NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 9 N 4.6958 8.2833 118.1160 52.8779 41.1095 175.9706 10 E 3.4812 8.0484 117.9666 57.7981 30.8804 174.1019 11 V 3.3601 9.0087 114.8268 65.4503 31.5537 176.6884 12 L 4.3687 9.3477 119.6909 58.3990 42.1773 178.1554 13 M 4.0370 8.1647 116.7203 58.5135 31.2901 178.2388 14 A 4.1569 7.0752 121.5286 55.5249 18.2386 178.6526 15 F 4.9762 8.0068 116.6713 59.3659 38.6166 177.6253 16 T 3.8425 8.0570 117.9627 67.8771 69.1059 175.0830 17 S 3.5975 8.1217 109.3209 62.0524 63.3359 175.3995 18 Y 4.4296 8.1245 118.2109 60.7130 38.1181 178.8684 19 A 3.6853 7.1487 122.4862 55.1125 18.3847 179.5751 20 T 4.0007 8.5244 108.4876 64.2568 68.7053 176.6172 21 I 4.1851 8.6369 116.3992 62.9815 38.2631 177.2764 22 I 4.2349 7.7641 120.6256 63.5615 37.4193 176.3625 23 L 4.3163 8.6662 120.8923 55.9267 41.0095 179.2497 24 A 3.6146 8.4479 122.4127 55.2760 19.3880 179.1617 25 K 4.0390 8.1405 115.5637 59.9332 32.5237 178.9726 26 M 4.1880 8.1658 118.0698 58.1269 32.1584 177.5601 27 M 4.2203 9.5655 115.4338 57.0199 30.1755 176.3128 28 F 5.0399 8.4624 122.0511 59.5087 42.0898 176.7505 29 L 3.7460 7.9948 121.3681 59.2564 39.9127 179.7316 30 S 4.0440 7.9248 115.8467 60.8543 62.7003 176.0356 31 S 4.2845 7.5127 113.7700 59.9051 62.2329 174.7715 32 A 4.2834 7.2887 121.4212 52.1436 19.4982 177.2458 33 T 3.6151 7.0432 112.3111 61.3222 67.8722 173.1539 34 A 4.0330 8.1722 130.6289 52.8040 17.5450 178.1392 35 F 4.8812 8.2099 125.8589 60.3828 38.0894 175.8620 36 Q 3.5605 7.1953 119.8033 53.6212 30.8168 176.9151 37 R 3.9967 8.5052 121.7539 56.2509 29.7362 176.9853 38 L 4.1806 8.2372 119.7258 55.3675 40.0847 176.7523 39 T 4.2373 8.0481 119.9538 63.4900 69.4793 173.6873 40 N 5.0958 8.6115 121.4008 55.2030 43.6834 176.1421 41 K 3.9720 7.8488 118.1589 56.5621 30.1308 175.6857 42 V 4.1912 7.4692 124.1303 64.4541 34.2169 176.7355 43 F 4.2808 8.0869 113.5438 59.4623 37.8266 175.9781 *62 L 4.3613 7.8596 120.3605 54.5617 43.4505 178.2058 63 R 4.0795 8.0670 117.8320 56.5431 30.3689 180.9589 64 T 3.0013 7.3437 104.7513 61.1200 72.0171 174.6261 65 D 4.4709 8.7460 119.5101 56.6074 39.7931 178.5606 66 E 4.1642 7.5471 115.1520 56.4091 29.6632 178.2607 67 K 4.2282 8.0860 120.9879 58.6316 32.8414 178.1529 68 V 3.7827 8.3112 118.9803 66.3469 31.2580 177.7320 69 E 4.0544 10.6302 115.9201 58.5240 29.4533 178.6585 70 R 4.3155 7.6317 118.1341 59.0835 30.2482 177.4860 71 V 3.5467 8.6644 119.3743 65.6716 31.3200 177.7761 72 R 4.0850 8.3459 117.0139 59.7908 30.1420 179.5238 73 R 4.0448 8.0795 114.6851 58.3361 30.1977 178.1278 74 A 4.6511 8.2508 121.0484 54.7129 19.0152 178.7478 75 H 4.7012 9.3353 117.7890 58.1909 29.7258 177.4418 76 L 4.0434 8.4582 121.7156 57.3870 40.5724 178.0324 77 N 4.5898 8.1074 116.3669 54.5536 39.5838 176.3011 78 D 4.3843 8.3607 120.7339 56.3520 39.1578 178.1351 79 L 4.0396 7.8144 118.7095 55.8446 41.6990 178.2653 80 E 3.9492 6.3626 116.3119 60.0570 29.9778 179.2244 81 N 4.1355 7.1048 115.8127 54.8372 38.8981 175.6486 82 I 4.3969 8.2690 121.0919 63.1706 38.7670 177.5575 83 V 3.9919 7.5046 118.9851 66.4239 31.2849 175.7394 84 P 4.3787 0.0000 0.0000 64.7812 31.0371 178.6422 85 F 3.7876 7.4752 122.0715 59.8330 40.6994 177.4077 86 L 4.4981 9.5373 121.2618 58.4486 42.1168 178.0872 87 G 3.8333 7.7763 104.1292 48.4630 0.0000 174.9592 88 I 3.4879 8.4430 117.0881 63.5378 37.6300 177.8834 89 G 4.1469 7.7294 106.1611 47.2191 0.0000 174.5323 90 L 4.4756 7.8065 119.2201 56.6228 42.7426 178.5613 91 L 3.7720 7.4147 118.8604 57.6430 41.7522 177.5534 92 Y 4.5350 8.2743 115.7224 60.1579 