NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 G 3.9758 8.2127 109.7412 44.8917 0.0000 174.4010 3 L 3.7732 8.5035 120.1880 57.7366 41.7758 177.3260 4 L 3.9729 8.0722 118.6910 57.9267 41.7387 178.8492 5 S 4.1139 8.0284 112.5206 61.4421 62.4018 176.2595 6 R 4.0727 8.3251 121.0912 59.2974 29.8305 179.0681 7 L 4.0505 8.3147 119.1436 57.7915 41.3691 179.7500 8 R 4.0687 7.9820 117.1350 58.2411 29.9581 178.1019 9 K 4.3999 7.3438 116.0042 54.9744 32.4531 176.3047 10 R 3.8518 7.6960 116.8316 57.1741 28.2200 175.8835 11 E 4.4946 8.0071 116.5586 54.1526 30.7816 175.1187 12 P 4.4516 0.0000 0.0000 62.4158 32.1329 175.9174 13 I 3.9547 8.0695 121.0631 60.9472 37.7321 177.1754 14 S 4.4628 8.5057 120.4893 57.8010 65.3406 175.1846 15 I 3.6598 8.2858 123.3687 64.7613 36.8326 177.6745 16 Y 4.1366 8.5597 120.6141 61.2332 38.4036 178.3209 17 D 4.3629 8.1501 119.4166 56.9987 40.8135 178.8532 18 K 4.0414 7.9953 118.5755 59.0999 32.7930 178.4094 19 I 4.1206 7.2771 112.3350 60.4645 37.9820 176.0728 20 G 4.0027 8.1049 111.2343 44.8524 0.0000 175.2258 21 G 2.6882 8.2386 109.0051 45.5297 0.0000 175.1647 22 H 4.1282 8.7104 116.9641 59.6447 29.9361 177.8211 23 E 3.9782 8.1503 119.4716 59.2631 29.3408 178.9143 24 A 3.9492 7.5235 119.4299 55.3371 18.3705 179.7819 25 I 3.6463 7.7034 118.2194 64.4200 37.1587 178.4779 26 E 4.0004 8.2705 119.4757 59.4848 29.3451 179.6855 27 V 3.6104 7.7245 118.0090 65.8997 31.6226 178.1506 28 V 3.5575 7.9338 118.0984 66.0970 31.3819 178.1890 29 V 3.8495 8.2559 118.3356 65.9149 31.3975 177.4361 30 E 4.0648 8.4322 119.1285 59.5550 28.9989 178.4007 31 D 4.3241 8.1554 117.9349 57.1462 41.1961 177.6597 32 F 4.1911 8.7066 121.6586 61.6972 39.2703 177.2792 33 F 3.6195 8.2428 117.0298 59.8189 38.6511 177.7182 34 V 3.5462 7.7503 118.2780 66.2286 31.0161 178.2731 35 R 3.7434 7.5163 115.8318 59.2340 30.2959 178.9363 36 V 3.4002 7.4399 118.1331 65.9517 31.2492 178.0397 37 L 4.1010 7.7712 116.8853 56.9807 41.5521 178.5304 38 A 4.3934 7.6747 119.1703 52.2266 18.7876 176.5658 39 D 4.6144 7.5025 118.1624 52.6189 41.0016 176.5975 40 D 4.5788 8.6281 126.6030 55.1578 39.6800 177.2227 41 Q 4.3589 8.4366 118.6085 57.4483 29.4689 176.5628 42 L 5.1431 8.3811 117.3520 55.3312 44.5911 178.6995 43 S 4.3076 8.6010 112.9489 61.4472 62.9779 176.4790 44 A 4.0482 8.0335 122.8929 53.9285 18.3139 179.2872 45 F 3.9043 7.8904 113.8308 60.1480 39.2443 176.1885 46 F 4.7065 8.4740 117.5855 57.0802 38.9163 177.4266 47 S 4.1560 7.9278 119.3866 61.5173 62.6861 176.2999 48 G 3.9874 7.9289 106.3367 45.6066 0.0000 172.8273 49 T 4.4502 7.5076 116.2287 61.0326 70.5851 174.6206 50 N 4.4601 8.5632 124.1913 53.7240 39.3308 175.3725 51 M 3.8849 8.4502 129.2769 58.2145 32.2348 178.7782 52 S 4.0804 8.0473 115.0510 61.4050 62.9931 176.5686 53 R 3.7938 7.8410 120.7744 59.2521 29.8772 177.8793 54 L 3.9037 7.9265 120.2884 58.4899 41.9299 179.2178 55 K 4.0747 8.2004 118.4783 59.2233 31.9369 179.2976 56 G 3.8295 8.1051 106.0557 48.1427 0.0000 175.8355 57 K 4.1532 8.2332 121.4366 58.9422 32.0474 179.7915 58 V 3.5229 8.2504 118.8509 65.7585 31.4098 177.9966 59 V 3.7607 8.3062 118.5308 66.4194 31.3207 177.8783 60 E 4.0952 8.3324 117.9985 59.3494 29.2336 179.2227 61 F 3.6966 8.7296 120.9742 61.2684 39.5978 177.2297 62 F 4.5857 8.6384 117.6471 60.5097 38.7162 177.4387 63 A 4.2277 8.5427 120.4612 55.3288 18.1283 179.5876 64 A 3.7943 7.9648 118.9688 55.2419 18.2304 179.7268 65 A 3.7939 7.8392 118.3765 54.3805 18.6630 178.8098 66 L 4.5566 7.5974 115.2832 54.3683 41.8765 177.7195 67 G 4.0285 7.6371 107.2249 45.0622 0.0000 174.7962 68 G 2.5386 8.0803 108.4343 43.6288 0.0000 172.4118 69 P 4.4120 0.0000 0.0000 62.9873 31.9602 176.3350 70 E 4.1825 7.6574 120.4472 55.3269 30.1800 174.5193 71 P 4.3557 0.0000 0.0000 62.6506 32.2725 