NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 24 L 4.6583 8.1693 122.5184 55.0721 44.4395 176.3957 *26 R 4.3449 7.4878 116.2128 55.8887 33.2087 175.6037 27 H 4.3996 8.6548 119.5688 56.2646 30.1438 175.0260 28 W 5.5626 8.2449 124.0749 55.6437 33.7502 174.1680 29 H 4.8244 9.2425 117.2981 54.4582 32.8145 172.9504 30 T 4.5671 8.5678 119.3199 63.4897 68.7116 174.3196 31 V 4.2671 9.1115 126.7100 63.8712 34.1460 175.7598 32 V 4.9988 7.4990 118.5922 61.1246 35.1799 173.9112 33 L 5.4088 9.1289 126.4864 53.0083 45.4871 175.3910 34 A 4.7028 8.5711 123.3431 50.4604 22.5486 174.9915 35 S 4.9421 8.2069 114.9936 56.7135 65.3402 174.5006 36 S 3.9784 8.5314 120.0104 60.2153 63.8096 173.4836 37 D 4.7249 8.0857 120.1088 51.8200 41.9751 175.5732 38 R 3.9003 8.7688 128.3026 59.3848 30.2143 178.7240 39 S 4.7594 8.0375 111.1344 60.4844 63.1920 176.4410 40 L 3.9150 8.2296 121.6536 56.7922 41.4000 178.3040 41 I 4.3277 7.5248 109.1830 60.3528 38.1117 175.3211 42 E 4.2867 7.6726 122.1783 55.1694 30.3197 175.5279 43 E 3.9807 8.5971 118.3402 58.5576 29.4916 177.5471 44 E 3.9117 9.1575 121.1859 56.7835 27.4648 174.9110 45 G 3.7516 8.3830 109.1934 44.3947 0.0000 173.4932 46 P 3.9869 0.0000 0.0000 64.8065 31.0748 177.2172 47 F 4.2372 8.1587 115.6487 57.0512 39.4501 176.7905 48 R 4.0305 7.2882 123.8241 54.7916 28.1192 174.7988 49 N 4.5641 7.0997 116.4292 50.8046 42.2603 174.9321 50 F 4.7503 8.3672 121.2615 55.4071 41.0601 175.0703 51 I 3.1886 8.3302 125.1869 61.3381 38.1161 175.0979 52 Q 4.2199 8.4784 125.5231 56.9903 31.7707 175.0229 53 N 5.3652 7.4624 115.2238 52.1879 42.9519 173.1135 54 I 4.9611 8.6267 124.6329 59.9683 40.5138 174.8111 55 T 4.6877 9.0474 124.7405 61.5294 71.1706 173.9020 56 V 4.3313 8.4647 126.6418 60.7650 32.6072 175.4666 57 E 4.3932 9.1397 128.1648 54.7578 30.4355 175.8757 58 S 3.7763 9.6787 125.0550 59.6974 60.3584 174.0450 59 G 4.0533 8.4614 106.9458 45.5007 0.0000 173.4663 60 N 5.0629 8.0116 117.3383 52.0377 41.3116 174.3332 61 L 4.7324 8.5396 121.8928 53.3193 43.7073 175.9405 62 N 4.7824 9.4986 124.5322 52.2615 39.4446 174.5552 63 G 4.1501 9.2738 112.6122 44.2961 0.0000 171.1245 64 F 5.1224 8.7258 126.7722 56.2952 41.7463 174.1527 65 F 4.8692 9.3012 124.2713 55.4282 43.1999 173.9225 66 L 5.1828 8.4506 118.6178 53.6829 45.3109 175.9673 67 T 4.8332 8.7502 114.7203 60.9970 71.4389 172.1084 68 R 5.4744 8.6474 129.4078 54.9093 30.4998 176.4899 69 K 4.3942 8.1472 126.9706 53.5876 34.3470 172.3405 70 N 4.3336 9.9427 124.1301 53.5870 36.4190 175.7211 71 G 3.9370 10.1745 105.4557 45.7784 0.0000 173.6948 72 Q 4.6483 7.6648 119.3238 54.6523 33.4614 176.0471 73 C 5.4416 8.7131 114.6370 56.7039 43.0615 173.9058 74 I 4.8624 9.1112 117.5490 58.2367 40.6741 173.3519 75 P 4.9673 0.0000 0.0000 62.7565 32.4741 175.7440 76 L 4.7582 9.0180 124.8234 53.8976 45.3868 174.2791 77 Y 5.3538 9.0401 123.8238 56.3476 40.4230 175.2477 78 L 4.9404 9.2827 123.1686 53.3649 46.5808 175.3051 79 T 4.9047 8.6541 118.6755 61.6920 70.9131 173.4403 80 A 4.6778 8.6029 129.2273 50.5820 20.4395 176.1341 81 F 5.0561 9.3918 122.6487 56.9998 40.4749 176.2058 82 K 4.4407 9.2582 122.5990 57.6417 33.3512 176.0866 83 T 4.6780 7.7935 112.2633 60.7586 71.5186 173.9102 84 E 4.1456 8.8032 115.8323 58.1520 30.0519 172.4433 85 E 4.6876 7.7903 116.5300 54.4508 32.8454 175.3485 86 A 3.9604 8.5149 125.5382 53.8271 19.0433 178.0700 87 R 4.1649 8.5405 117.0816 56.5788 28.3943 175.2804 88 Q 4.8660 7.1628 119.1720 54.2008 31.0185 174.4781 89 F 5.1587 9.6658 124.6605 55.6377 44.2587 173.2362 90 K 5.1747 9.4520 120.9937 54.7647 35.1363 174.5506 91 L 5.2058 8.9310 128.1244 53.5723 45.9068 