38.7917 177.9988 93 S 4.1717 8.1329 114.3821 60.9219 63.1490 175.7171 94 L 3.9950 7.9544 119.3952 57.1216 41.3864 177.4258 95 S 4.4487 7.9020 114.2342 55.3663 62.9116 171.6800 96 G 4.0504 8.5820 110.6173 44.1619 0.0000 169.2859 97 P 4.5168 0.0000 0.0000 62.2503 32.5753 175.7703 98 D 4.5740 9.0831 121.0403 54.8184 39.8680 176.9423 99 L 4.6527 5.6200 127.5508 54.4953 46.6948 176.5448 100 S 4.1333 8.3433 114.3384 61.5799 63.0410 176.0458 101 T 3.9401 7.8386 115.0410 65.3152 67.3528 175.7919 102 A 4.1034 8.0440 122.0459 55.2018 18.1870 179.3519 103 L 4.0216 7.7021 117.5532 58.8070 41.0263 178.8699 104 I 3.9497 8.3876 120.8628 63.5897 36.8124 177.3232 105 H 4.4832 8.2878 120.6828 58.9846 29.9741 176.6405 106 F 4.2879 8.2507 121.1367 59.7012 39.8748 177.8159 107 R 4.1090 8.2068 118.2412 59.1665 29.8748 178.9145 108 I 3.7701 9.2179 120.0591 64.7683 36.9233 177.2792 109 F 3.9738 7.8822 118.7819 61.7473 39.8001 176.7980 110 V 3.4063 8.0928 112.6620 65.3609 31.5502 178.7160 111 G 3.9220 8.0931 103.7182 48.4283 0.0000 175.1455 112 A 4.0015 9.1820 123.7815 53.2891 18.2127 179.9723 113 R 2.9431 7.3899 115.5978 58.2772 31.2277 177.7482 114 I 3.7698 8.9293 120.4129 62.2855 36.6052 178.1989 115 Y 4.2572 6.6590 122.7777 61.1227 39.7412 177.3030 116 H 3.7998 8.7200 120.2957 59.7603 29.8052 177.1865 117 T 3.9081 8.1262 117.6535 66.8114 68.0129 176.7471 118 I 3.7094 7.9017 120.9464 63.9885 37.1285 178.1329 119 A 4.1534 8.3419 121.5779 55.3665 18.3682 178.6663 120 Y 3.9721 7.9756 116.7909 60.2170 39.0538 177.1189 121 L 4.1688 7.6103 119.0392 58.4503 41.8403 179.0846 122 T 3.8281 7.7553 107.1909 65.6762 68.9552 172.9777 123 P 4.6881 0.0000 0.0000 61.4743 31.0394 175.9878 124 L 4.0268 7.9711 113.1442 54.5387 49.7169 174.3933 125 P 4.4034 0.0000 0.0000 63.5359 30.2178 176.6047 126 Q 4.1647 9.2798 115.4972 58.1480 29.8804 176.7992 127 P 4.5995 0.0000 0.0000 63.2222 31.6291 175.4174 128 N 4.7747 8.5542 116.3442 55.3244 40.7976 176.6708 129 R 3.9409 8.3283 115.3643 59.7923 30.3229 178.0132 130 G 3.6686 8.2891 104.5752 48.1351 0.0000 175.0623 131 L 3.9554 7.9237 120.2710 57.1635 40.3852 179.5204 132 A 4.1397 8.7236 120.2726 54.0750 18.2343 179.3399 133 F 4.6410 8.2838 119.9575 61.3223 39.6198 177.7016 134 F 4.2039 7.7316 116.4979 60.5404 38.6380 176.1546 135 V 4.1796 7.7584 109.9075 61.4624 31.0538 178.2099 136 G 4.0656 7.3267 109.7527 48.8136 0.0000 174.5854 137 Y 4.3192 8.2256 118.9626 60.7996 37.9643 177.5879 138 G 3.7610 8.6902 108.2334 44.9450 0.0000 176.1440 139 V 4.3604 7.8009 118.5569 64.0058 32.3838 177.7893 140 T 3.9313 7.6366 110.5155 62.9534 69.5779 176.6161 141 L 4.0382 7.9285 123.5872 58.3494 42.0459 178.0320 142 S 4.2373 8.7079 115.5456 60.0605 62.6012 175.8063 143 M 3.6525 7.6426 126.4537 57.8061 31.9593 178.0522 144 A 4.3653 8.0826 121.3288 54.7423 18.7409 178.4143 145 Y 3.8376 9.3310 115.7756 60.9028 38.7393 179.3090 146 R 3.9512 9.1616 121.5326 59.4204 30.6084 176.6168 147 L 4.1914 7.6157 121.8523 54.9744 41.6849 176.6059 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 9 N 8.28 4.70 0.00 2.73 2.89 0.00 0.00 6.99 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 E 8.05 3.48 0.00 1.95 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.15 0.00 11 V 9.01 3.36 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 0.95 0.00 0.00 0.93 0.00 0.00 12 L 9.35 4.37 0.00 1.77 1.86 0.97 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 13 M 8.16 4.04 0.00 2.22 2.39 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 2.24 0.00 14 A 7.08 4.16 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 15 F 8.01 4.98 0.00 3.33 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 16 T 8.06 3.84 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 17 S 8.12 3.60 0.00 4.44 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 0.00 18 Y 8.12 4.43 0.00 3.42 3.