NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 15 G 3.8125 8.3549 108.0144 46.0397 0.0000 173.3161 16 L 4.5596 8.7895 125.1057 52.8901 43.3112 174.9837 17 F 5.1001 10.1944 120.8373 55.0151 43.2843 176.0462 18 L 3.9916 8.8612 123.1339 58.7050 41.8451 179.2214 19 E 4.1124 8.3251 116.9633 59.0959 29.5158 178.0054 20 D 4.7631 8.2947 117.1077 54.9125 41.3449 176.1616 21 L 4.8592 7.6955 119.6112 53.1277 43.4674 175.8819 22 A 4.6754 8.6522 123.9885 49.8540 22.1864 175.9152 23 V 3.8634 8.4342 121.5943 64.9499 31.7648 176.4161 24 G 3.9949 9.3027 116.1527 44.8968 0.0000 173.4305 25 D 4.3870 8.1178 120.5504 54.4673 41.9312 175.5851 26 R 4.9647 7.9747 120.6932 54.3303 33.1968 175.1236 27 F 4.9429 9.2601 121.3304 55.7526 43.0030 173.6762 28 D 5.6174 8.9419 121.5217 52.6503 43.7555 175.5885 29 S 4.8510 8.6506 116.4161 56.4813 65.7769 173.2244 30 A 4.4038 8.4578 123.0043 51.7837 19.2986 177.0211 31 R 4.8440 8.3426 117.4213 55.7161 32.3246 176.1805 32 H 4.7914 9.1879 120.9263 54.6296 33.3568 171.9115 33 R 4.7826 8.4195 126.3750 55.3611 31.2965 175.3502 34 V 4.1349 8.8193 127.4762 62.1303 33.0195 174.4170 35 E 4.9354 8.6647 126.6179 54.4431 32.1601 176.8344 36 A 3.9809 8.8483 124.4761 55.5196 18.3882 180.1703 37 A 3.9460 8.0153 118.3906 55.2243 18.5385 179.5558 38 A 4.0094 8.0013 118.8507 55.2108 18.5129 179.6853 39 I 3.7507 7.9659 118.3110 64.7437 37.1891 178.8938 40 K 4.1737 8.2858 118.9591 59.3355 31.9380 179.4074 41 A 3.9541 8.2523 121.3392 54.9581 18.2249 179.5462 42 F 3.9312 8.4131 119.0272 61.3512 39.4815 177.3844 43 A 4.2767 8.4870 120.7163 55.1398 17.9769 179.8351 44 G 3.5057 8.2838 103.5689 47.1892 0.0000 174.6501 45 E 3.9928 7.1500 119.1411 56.9299 30.2674 176.4157 46 F 4.8843 7.9314 114.7088 57.3247 41.6946 175.1469 47 D 4.8837 8.0393 119.0793 52.5203 41.3612 175.2355 48 P 4.7337 0.0000 0.0000 62.3696 29.5302 175.8830 49 Q 4.4910 7.6102 119.0464 52.8466 33.2307 174.6576 50 P 4.0605 0.0000 0.0000 65.7447 31.2187 178.7313 51 F 4.3894 6.6042 111.8917 59.1566 37.9472 175.8092 52 H 5.2342 7.9812 115.8592 54.7399 29.4420 174.6646 53 L 4.6493 7.7914 118.3627 54.6499 44.4187 176.1890 54 D 4.8674 8.1473 119.6437 52.2885 44.1565 176.8523 55 E 4.1753 8.9142 127.4131 61.6811 29.6514 178.3367 56 E 4.2292 8.1499 117.4179 60.9208 30.0116 181.0422 57 A 4.3313 10.1898 121.8938 55.0572 18.5081 179.7129 58 A 4.3237 8.1735 121.2456 55.6739 18.2286 180.5365 59 R 4.1181 7.9300 121.7993 62.0744 29.4129 182.2227 *60 H 4.9193 7.8769 116.0655 55.3678 28.7190 177.0770 61 S 4.9872 7.9907 119.3131 57.0709 65.4441 177.8004 62 L 4.2509 8.2789 116.3163 57.0390 40.4787 176.1018 63 F 4.5602 8.0460 116.1793 58.2273 40.0860 177.2403 64 G 3.9925 8.4682 106.5025 44.4653 0.0000 172.7831 65 G 3.9468 7.4057 107.1950 44.6970 0.0000 172.4008 66 L 4.2167 8.4117 121.3521 55.3314 42.7640 176.0841 67 A 4.8725 8.3350 124.7804 49.9566 22.8013 175.4396 68 A 4.2458 8.7680 123.3030 51.4736 19.4555 177.8822 69 S 3.6763 8.4652 114.7851 57.6463 63.5133 175.6701 70 G 2.2012 7.9713 112.8285 47.0161 0.0000 175.5607 71 W 4.4719 7.5309 119.5958 58.7344 29.1582 178.1001 72 H 2.6820 7.8244 118.9399 58.7763 29.2020 177.2745 73 T 3.6725 7.5047 116.8560 66.4381 68.0705 176.3962 74 A 4.2051 7.9376 122.9908 54.4035 18.4545 179.2711 75 A 4.1389 7.5171 118.3162 55.2626 18.8093 179.5943 76 I 3.7645 7.8343 118.5160 64.5975 37.0399 179.5683 77 T 4.0081 7.8134 113.9371 64.1108 68.0829 176.1143 *79 R 4.2410 7.9583 123.1863 56.4289 31.9788 177.5073 80 L 4.0038 8.0090 117.7096 57.6039 41.4786 179.6068 81 L 3.9636 8.3009 119.3706 57.9100 41.4390 179.6877 82 V 3.5812 7.7314 