174.6050 92 N 5.1761 8.9060 123.5268 52.6706 39.5690 173.9845 93 Y 4.4477 9.1505 121.5346 58.3316 42.5119 173.0332 94 Y 3.4300 9.3063 127.7451 59.0464 38.5610 170.2665 95 G 4.1336 7.9151 103.7223 44.2612 0.0000 174.2707 96 T 5.2839 9.1148 117.8974 60.4238 71.0587 172.3535 97 N 5.9250 9.1807 122.0497 52.0448 43.7999 173.0627 98 D 4.9835 9.3071 123.0141 52.9983 43.0379 175.4761 99 V 4.6920 8.8716 124.1925 61.1640 34.1834 173.6920 100 Y 5.3764 8.9254 125.2702 56.4461 40.8307 173.8961 101 Y 4.8402 9.3063 125.9349 56.2293 40.5503 174.5603 102 E 4.2444 7.8785 124.3075 54.4762 34.7267 174.2121 103 S 4.6484 7.5192 116.0805 58.3971 64.3596 177.3209 104 S 4.2827 9.4548 124.7901 60.5499 63.0598 174.3259 105 K 4.4571 7.2939 121.5703 52.9216 31.8231 173.9334 106 P 4.2241 0.0000 0.0000 64.4388 31.6135 176.6786 107 N 4.8206 8.1378 113.8835 53.5999 39.5321 174.4671 108 E 4.8138 8.5169 117.3394 58.6257 31.8932 175.3069 109 Y 5.7349 7.7088 113.8468 56.1339 41.3710 174.1104 110 A 4.4298 9.0339 121.0331 49.9941 22.8644 174.8365 111 K 4.7915 8.6666 123.6049 54.4410 35.1725 174.7199 112 F 5.1984 8.8956 125.7244 55.7686 42.3323 173.9945 113 I 4.8708 9.0247 125.4315 59.7636 39.3239 174.5411 114 F 5.1458 9.5101 126.8046 56.0046 41.4561 174.5102 115 Y 4.8440 8.9379 122.1626 56.4487 39.4328 174.0177 116 N 5.5170 8.8150 124.4708 51.9984 41.0987 173.4495 117 Y 4.7754 9.3964 124.7504 56.8584 39.8770 174.1092 118 H 4.6005 9.3165 126.1549 53.8688 31.6418 173.6413 119 D 4.2772 9.3999 128.1158 55.1899 39.1452 174.0363 120 G 4.0595 8.0697 106.1294 45.3426 0.0000 172.1712 121 K 4.5232 7.9591 121.4409 54.7235 33.7019 174.7356 122 V 4.8180 8.2104 125.1232 61.5727 33.2721 174.4036 123 N 5.2747 8.8741 123.4474 51.5673 43.7268 173.4096 124 V 4.5687 8.5893 120.8028 59.8493 34.5124 174.7227 125 V 4.4702 8.8223 123.7176 61.0442 34.3366 173.6685 126 A 5.1853 8.9693 130.8831 50.5295 21.1804 175.0854 127 N 5.3560 9.4579 120.1306 51.1782 42.0632 173.3520 128 L 4.6257 8.4535 125.2983 53.2841 44.4608 174.9035 129 F 5.7445 9.3094 125.9213 56.0548 41.7462 175.2585 130 G 4.8366 9.4033 108.8549 44.4543 0.0000 173.9251 131 R 4.1513 8.5645 119.6534 58.2364 31.0150 176.5722 132 T 4.7204 7.7501 107.8060 58.4487 71.8833 172.5367 133 P 4.2550 0.0000 0.0000 64.6991 31.1437 175.1483 134 N 5.1184 7.5476 115.2808 51.8406 42.2833 172.5504 135 L 4.9337 8.0159 119.4368 51.5402 46.0040 177.3360 136 S 4.2631 8.5161 115.2205 59.0837 64.5449 175.3463 137 N 4.3616 8.7329 120.6509 56.2911 38.2966 177.3371 138 E 3.8959 8.0926 120.3345 59.3800 29.8932 178.7092 139 I 3.5505 7.7214 119.6554 64.4035 37.1123 178.6649 140 K 4.0217 8.0325 119.2501 59.1831 31.7903 179.4135 141 K 3.9494 8.4767 120.4020 59.5129 32.0959 178.8887 142 R 3.8975 8.0205 119.0464 59.2737 30.0016 178.0999 143 F 4.1221 8.2695 120.4404 61.5956 39.4176 177.0646 144 E 3.9713 8.5767 118.1907 59.3061 29.2003 179.2619 145 E 4.0183 8.6881 119.2492 59.4079 29.3175 178.9231 146 D 4.3423 8.1049 118.2303 57.2833 41.2100 178.4305 147 F 4.2960 7.8790 120.5101 61.7413 39.4328 177.1986 148 M 4.3598 8.1552 119.5727 57.8237 31.5372 178.2014 149 N 4.5250 8.6853 115.4644 54.9522 38.6127 176.2853 150 R 4.4381 7.3720 118.9121 55.5720 30.8995 176.9194 151 G 3.5365 7.5456 105.6631 45.5910 0.0000 173.9879 152 F 4.6962 6.9348 118.0880 55.2508 40.6896 175.6187 153 R 4.1654 8.3631 120.3596 55.6683 30.5163 177.6249 154 R 4.0027 8.7227 120.2336 59.5418 30.2233 178.3757 155 E 4.1076 8.2343 115.9771 58.8007 29.9046 177.0561 156 N 4.7817 8.6452 115.9434 53.0991 38.8141 173.7777 157 I 4.6616 7.5801 119.9849 59.3979 39.2819 175.1164 158 L 4.5669 9.4343 128.4921 