175.0329 72 Y 4.5587 8.5277 121.6769 57.2689 39.3318 175.6171 73 T 4.2444 8.5914 116.8311 61.2140 69.1693 174.5628 74 G 3.7756 5.4762 110.8288 43.4696 0.0000 173.3436 75 A 4.4997 8.1639 121.5337 50.3790 20.1439 176.3129 76 P 4.5873 0.0000 0.0000 62.5070 33.3300 177.6424 77 M 4.0365 8.7404 121.7270 58.5745 31.8928 179.0804 78 K 4.3953 7.9541 120.1948 59.0661 32.2862 178.2068 79 Q 3.9442 8.0538 117.8318 59.2867 29.0438 178.0164 80 V 3.6933 7.5837 117.5423 66.4265 31.8520 177.2077 81 H 4.4939 8.2926 114.8953 56.3778 28.9352 175.7051 82 Q 4.0578 7.6388 119.9641 57.7732 28.8900 177.4665 83 G 3.9650 8.9753 109.9300 45.7790 0.0000 173.9215 84 R 4.2492 7.9804 117.8666 55.5611 30.4332 176.8198 85 G 4.2831 7.9451 105.5923 46.5236 0.0000 173.8822 86 I 4.1064 7.2807 118.7815 60.3951 37.8567 176.4515 87 T 4.8064 8.5267 116.2027 60.2793 72.3015 175.0946 88 M 4.0352 8.4203 119.2682 58.7299 32.0740 177.2065 89 H 4.1184 8.2938 118.1789 59.8212 30.0271 176.7817 90 H 4.1941 7.8106 117.3328 58.7040 28.3978 177.5924 91 F 4.0153 8.5866 122.7895 61.4420 39.1828 177.4015 92 S 4.2325 8.8016 115.2262 61.5597 62.6315 176.6512 93 L 3.9102 7.9069 121.7494 57.7023 41.2970 179.7553 94 V 3.6258 7.7832 117.9322 65.9057 31.3949 177.7663 95 A 3.8994 8.0232 120.9417 55.0870 18.0901 179.6128 96 G 3.6066 8.3382 104.4891 48.5814 0.0000 175.6148 97 H 4.3105 8.2053 118.8413 58.1605 28.5852 177.7281 98 L 3.7490 8.3647 122.2042 58.0444 41.8580 178.8066 99 A 3.9057 8.1510 120.9574 55.3408 18.2028 179.3224 100 D 4.2900 8.4940 117.4505 57.4672 41.0236 178.9253 101 A 4.2433 8.2263 122.8365 54.5260 18.4463 179.7211 102 L 3.8565 8.1919 117.8489 58.2386 41.7188 179.6857 103 T 3.8190 8.2396 115.8344 66.8261 68.2048 176.5118 104 A 4.0169 8.1266 121.1120 54.5446 18.4545 178.5457 105 A 4.3550 7.6053 116.5723 51.9446 18.9530 178.0763 106 G 3.7844 7.8854 105.6630 45.5523 0.0000 174.1100 107 V 3.6626 7.4123 119.6367 61.4861 32.1038 174.3986 108 P 4.3618 0.0000 0.0000 62.5858 32.0173 177.2887 109 S 4.1247 8.8269 117.2349 61.9777 62.6705 176.8147 110 E 3.9240 8.1299 121.3785 59.4324 29.1641 179.2617 111 T 3.9839 7.9220 115.8779 66.2466 68.5036 177.0964 112 I 3.6201 7.6232 121.4278 64.5972 37.2153 178.1516 113 T 3.8334 8.0683 116.8061 66.8240 68.0985 176.1046 114 E 3.9437 8.0889 120.8547 59.3181 29.5891 179.0298 115 I 3.7055 7.8276 119.9114 64.3552 37.2265 178.2914 116 L 4.0873 8.4123 120.3790 57.8410 41.1653 179.8685 117 G 3.8746 7.8920 104.7941 47.2949 0.0000 175.7529 118 V 3.8112 7.2171 119.9271 65.8171 31.7976 177.8406 119 I 4.1275 8.0408 119.3082 63.9745 37.1613 177.7809 120 A 4.2627 8.5635 122.1332 55.1852 17.7797 177.9157 121 P 4.2717 0.0000 0.0000 64.8603 31.4006 178.3937 122 L 4.1310 8.4033 118.1991 56.8080 41.4511 178.6041 123 A 3.1447 7.6240 121.4266 54.8991 17.6901 179.5439 124 V 3.4121 7.0046 115.2098 66.4684 31.7336 177.6479 125 D 4.5114 8.1562 117.9446 56.5051 40.5728 178.8243 126 V 3.6716 7.5456 118.0274 64.1941 32.0457 176.1145 127 T 4.4577 7.3083 109.8877 61.0005 70.4160 175.4915 *128 S 4.3006 9.1287 116.8843 57.9376 64.1814 175.4324 *129 G 3.8107 8.3939 112.1874 45.9071 0.0000 173.7052 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 2 G 8.21 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 3 L 8.50 3.77 0.00 2.06 1.71 1.00 0.26 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 4 L 8.07 3.97 0.00 1.74 1.71 0.93 0.81 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 5 S 8.03 4.11 0.00 3.89 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 6 R 8.33 4.07 0.00 2.12 1.97 0.00 3.21 0.00 0.00 3.18 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.81 0.00 7 L 8.31 4.05 0.00 1.82 1.72 0.93 1.04 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 8 R 7.98 4.07 0.00 1.97 2.00 0.00 3.15 