116.4572 65.8662 31.6007 177.2731 83 T 4.3098 8.0203 108.0559 63.1525 69.1837 174.6954 84 S 4.7584 7.7613 113.1918 59.4499 69.6490 175.6724 85 G 3.7312 8.7512 108.4910 48.4132 0.0000 173.5916 86 L 4.3831 7.9912 121.9985 51.1651 42.7856 175.3804 87 P 4.5280 0.0000 0.0000 62.1433 29.1875 176.3394 88 L 4.5403 7.3773 120.9546 54.2617 42.7928 178.9733 89 A 3.6750 8.0958 128.4965 55.2361 18.1665 178.1849 90 Q 4.2622 7.7430 110.7887 55.5935 28.9132 175.8652 91 G 3.7918 8.0583 104.9501 44.8390 0.0000 173.0812 92 I 4.3156 7.8652 118.8608 59.5442 38.8373 175.7471 93 I 4.3542 8.3985 128.4060 59.1540 40.2531 174.1516 94 G 4.3429 8.7559 116.6871 44.9812 0.0000 172.6115 95 A 4.4415 8.7655 126.1822 53.0193 20.0509 177.3492 96 G 3.9769 7.4609 102.8870 46.1928 0.0000 171.2588 97 T 4.8333 8.1126 111.8740 61.0924 70.5375 172.0347 98 E 4.5184 8.8688 127.5504 54.6902 31.1365 174.5637 99 L 5.0389 8.1637 126.8898 53.1629 44.4062 176.0505 100 S 4.0331 7.5614 114.6321 57.0668 66.6409 173.3201 101 W 5.0129 8.3809 121.2930 53.8759 28.5559 173.0430 102 P 4.4073 0.0000 0.0000 64.8876 31.5129 176.4413 103 N 5.2594 7.8425 112.8311 50.6552 42.7710 172.6236 104 P 4.7027 0.0000 0.0000 62.7384 32.9199 175.8788 105 T 4.4054 8.2969 119.0629 62.7198 70.0791 174.3588 106 R 4.8569 9.2593 125.4521 53.1753 33.1201 173.7616 107 P 4.4378 0.0000 0.0000 64.5734 31.6532 177.1738 108 G 3.9854 9.2358 111.5282 45.0062 0.0000 173.3927 109 D 4.6881 8.0368 120.7087 54.3096 42.2660 175.3387 110 E 4.9389 9.2199 122.8446 55.1048 31.0980 174.9725 111 L 5.5959 9.2982 125.6813 52.8870 44.4662 175.5844 112 H 5.1953 8.3885 115.7646 54.4473 32.4174 171.9328 113 V 4.8086 8.8748 119.6616 61.1962 34.4284 174.1524 114 E 5.1360 9.1664 126.7993 55.1173 32.0737 175.0023 115 T 5.2669 9.2712 121.8722 62.0736 72.1002 173.7180 116 T 5.1353 8.6548 120.5568 61.7270 73.0131 173.3141 117 V 4.1894 8.8890 126.8647 63.0441 31.8974 176.2976 118 L 4.2987 8.9602 128.4104 56.3570 42.9482 176.8181 119 A 4.5350 7.4445 117.0331 51.0328 22.5353 175.3895 120 I 4.5978 8.4277 120.5007 59.9939 40.3295 175.6210 121 T 4.4726 8.8031 124.8112 60.4557 70.0601 171.4638 122 P 4.4579 0.0000 0.0000 62.6666 32.1547 176.1877 123 S 4.3204 8.4552 118.4916 57.9088 63.1819 174.4664 124 K 4.1606 8.6720 127.3223 59.5231 32.1240 178.8199 125 S 4.3324 7.9491 111.3275 60.3566 63.6189 174.4944 126 R 4.5434 7.8066 119.9019 53.5069 30.5453 173.6984 127 P 4.5657 0.0000 0.0000 63.6212 31.9276 177.2780 128 D 4.4927 8.1095 119.5416 56.3267 41.6844 175.2328 129 R 5.0467 8.0313 113.7579 54.2092 33.4900 173.9966 130 A 4.9543 8.5609 119.5133 50.5172 23.4891 175.0922 131 I 4.6082 8.5339 120.4665 59.9843 39.0379 175.1418 132 V 4.6273 8.9472 128.2292 61.4633 33.7896 174.5787 133 T 4.8779 8.8233 125.4416 62.9235 69.8562 173.4794 134 C 5.1890 9.3127 125.4386 57.9317 31.1763 172.9570 135 Q 4.7194 8.9701 126.4609 55.0421 30.0977 174.2313 136 S 5.2178 9.1937 123.8701 56.8981 65.5582 172.9590 137 D 5.1692 9.0271 125.1638 52.8562 43.2775 175.4807 138 T 4.6645 8.9984 122.2109 62.6484 69.9080 174.1245 139 L 5.2859 8.7340 127.1238 52.8493 45.2943 176.2613 140 N 5.5374 8.9636 120.3817 50.6966 39.7556 175.6826 141 Q 4.2512 8.7643 115.0995 57.7601 28.5621 176.7463 142 R 4.3308 8.8292 117.6233 55.9533 30.3793 177.2057 143 G 3.9522 8.3901 106.3959 45.4432 0.0000 173.7463 144 E 4.2317 7.9016 119.5725 55.3493 30.2520 175.6082 145 V 4.2091 8.1965 123.1571 62.8060 31.8810 176.3786 146 V 4.0954 8.9267 129.0453 64.1610 32.4339 175.8033 147 Q 4.7050 7.6656 119.5158 54.7938 32.7535 172.8810 148 R 4.6515 8.6619 125.5255 54.5433 33.6315 173.8485 