52.8678 44.0882 175.6684 159 D 5.0299 8.7785 125.6171 53.4790 41.1748 175.9396 160 I 4.2517 8.6420 120.2239 61.0436 38.3851 178.1340 161 S 4.1909 8.3549 116.9299 61.0301 62.8839 174.6155 162 E 4.5632 8.0318 117.3031 55.6700 29.7393 175.5982 163 V 4.4687 7.4777 117.7002 61.6700 34.8077 174.0984 164 D 4.4815 8.4939 125.4999 52.9222 40.3167 175.1263 165 H 4.6070 7.6521 116.5815 54.0395 31.5313 173.9828 166 C 4.3034 8.2790 115.7133 57.5212 41.0066 174.0865 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 24 L 8.17 4.66 0.00 1.59 1.76 0.89 0.31 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 *26 R 7.49 4.34 0.00 1.83 1.90 0.00 2.88 0.00 0.00 3.12 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.26 0.00 27 H 8.65 4.40 0.00 3.00 3.04 0.00 5.88 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 W 8.24 5.56 0.00 2.84 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 29 H 9.24 4.82 0.00 3.38 3.14 0.00 5.61 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 T 8.57 4.57 4.40 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 1.37 0.00 0.00 31 V 9.11 4.27 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 0.94 0.00 0.00 1.06 0.00 0.00 32 V 7.50 5.00 1.71 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 1.19 0.00 0.00 0.89 0.00 0.00 33 L 9.13 5.41 0.00 1.54 1.42 0.83 0.71 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 34 A 8.57 4.70 -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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 S 8.21 4.94 0.00 3.67 3.55 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 36 S 8.53 3.98 0.00 4.00 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 37 D 8.09 4.72 0.00 2.68 2.53 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 38 R 8.77 3.90 0.00 2.05 1.95 0.00 3.45 0.00 0.00 3.41 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.65 0.00 39 S 8.04 4.76 0.00 4.04 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 40 L 8.23 3.92 0.00 1.75 1.73 0.76 0.45 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 41 I 7.52 4.33 1.81 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.65 0.82 0.00 0.00 42 E 7.67 4.29 0.00 2.01 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 2.32 2.47 0.00 43 E 8.60 3.98 0.00 1.96 1.97 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 2.36 2.34 0.00 44 E 9.16 3.91 0.00 2.11 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 2.48 2.30 0.00 45 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 46 P 0.00 3.99 0.00 1.15 1.36 0.00 3.66 0.00 0.00 3.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.06 0.00 47 F 8.16 4.24 0.00 2.93 2.85 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 48 R 7.29 4.03 0.00 1.84 1.67 0.00 3.44 0.00 0.00 3.25 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.55 0.00 49 N 7.10 4.56 0.00 1.94 2.09 0.00 0.00 7.08 7.45 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 50 F 8.37 4.75 0.00 2.86 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 51 I 8.33 3.19 0.93 0.00 0.00 -0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.40 0.03 -0.28 0.00 0.00 52 Q 8.48 4.22 0.00 1.48 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.48 0.00 0.00 0.00 0.00 0.00 1.67 1.45 0.00 53 N 7.46 5.37 0.00 2.90 2.71 0.00 0.00 6.92 7.75 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 54 I 8.63 4.96 2.15 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.70 0.90 0.00 0.00 55 T 9.05 4.69 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 1.21 0.00 0.00 56 V 8.46 4.33 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 0.69 0.00 0.00 0.96 0.00 0.00 57 E 9.14 4.39 0.00 