.00 155 L 8.09 3.93 0.00 2.09 1.82 0.81 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 156 K 8.22 3.68 0.00 1.78 1.70 0.00 1.43 0.00 0.00 1.38 0.00 0.00 2.87 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.17 0.78 7.81 157 A 8.20 3.87 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 0.00 158 A 8.59 4.20 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 0.00 159 A 7.92 3.87 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 0.00 160 I 8.01 3.59 1.91 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 1.52 0.87 0.86 0.00 0.00 161 V 7.98 3.53 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 0.99 0.00 0.00 0.87 0.00 0.00 162 S 8.05 4.19 0.00 4.07 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 0.00 163 G 8.17 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 0.00 164 V 8.07 3.58 2.23 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 1.04 0.00 0.00 0.97 0.00 0.00 165 A 8.16 4.02 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 0.00 166 Q 8.30 3.85 0.00 2.19 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.73 0.00 0.00 0.00 0.00 0.00 2.37 2.45 0.00 167 A 8.38 4.05 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 0.00 168 L 8.35 3.87 0.00 1.97 1.67 0.91 1.16 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 0.00 169 A 8.21 4.02 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 0.00 0.00 170 T 8.02 3.86 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 1.39 0.00 0.00 171 I 7.62 3.80 1.87 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 1.75 0.85 0.92 0.00 0.00 172 E 8.09 4.10 0.00 2.00 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 2.35 2.63 0.00 173 A 7.69 4.26 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.65 4.40 0.00 1.69 1.73 0.95 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 175 S 7.48 4.19 0.00 4.09 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 * Residues marked with a * may have inaccurate shift predictions.