149 S 4.4890 9.0765 120.6510 57.0891 65.6855 172.9684 150 T 4.8838 8.7702 125.8402 62.3589 69.0354 173.9849 151 A 5.1501 8.8662 128.8787 50.1272 22.3595 175.3732 152 K 4.9756 8.7421 118.9790 54.7865 34.6558 176.0455 153 V 4.8761 8.8669 118.5755 59.3499 35.5493 174.9747 154 V 4.3412 8.2280 124.2645 62.2341 32.2508 175.4287 155 V 4.5502 8.5030 127.6522 61.2061 34.5764 174.4308 156 F 5.1316 8.9374 125.5233 55.8484 41.5561 175.5895 157 R 4.7269 8.6353 120.1611 55.3897 30.8621 176.8757 158 R 2.8422 8.7733 122.6384 54.9592 30.4200 175.0053 159 P 4.2983 0.0000 0.0000 62.5555 31.8350 176.1586 160 L 4.0883 8.3770 118.6468 55.3688 41.4659 177.1735 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 15 G 8.35 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 16 L 8.79 4.56 0.00 1.59 1.57 1.04 0.68 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 17 F 10.19 5.10 0.00 3.02 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 18 L 8.86 3.99 0.00 1.86 1.77 0.92 0.95 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 19 E 8.33 4.11 0.00 2.17 2.03 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 2.41 2.42 0.00 20 D 8.29 4.76 0.00 2.83 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 21 L 7.70 4.86 0.00 1.70 1.66 0.94 0.79 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 22 A 8.65 4.68 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 23 V 8.43 3.86 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 0.86 0.00 0.00 0.94 0.00 0.00 24 G 9.30 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 0.00 0.00 0.00 25 D 8.12 4.39 0.00 2.79 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 0.00 0.00 0.00 0.00 26 R 7.97 4.96 0.00 1.45 1.67 0.00 3.06 0.00 0.00 3.17 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.67 0.00 27 F 9.26 4.94 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 28 D 8.94 5.62 0.00 2.53 2.57 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.65 4.85 0.00 4.02 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 30 A 8.46 4.40 1.27 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 0.00 0.00 31 R 8.34 4.84 0.00 1.71 2.00 0.00 3.15 0.00 0.00 3.27 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.61 0.00 32 H 9.19 4.79 0.00 3.19 3.09 0.00 5.77 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 R 8.42 4.78 0.00 1.81 1.73 0.00 3.37 0.00 0.00 3.23 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.59 0.00 34 V 8.82 4.13 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 0.72 0.00 0.00 0.99 0.00 0.00 35 E 8.66 4.94 0.00 1.93 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 0.00 2.29 2.23 0.00 36 A 8.85 3.98 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 37 A 8.02 3.95 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 38 A 8.00 4.01 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 39 I 7.97 3.75 2.10 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 1.57 0.80 0.95 0.00 0.00 40 K 8.29 4.17 0.00 1.96 1.87 0.00 1.68 0.00 0.00 1.66 0.00 0.00 3.05 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.61 1.59 7.81 41 A 8.25 3.95 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 42 F 8.41 3.93 0.00 2.94 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 43 A 8.49 4.28 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 44 G 8.28 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 7.15 3.99 0.00 1.61 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 1.47 1.54 0.00 46 F 7.93 4.88 0.00 2.50 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 47 D 8.04 4.88 0.00 2.87 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 