2.01 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 0.00 2.19 2.38 0.00 58 S 9.68 3.78 0.00 4.09 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 59 G 8.46 4.05 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 0.00 0.00 0.00 60 N 8.01 5.06 0.00 2.67 2.46 0.00 0.00 6.76 6.42 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 61 L 8.54 4.73 0.00 1.13 1.30 0.12 0.48 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 62 N 9.50 4.78 0.00 2.75 2.79 0.00 0.00 6.43 7.37 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 63 G 9.27 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 0.00 0.00 0.00 0.00 64 F 8.73 5.12 0.00 2.81 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 65 F 9.30 4.87 0.00 2.62 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 66 L 8.45 5.18 0.00 1.60 1.55 0.87 0.52 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 T 8.75 4.83 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 1.23 0.00 0.00 68 R 8.65 5.47 0.00 1.96 1.88 0.00 3.10 0.00 0.00 3.94 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.66 0.00 69 K 8.15 4.39 0.00 1.65 1.62 0.00 2.00 0.00 0.00 1.82 0.00 0.00 2.82 0.00 0.00 2.68 0.00 0.00 0.00 0.00 1.33 1.00 7.81 70 N 9.94 4.33 0.00 2.91 2.94 0.00 0.00 7.30 7.03 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 71 G 10.17 3.94 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 0.00 0.00 0.00 72 Q 7.66 4.65 0.00 1.88 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.28 6.72 0.00 0.00 0.00 0.00 0.00 2.19 2.21 0.00 73 C 8.71 5.44 0.00 2.85 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 74 I 9.11 4.86 1.93 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.90 0.95 0.00 0.00 75 P 0.00 4.97 0.00 2.27 2.42 0.00 3.74 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 2.19 2.26 0.00 76 L 9.02 4.76 0.00 1.63 1.37 0.90 0.27 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 77 Y 9.04 5.35 0.00 2.88 2.92 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 78 L 9.28 4.94 0.00 1.59 1.48 -0.01 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 79 T 8.65 4.90 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 0.15 0.00 0.00 80 A 8.60 4.68 1.05 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 0.00 0.00 81 F 9.39 5.06 0.00 3.13 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 82 K 9.26 4.44 0.00 1.76 2.18 0.00 1.59 0.00 0.00 1.98 0.00 0.00 3.08 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.79 1.47 7.81 83 T 7.79 4.68 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 1.23 0.00 0.00 84 E 8.80 4.15 0.00 2.01 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 2.23 1.90 0.00 85 E 7.79 4.69 0.00 1.91 1.81 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 2.21 2.21 0.00 86 A 8.51 3.96 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 87 R 8.54 4.16 0.00 2.17 2.47 0.00 3.32 0.00 0.00 3.43 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.74 0.00 88 Q 7.16 4.87 0.00 1.90 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.70 0.00 0.00 0.00 0.00 0.00 1.98 1.50 0.00 89 F 9.67 5.16 0.00 2.87 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 90 K 9.45 5.17 0.00 1.88 1.76 0.00 1.76 0.00 0.00 1.66 0.00 0.00 2.98 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.38 1.53 7.81 91 L 8.93 5.21 0.00 1.93 1.65 1.09 0.82 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 92 N 8.91 5.18 0.00 2.79 2.88 0.00 0.00 6.81 7.46 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 93 Y 9.15 4.45 0.00 2.88 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 Y 9.31 3.43 0.00 2.12 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 