0.00 0.00 3.23 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.95 0.00 9 K 7.34 4.40 0.00 1.86 1.82 0.00 1.98 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.41 1.46 7.81 10 R 7.70 3.85 0.00 1.96 2.00 0.00 3.15 0.00 0.00 3.22 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.58 0.00 11 E 8.01 4.49 0.00 2.09 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 2.29 2.41 0.00 12 P 0.00 4.45 0.00 2.18 2.05 0.00 3.76 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 1.99 1.99 0.00 13 I 8.07 3.95 1.88 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 1.48 0.54 0.92 0.00 0.00 14 S 8.51 4.46 0.00 4.30 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 15 I 8.29 3.66 2.00 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.06 0.89 0.00 0.00 16 Y 8.56 4.14 0.00 2.99 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 17 D 8.15 4.36 0.00 2.87 2.72 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 18 K 8.00 4.04 0.00 1.91 1.94 0.00 1.58 0.00 0.00 1.75 0.00 0.00 3.06 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.62 1.42 7.81 19 I 7.28 4.12 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 1.61 0.49 0.90 0.00 0.00 20 G 8.10 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 0.00 0.00 0.00 21 G 8.24 2.69 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 0.00 0.00 0.00 22 H 8.71 4.13 0.00 3.61 3.41 0.00 5.87 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 23 E 8.15 3.98 0.00 2.04 1.98 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 2.44 2.42 0.00 24 A 7.52 3.95 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 I 7.70 3.65 2.00 0.00 0.00 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 1.51 0.74 1.04 0.00 0.00 26 E 8.27 4.00 0.00 2.27 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 2.37 2.35 0.00 27 V 7.72 3.61 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 1.00 0.00 0.00 28 V 7.93 3.56 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 0.77 0.00 0.00 0.91 0.00 0.00 29 V 8.26 3.85 2.34 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 1.42 0.00 0.00 1.29 0.00 0.00 30 E 8.43 4.06 0.00 2.21 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 2.35 2.42 0.00 31 D 8.16 4.32 0.00 2.98 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 32 F 8.71 4.19 0.00 2.96 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 33 F 8.24 3.62 0.00 3.14 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 34 V 7.75 3.55 2.24 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 1.01 0.00 0.00 1.03 0.00 0.00 35 R 7.52 3.74 0.00 1.84 1.77 0.00 3.36 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 1.64 1.78 0.00 36 V 7.44 3.40 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 0.74 0.00 0.00 0.09 0.00 0.00 37 L 7.77 4.10 0.00 1.65 1.69 0.84 0.76 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 38 A 7.67 4.39 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 39 D 7.50 4.61 0.00 2.84 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 40 D 8.63 4.58 0.00 2.83 2.81 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 41 Q 8.44 4.36 0.00 2.33 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.80 0.00 0.00 0.00 0.00 0.00 2.49 2.41 0.00 42 L 8.38 5.14 0.00 2.07 1.94 1.01 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 43 S 8.60 4.31 0.00 4.07 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 0.00 44 A 8.03 4.05 1.17 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 0.00 0.00 45 F 7.89 3.90 0.00 2.69 2.49 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 46 F 8.47 4.71 0.00 3.32 3.10 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 47 S 7.93 4.16 0.00 3.92 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 48 G 7.93 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 