48 P 0.00 4.73 0.00 2.06 1.97 0.00 3.70 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 2.00 2.06 0.00 49 Q 7.61 4.49 0.00 2.08 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.65 6.77 0.00 0.00 0.00 0.00 0.00 2.34 2.57 0.00 50 P 0.00 4.06 0.00 1.68 1.95 0.00 3.01 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.93 0.00 51 F 6.60 4.39 0.00 2.92 3.49 0.00 0.00 0.00 0.00 0.00 0.00 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 H 7.98 5.23 0.00 3.30 3.37 0.00 5.57 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 L 7.79 4.65 0.00 1.55 1.64 0.88 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 54 D 8.15 4.87 0.00 2.69 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 55 E 8.91 4.18 0.00 2.02 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 2.31 1.94 0.00 56 E 8.15 4.23 0.00 2.06 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 2.23 1.94 0.00 57 A 10.19 4.33 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 58 A 8.17 4.32 1.55 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 0.00 0.00 59 R 7.93 4.12 0.00 1.80 1.97 0.00 3.26 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 1.57 1.53 0.00 *60 H 7.88 4.92 0.00 2.96 2.96 0.00 7.12 0.00 0.00 0.00 0.00 5.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 S 7.99 4.99 0.00 3.62 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 62 L 8.28 4.25 0.00 1.66 1.60 0.92 0.70 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 63 F 8.05 4.56 0.00 3.06 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 64 G 8.47 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 0.00 0.00 0.00 65 G 7.41 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 66 L 8.41 4.22 0.00 1.68 1.59 0.93 0.96 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 67 A 8.33 4.87 0.71 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 68 A 8.77 4.25 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 0.00 0.00 0.00 0.00 0.00 0.00 69 S 8.47 3.68 0.00 3.81 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 70 G 7.97 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 0.00 0.00 0.00 71 W 7.53 4.47 0.00 3.62 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 72 H 7.82 2.68 0.00 2.21 3.08 0.00 5.78 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 T 7.50 3.67 4.36 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 1.24 0.00 0.00 74 A 7.94 4.21 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 75 A 7.52 4.14 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 76 I 7.83 3.76 1.86 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.57 0.70 0.00 0.00 77 T 7.81 4.01 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 1.19 0.00 0.00 *79 R 7.96 4.24 0.00 1.87 2.09 0.00 3.18 0.00 0.00 3.36 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.67 0.00 80 L 8.01 4.00 0.00 1.90 1.71 0.93 0.54 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 81 L 8.30 3.96 0.00 1.64 1.68 0.90 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 82 V 7.73 3.58 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 0.87 0.00 0.00 0.92 0.00 0.00 83 T 8.02 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 1.25 0.00 0.00 84 S 7.76 4.76 0.00 3.97 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 85 G 8.75 3.73 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 0.00 0.00 0.00 86 L 7.99 4.38 0.00 1.52 1.39 0.84 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 87 P 0.00 4.53 0.00 2.04 2.13 0.00 2.74 0.00 0.00 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.92 0.00 88 L 7.38 4.54 0.00 1.54 1.61 0.72 