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 A 7.15 3.69 1.15 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 20 T 8.52 4.00 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 1.21 0.00 0.00 21 I 8.64 4.19 1.97 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.88 1.03 0.00 0.00 22 I 7.76 4.23 1.95 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.87 0.97 0.00 0.00 23 L 8.67 4.32 0.00 1.76 1.58 0.94 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 24 A 8.45 3.61 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 25 K 8.14 4.04 0.00 1.94 2.17 0.00 1.90 0.00 0.00 1.81 0.00 0.00 3.07 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.57 1.65 7.81 26 M 8.17 4.19 0.00 2.37 2.08 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.61 0.00 27 M 9.57 4.22 0.00 2.25 2.26 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.82 0.00 28 F 8.46 5.04 0.00 3.09 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 29 L 7.99 3.75 0.00 1.85 1.86 0.93 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 30 S 7.92 4.04 0.00 3.89 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 31 S 7.51 4.28 0.00 4.12 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 0.00 32 A 7.29 4.28 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 T 7.04 3.62 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 0.85 0.00 0.00 34 A 8.17 4.03 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 35 F 8.21 4.88 0.00 3.08 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 36 Q 7.20 3.56 0.00 2.07 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.93 0.00 0.00 0.00 0.00 0.00 2.35 2.42 0.00 37 R 8.51 4.00 0.00 1.97 1.95 0.00 3.09 0.00 0.00 3.22 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.68 0.00 38 L 8.24 4.18 0.00 1.66 1.72 0.94 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 39 T 8.05 4.24 4.27 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 1.24 0.00 0.00 40 N 8.61 5.10 0.00 2.70 2.88 0.00 0.00 7.08 6.68 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 41 K 7.85 3.97 0.00 1.73 1.68 0.00 1.53 0.00 0.00 1.59 0.00 0.00 2.73 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.37 1.37 7.81 42 V 7.47 4.19 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 0.89 0.00 0.00 0.94 0.00 0.00 43 F 8.09 4.28 0.00 3.17 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 *62 L 7.86 4.36 0.00 1.76 1.80 0.92 0.99 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 63 R 8.07 4.08 0.00 1.93 1.78 0.00 3.21 0.00 0.00 3.40 7.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.70 0.00 64 T 7.34 3.00 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 1.20 0.00 0.00 65 D 8.75 4.47 0.00 3.11 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 66 E 7.55 4.16 0.00 2.23 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 2.41 2.46 0.00 67 K 8.09 4.23 0.00 1.87 1.79 0.00 1.54 0.00 0.00 1.60 0.00 0.00 2.97 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.38 1.47 7.81 68 V 8.31 3.78 2.30 0.00 0.00 0.00 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 0.91 0.00 0.00 69 E 10.63 4.05 0.00 2.11 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 2.36 2.34 0.00 70 R 7.63 4.32 0.00 1.94 2.00 0.00 3.26 0.00 0.00 3.28 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.80 0.00 71 