49 T 7.51 4.45 4.50 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 1.26 0.00 0.00 50 N 8.56 4.46 0.00 2.74 2.71 0.00 0.00 7.24 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 51 M 8.45 3.88 0.00 1.86 1.99 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.65 0.00 52 S 8.05 4.08 0.00 3.84 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 53 R 7.84 3.79 0.00 1.87 2.06 0.00 3.11 0.00 0.00 3.08 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.62 0.00 54 L 7.93 3.90 0.00 1.73 1.44 1.02 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 55 K 8.20 4.07 0.00 1.77 1.93 0.00 1.82 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 2.88 0.00 0.00 0.00 0.00 0.97 1.23 7.81 56 G 8.11 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 57 K 8.23 4.15 0.00 2.04 2.09 0.00 1.58 0.00 0.00 1.57 0.00 0.00 2.89 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.67 1.61 7.81 58 V 8.25 3.52 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 1.19 0.00 0.00 59 V 8.31 3.76 2.34 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 1.09 0.00 0.00 1.09 0.00 0.00 60 E 8.33 4.10 0.00 2.55 2.34 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 2.44 2.55 0.00 61 F 8.73 3.70 0.00 2.83 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 62 F 8.64 4.59 0.00 3.24 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 63 A 8.54 4.23 1.61 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 0.00 0.00 64 A 7.96 3.79 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 65 A 7.84 3.79 1.17 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 0.00 0.00 66 L 7.60 4.56 0.00 1.89 1.82 0.86 0.69 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 67 G 7.64 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 0.00 0.00 0.00 68 G 8.08 2.54 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 69 P 0.00 4.41 0.00 2.13 2.09 0.00 3.26 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 1.89 1.94 0.00 70 E 7.66 4.18 0.00 2.13 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 2.48 2.38 0.00 71 P 0.00 4.36 0.00 2.18 2.05 0.00 3.76 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 1.99 1.95 0.00 72 Y 8.53 4.56 0.00 3.05 2.96 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 73 T 8.59 4.24 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 1.24 0.00 0.00 74 G 5.48 3.78 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 0.00 0.00 0.00 0.00 0.00 0.00 75 A 8.16 4.50 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 76 P 0.00 4.59 0.00 2.23 2.06 0.00 3.77 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.25 0.00 77 M 8.74 4.04 0.00 1.96 2.12 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.34 0.00 78 K 7.95 4.40 0.00 1.84 1.83 0.00 1.78 0.00 0.00 1.72 0.00 0.00 2.92 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.52 1.37 7.81 79 Q 8.05 3.94 0.00 2.11 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.80 0.00 0.00 0.00 0.00 0.00 2.36 2.44 0.00 80 V 7.58 3.69 2.15 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 0.69 0.00 0.00 0.99 0.00 0.00 81 H 8.29 4.49 0.00 3.37 3.51 0.00 5.89 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 Q 7.64 4.06 0.00 2.10 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.63 0.00 0.00 0.00 0.00 0.00 2.42 2.50 0.00 83 G 8.98 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 0.00 0.00 0.00 84 R 7.98 4.25 0.00 2.05 2.08 0.00 3.23 0.00 0.00 3.14 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.68 0.00 85 G 7.95 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 I 7.28 4.11 2.03 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 0.69 0.92 0.84 0.00 0.00 87 T 8.53 4.81 4.29 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 1.33 0.00 0.00 88 M 8.42 4.04 0.00 2.16 2.08 