95 G 7.92 4.13 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 0.00 0.00 0.00 96 T 9.11 5.28 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 1.39 0.00 0.00 97 N 9.18 5.93 0.00 2.97 2.99 0.00 0.00 7.18 8.23 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 98 D 9.31 4.98 0.00 3.05 2.77 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 99 V 8.87 4.69 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 0.55 0.00 0.00 0.56 0.00 0.00 100 Y 8.93 5.38 0.00 3.02 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 0.00 101 Y 9.31 4.84 0.00 2.76 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 0.00 102 E 7.88 4.24 0.00 1.69 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 2.13 2.17 0.00 103 S 7.52 4.65 0.00 3.21 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 0.00 104 S 9.45 4.28 0.00 4.04 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 0.00 105 K 7.29 4.46 0.00 1.87 1.77 0.00 1.68 0.00 0.00 1.86 0.00 0.00 2.99 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.66 1.62 7.81 106 P 0.00 4.22 0.00 2.16 2.29 0.00 3.72 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 2.08 2.10 0.00 107 N 8.14 4.82 0.00 2.71 2.85 0.00 0.00 6.89 7.65 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 0.00 108 E 8.52 4.81 0.00 2.29 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 0.00 2.32 2.31 0.00 109 Y 7.71 5.73 0.00 3.15 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 0.00 110 A 9.03 4.43 0.64 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 0.00 0.00 111 K 8.67 4.79 0.00 1.88 1.66 0.00 1.69 0.00 0.00 1.79 0.00 0.00 3.12 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.56 7.81 112 F 8.90 5.20 0.00 2.95 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 0.00 113 I 9.02 4.87 1.99 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.98 0.55 0.00 0.00 114 F 9.51 5.15 0.00 2.87 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 Y 8.94 4.84 0.00 3.11 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 0.00 116 N 8.81 5.52 0.00 2.98 2.63 0.00 0.00 6.89 8.38 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 0.00 117 Y 9.40 4.78 0.00 3.05 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 0.00 118 H 9.32 4.60 0.00 3.45 3.19 0.00 5.92 0.00 0.00 0.00 0.00 6.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 D 9.40 4.28 0.00 2.54 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 0.00 120 G 8.07 4.06 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 0.00 0.00 0.00 121 K 7.96 4.52 0.00 1.84 1.84 0.00 1.66 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.41 1.40 7.81 122 V 8.21 4.82 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 0.76 0.00 0.00 1.08 0.00 0.00 123 N 8.87 5.27 0.00 2.66 2.49 0.00 0.00 6.37 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 0.00 124 V 8.59 4.57 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 0.50 0.00 0.00 0.57 0.00 0.00 125 V 8.82 4.47 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 0.54 0.00 0.00 0.09 0.00 0.00 126 A 8.97 5.19 1.24 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 0.00 0.00 0.00 127 N 9.46 5.36 0.00 2.54 2.46 0.00 0.00 6.10 6.56 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 0.00 128 L 8.45 4.63 0.00 0.27 0.83 0.64 0.29 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 0.00 129 F 9.31 5.74 0.00 2.73 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 0.00 130 G 9.40 4.84 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 0.00 0.00 0.00 131 R 8.56 4.15 0.00 1.76 1.93 0.00 2.80 0.00 0.00 2.29 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.68 0.00 132 T 7.75 4.72 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 1.21 0.00 0.00 133 P 0.00 4.26 0.00 2.13 2.07 0.00 3.60 0.00 0.00 3.