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 89 A 8.10 3.68 0.48 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 0.00 0.00 0.00 90 Q 7.74 4.26 0.00 2.08 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.39 0.00 0.00 0.00 0.00 0.00 2.37 2.34 0.00 91 G 8.06 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 0.00 0.00 0.00 92 I 7.87 4.32 1.85 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 1.17 0.64 0.89 0.00 0.00 93 I 8.40 4.35 1.91 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 1.32 1.53 1.00 0.00 0.00 94 G 8.76 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 0.00 0.00 0.00 0.00 95 A 8.77 4.44 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 96 G 7.46 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 97 T 8.11 4.83 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 98 E 8.87 4.52 0.00 2.03 1.73 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 2.11 2.20 0.00 99 L 8.16 5.04 0.00 1.14 0.50 0.86 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 100 S 7.56 4.03 0.00 3.72 3.69 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 0.00 101 W 8.38 5.01 0.00 3.28 2.97 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 0.00 102 P 0.00 4.41 0.00 2.22 2.12 0.00 3.60 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.07 0.00 103 N 7.84 5.26 0.00 2.76 2.68 0.00 0.00 7.07 7.91 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 0.00 104 P 0.00 4.70 0.00 2.01 2.10 0.00 3.73 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.32 0.00 105 T 8.30 4.41 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 1.15 0.00 0.00 106 R 9.26 4.86 0.00 1.80 1.79 0.00 3.16 0.00 0.00 3.19 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.56 0.00 107 P 0.00 4.44 0.00 2.04 2.01 0.00 3.67 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.10 0.00 108 G 9.24 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 0.00 0.00 0.00 109 D 8.04 4.69 0.00 2.73 2.59 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 0.00 0.00 0.00 0.00 110 E 9.22 4.94 0.00 1.91 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 2.24 2.41 0.00 111 L 9.30 5.60 0.00 1.56 1.55 0.89 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 112 H 8.39 5.20 0.00 3.32 3.35 0.00 5.41 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 V 8.87 4.81 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 0.97 0.00 0.00 0.92 0.00 0.00 114 E 9.17 5.14 0.00 1.91 1.84 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 2.42 2.29 0.00 115 T 9.27 5.27 4.42 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 1.35 0.00 0.00 116 T 8.65 5.14 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 1.19 0.00 0.00 117 V 8.89 4.19 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 0.97 0.00 0.00 1.14 0.00 0.00 118 L 8.96 4.30 0.00 1.67 1.69 0.96 0.74 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 0.00 119 A 7.44 4.53 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 0.00 120 I 8.43 4.60 1.87 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 0.73 0.91 0.00 0.00 121 T 8.80 4.47 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 1.19 0.00 0.00 122 P 0.00 4.46 0.00 1.91 1.98 0.00 3.66 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 2.02 2.08 0.00 123 S 8.46 4.32 0.00 3.78 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 0.00 124 K 8.67 4.16 0.00 1.78 1.84 0.00 1.79 0.00 0.00 1.75 0.00 0.00 3.02 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.44 1.41 7.81 125 S 7.95 4.33 0.00 3.98 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 0.00 126 R 7.81 4.54 0.00 1.85 1.85 0.00 3.18 0.00 0.00 3.20 