V 8.66 3.55 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 0.89 0.00 0.00 0.92 0.00 0.00 72 R 8.35 4.08 0.00 2.00 2.00 0.00 3.33 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.83 0.00 73 R 8.08 4.04 0.00 1.91 2.07 0.00 3.38 0.00 0.00 3.27 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.72 0.00 74 A 8.25 4.65 2.01 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 0.00 0.00 75 H 9.34 4.70 0.00 3.00 3.33 0.00 5.83 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 L 8.46 4.04 0.00 1.85 1.72 0.97 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 77 N 8.11 4.59 0.00 2.89 2.96 0.00 0.00 6.92 8.34 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 78 D 8.36 4.38 0.00 3.07 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 79 L 7.81 4.04 0.00 1.88 1.65 0.92 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 80 E 6.36 3.95 0.00 2.18 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 0.00 2.34 2.34 0.00 81 N 7.10 4.14 0.00 2.98 2.65 0.00 0.00 6.96 7.33 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 82 I 8.27 4.40 2.11 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 1.46 0.88 1.01 0.00 0.00 83 V 7.50 3.99 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 1.06 0.00 0.00 1.00 0.00 0.00 84 P 0.00 4.38 0.00 2.32 2.19 0.00 4.09 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.00 0.00 85 F 7.48 3.79 0.00 3.01 3.24 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 86 L 9.54 4.50 0.00 1.95 1.80 1.28 1.19 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 87 G 7.78 3.83 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 0.00 0.00 0.00 88 I 8.44 3.49 2.36 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.86 0.99 0.00 0.00 89 G 7.73 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 90 L 7.81 4.48 0.00 1.69 1.68 0.93 0.59 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 91 L 7.41 3.77 0.00 1.52 0.99 0.80 0.65 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 92 Y 8.27 4.53 0.00 3.06 2.87 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 93 S 8.13 4.17 0.00 3.71 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 94 L 7.95 3.99 0.00 1.69 1.72 0.88 0.76 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 95 S 7.90 4.45 0.00 3.79 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 96 G 8.58 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 97 P 0.00 4.52 0.00 2.11 2.08 0.00 3.63 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.84 0.00 98 D 9.08 4.57 0.00 2.61 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 0.00 0.00 0.00 99 L 5.62 4.65 0.00 1.82 1.60 0.92 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 100 S 8.34 4.13 0.00 3.83 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 0.00 101 T 7.84 3.94 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 1.19 0.00 0.00 102 A 8.04 4.10 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 0.00 103 L 7.70 4.02 0.00 1.70 1.77 0.93 0.76 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 0.00 104 I 8.39 3.95 2.01 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 1.43 0.90 0.94 0.00 0.00 105 H 8.29 4.48 0.00 3.27 3.37 0.00 5.85 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 F 8.25 4.29 0.00 3.30 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 0.00 107 R 8.21 4.11 0.00 2.16 2.02 0.00 3.40 0.00 0.00 3.24 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.88 0.00 108 I 9.22 3.77 2.04 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 1.44 1.00 0.90 0.00 0.00 109 F 7.88 3.97 0.00 2.81 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 0.00 110 V 8.09 3.41 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 0.70 0.00 0.00 1.16 0.00 0.00 111 G 8.09 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 0.00 112 A 9.18 4.00 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 0.00 113 R 7.39 2.94 0.00 1.14 1.27 0.00 2.38 0.00 0.00 2.48 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.99 0.00 114 I 8.93 3.77 2.04 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 1.33 0.61 0.92 0.00 0.00 115 Y 6.66 4.26 0.00 2.85 3.