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.85 0.00 134 N 7.55 5.12 0.00 2.75 2.68 0.00 0.00 6.92 7.66 0.00 0.00 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 L 8.02 4.93 0.00 1.60 1.48 0.95 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 136 S 8.52 4.26 0.00 4.05 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 0.00 137 N 8.73 4.36 0.00 2.76 2.92 0.00 0.00 6.62 7.66 0.00 0.00 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 E 8.09 3.90 0.00 2.03 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 2.37 2.40 0.00 139 I 7.72 3.55 1.87 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 1.28 0.66 0.41 0.00 0.00 140 K 8.03 4.02 0.00 1.82 1.89 0.00 1.88 0.00 0.00 1.67 0.00 0.00 2.92 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.42 1.50 7.81 141 K 8.48 3.95 0.00 1.90 1.96 0.00 1.65 0.00 0.00 1.58 0.00 0.00 3.14 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.45 1.46 7.81 142 R 8.02 3.90 0.00 1.98 1.91 0.00 3.22 0.00 0.00 3.10 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.84 0.00 143 F 8.27 4.12 0.00 3.14 3.19 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 0.00 144 E 8.58 3.97 0.00 2.31 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 2.41 2.61 0.00 145 E 8.69 4.02 0.00 2.10 2.00 0.00 0.00 0.00 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 2.58 0.00 146 D 8.10 4.34 0.00 2.72 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 0.00 147 F 7.88 4.30 0.00 2.82 3.11 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 0.00 148 M 8.16 4.36 0.00 2.12 2.21 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.97 2.54 0.00 149 N 8.69 4.52 0.00 2.79 2.84 0.00 0.00 6.96 7.85 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 0.00 150 R 7.37 4.44 0.00 1.94 1.83 0.00 3.27 0.00 0.00 3.33 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.71 0.00 151 G 7.55 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 F 6.93 4.70 0.00 2.30 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 0.00 153 R 8.36 4.17 0.00 2.04 2.10 0.00 3.02 0.00 0.00 3.32 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.84 0.00 154 R 8.72 4.00 0.00 1.91 2.02 0.00 3.21 0.00 0.00 3.37 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.72 0.00 155 E 8.23 4.11 0.00 2.05 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 2.36 2.31 0.00 156 N 8.65 4.78 0.00 3.27 3.18 0.00 0.00 6.66 6.91 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 0.00 157 I 7.58 4.66 1.90 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.72 0.91 0.00 0.00 158 L 9.43 4.57 0.00 1.44 1.59 0.92 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 159 D 8.78 5.03 0.00 2.72 2.63 0.00 0.00 0.00 0.00 0.00 0.00 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 8.64 4.25 1.95 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.64 1.08 0.00 0.00 161 S 8.35 4.19 0.00 4.09 4.09 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 0.00 0.00 0.00 0.00 162 E 8.03 4.56 0.00 2.09 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 2.49 2.30 0.00 163 V 7.48 4.47 2.12 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 0.83 0.00 0.00 0.95 0.00 0.00 164 D 8.49 4.48 0.00 2.72 2.58 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 0.00 0.00 0.00 165 H 7.65 4.61 0.00 1.89 2.92 0.00 5.74 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 0.00 166 C 8.28 4.30 0.00 3.09 3.09 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 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.