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.65 0.00 89 H 8.29 4.12 0.00 3.27 3.25 0.00 5.92 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 90 H 7.81 4.19 0.00 3.33 3.13 0.00 5.87 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 F 8.59 4.02 0.00 3.16 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 92 S 8.80 4.23 0.00 4.07 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 93 L 7.91 3.91 0.00 1.86 1.70 0.93 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 94 V 7.78 3.63 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 1.20 0.00 0.00 0.94 0.00 0.00 95 A 8.02 3.90 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.34 3.61 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 0.00 0.00 0.00 97 H 8.21 4.31 0.00 3.42 3.34 0.00 5.63 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 L 8.36 3.75 0.00 1.17 1.61 0.08 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 99 A 8.15 3.91 1.32 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 0.00 0.00 0.00 100 D 8.49 4.29 0.00 2.87 2.75 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 0.00 101 A 8.23 4.24 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 0.00 102 L 8.19 3.86 0.00 1.75 1.64 0.73 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 103 T 8.24 3.82 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 0.00 104 A 8.13 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 0.00 105 A 7.61 4.36 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 0.00 106 G 7.89 3.78 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 0.00 0.00 0.00 0.00 0.00 0.00 107 V 7.41 3.66 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 0.74 0.00 0.00 0.90 0.00 0.00 108 P 0.00 4.36 0.00 2.19 1.94 0.00 3.63 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.06 0.00 109 S 8.83 4.12 0.00 4.02 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 0.00 110 E 8.13 3.92 0.00 2.01 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 2.39 2.39 0.00 111 T 7.92 3.98 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 1.17 0.00 0.00 112 I 7.62 3.62 1.96 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.66 0.84 0.00 0.00 113 T 8.07 3.83 4.39 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 1.20 0.00 0.00 114 E 8.09 3.94 0.00 2.18 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 2.29 2.34 0.00 115 I 7.83 3.71 1.91 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.59 0.70 0.00 0.00 116 L 8.41 4.09 0.00 1.81 1.73 0.89 0.80 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 0.00 117 G 7.89 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 0.00 0.00 0.00 118 V 7.22 3.81 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 0.93 0.00 0.00 0.99 0.00 0.00 119 I 8.04 4.13 1.91 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.78 1.04 0.00 0.00 120 A 8.56 4.26 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 0.00 121 P 0.00 4.27 0.00 2.19 2.11 0.00 3.72 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.18 0.00 122 L 8.40 4.13 0.00 1.99 1.82 1.26 0.81 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 0.00 123 A 7.62 3.14 0.27 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 0.00 124 V 7.00 3.41 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 0.84 0.00 0.00 0.86 0.00 0.00 125 D 8.16 4.51 0.00 2.85 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 0.00 126 V 7.55 3.67 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 0.98 0.00 0.00 0.76 0.00 0.00 127 T 7.31 4.46 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 1.20 0.00 0.00 *128 S 9.13 4.30 0.00 3.58 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 *129 G 8.39 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 * Residues marked with a * may have inaccurate shift predictions.