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 H 8.72 3.80 0.00 2.88 3.13 0.00 5.65 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 0.00 117 T 8.13 3.91 4.43 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 1.12 0.00 0.00 118 I 7.90 3.71 2.10 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 1.43 0.45 0.91 0.00 0.00 119 A 8.34 4.15 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 0.00 120 Y 7.98 3.97 0.00 2.91 2.87 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 0.00 121 L 7.61 4.17 0.00 1.44 1.57 0.52 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 122 T 7.76 3.83 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 1.17 0.00 0.00 123 P 0.00 4.69 0.00 1.97 1.81 0.00 3.67 0.00 0.00 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.83 0.00 124 L 7.97 4.03 0.00 1.42 1.56 0.83 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 125 P 0.00 4.40 0.00 2.20 1.82 0.00 3.66 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.88 0.00 126 Q 9.28 4.16 0.00 2.26 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.02 7.07 0.00 0.00 0.00 0.00 0.00 2.39 2.37 0.00 127 P 0.00 4.60 0.00 2.07 2.14 0.00 3.59 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 1.99 2.06 0.00 128 N 8.55 4.77 0.00 2.81 3.30 0.00 0.00 7.14 7.84 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 0.00 129 R 8.33 3.94 0.00 1.81 1.96 0.00 3.28 0.00 0.00 3.22 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 2.09 0.00 130 G 8.29 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.92 3.96 0.00 1.63 1.63 0.62 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 132 A 8.72 4.14 1.42 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 0.00 0.00 133 F 8.28 4.64 0.00 2.89 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 F 7.73 4.20 0.00 2.99 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 0.00 135 V 7.76 4.18 2.28 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 0.94 0.00 0.00 1.06 0.00 0.00 136 G 7.33 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 0.00 0.00 0.00 0.00 137 Y 8.23 4.32 0.00 3.18 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 0.00 138 G 8.69 3.76 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 0.00 0.00 0.00 139 V 7.80 4.36 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 0.73 0.00 0.00 0.92 0.00 0.00 140 T 7.64 3.93 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 1.28 0.00 0.00 141 L 7.93 4.04 0.00 1.88 1.99 1.06 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 142 S 8.71 4.24 0.00 3.88 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 M 7.64 3.65 0.00 0.51 0.68 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.50 0.00 144 A 8.08 4.37 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 0.00 145 Y 9.33 3.84 0.00 3.33 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 146 R 9.16 3.95 0.00 1.71 2.00 0.00 3.15 0.00 0.00 3.07 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.78 0.00 147 L 7.62 4.19 0.00 1.77 1.59 1.08 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.