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.59 0.00 127 P 0.00 4.57 0.00 2.04 2.09 0.00 3.69 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 2.03 2.07 0.00 128 D 8.11 4.49 0.00 2.84 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 0.00 129 R 8.03 5.05 0.00 0.90 0.66 0.00 2.80 0.00 0.00 3.08 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 1.27 0.00 130 A 8.56 4.95 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 0.00 131 I 8.53 4.61 1.84 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 1.06 0.88 0.89 0.00 0.00 132 V 8.95 4.63 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 1.03 0.00 0.00 0.92 0.00 0.00 133 T 8.82 4.88 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 1.20 0.00 0.00 134 C 9.31 5.19 0.00 2.78 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 0.00 135 Q 8.97 4.72 0.00 2.11 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.56 6.78 0.00 0.00 0.00 0.00 0.00 2.37 2.28 0.00 136 S 9.19 5.22 0.00 3.71 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 0.00 137 D 9.03 5.17 0.00 2.70 2.52 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 0.00 138 T 9.00 4.66 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 1.18 0.00 0.00 139 L 8.73 5.29 0.00 1.33 1.46 0.87 0.57 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 0.00 140 N 8.96 5.54 0.00 2.85 2.96 0.00 0.00 6.63 7.11 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 0.00 141 Q 8.76 4.25 0.00 2.19 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 7.06 0.00 0.00 0.00 0.00 0.00 2.33 2.33 0.00 142 R 8.83 4.33 0.00 1.93 1.99 0.00 3.21 0.00 0.00 3.23 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.56 0.00 143 G 8.39 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 0.00 144 E 7.90 4.23 0.00 2.05 1.87 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 2.38 2.43 0.00 145 V 8.20 4.21 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 0.94 0.00 0.00 0.90 0.00 0.00 146 V 8.93 4.10 2.18 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 0.93 0.00 0.00 0.96 0.00 0.00 147 Q 7.67 4.70 0.00 2.26 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.64 0.00 0.00 0.00 0.00 0.00 2.14 1.99 0.00 148 R 8.66 4.65 0.00 1.76 1.55 0.00 3.01 0.00 0.00 3.03 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.56 0.00 149 S 9.08 4.49 0.00 3.71 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 0.00 150 T 8.77 4.88 4.19 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 0.00 0.00 0.00 1.18 0.00 0.00 151 A 8.87 5.15 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 0.00 152 K 8.74 4.98 0.00 1.69 1.70 0.00 1.60 0.00 0.00 1.63 0.00 0.00 2.81 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.34 1.37 7.81 153 V 8.87 4.88 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 0.71 0.00 0.00 0.97 0.00 0.00 154 V 8.23 4.34 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 0.46 0.00 0.00 0.93 0.00 0.00 155 V 8.50 4.55 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 1.06 0.00 0.00 0.91 0.00 0.00 156 F 8.94 5.13 0.00 3.37 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 0.00 157 R 8.64 4.73 0.00 1.75 2.03 0.00 3.14 0.00 0.00 3.02 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.67 0.00 158 R 8.77 2.84 0.00 1.17 1.53 0.00 3.09 0.00 0.00 3.09 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.50 0.00 159 P 0.00 4.30 0.00 2.13 1.98 0.00 3.06 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.93 0.00 160 L 8.38 4.09 0.00 1.61 1.61 0.90 0.82 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 * Residues marked with a * may have inaccurate shift predictions.