NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 N 4.8011 8.2827 118.1452 52.1643 38.9585 174.5312 2 L 3.7767 8.0308 119.0578 57.6257 41.8282 176.9328 3 Y 3.8843 8.7385 120.3508 60.8468 39.1803 177.6233 4 Q 3.8145 8.6972 119.3179 58.7635 28.7230 178.4498 5 F 4.3317 8.3439 121.8468 61.1730 39.4094 177.3097 6 K 3.4741 7.9024 118.2446 59.4213 31.8452 179.1053 7 N 4.3614 7.5404 116.3435 56.2962 38.3715 177.4426 8 M 4.1009 7.9250 120.2650 58.4945 32.0735 178.7974 9 I 3.5231 7.3534 119.8724 64.3631 37.0082 178.2824 10 E 4.3367 7.7647 117.9920 58.6812 29.2752 178.2869 11 C 4.4024 7.6861 118.3115 59.5665 43.9488 174.9440 12 T 4.0588 7.7792 108.9928 62.0840 70.4805 174.9693 13 V 4.5020 8.0915 121.1015 60.5283 31.3412 173.9670 14 P 4.2439 0.0000 0.0000 65.4487 31.6272 177.3156 15 A 4.1923 7.3434 118.5024 52.4060 18.5492 176.7873 *17 R 4.0527 7.7432 117.9627 57.5725 31.2828 174.4660 18 S 4.6417 8.2596 117.6776 57.0176 63.5423 175.1314 19 W 4.4978 9.0549 124.5316 59.5800 27.7257 178.4448 20 W 3.1882 6.9473 119.8623 59.2921 28.0883 177.8513 21 D 4.2621 8.0153 118.0776 56.0739 40.1855 177.4659 22 F 4.7335 7.8813 115.9080 57.2401 40.2025 176.2783 23 A 4.4573 8.0118 121.8038 54.0770 19.0976 177.0397 24 D 4.9861 7.7769 114.5445 53.2183 42.5020 172.1755 25 Y 4.9242 8.5206 122.3746 56.1656 42.8183 176.0099 26 G 3.8462 7.9979 115.6119 46.8205 0.0000 172.6514 27 C 4.4805 9.2580 115.2492 57.7196 40.9496 174.6481 28 Y 4.3424 8.5670 115.5166 58.0092 40.1816 175.1674 29 C 4.6228 8.4319 118.1951 58.3289 40.9174 172.3767 30 G 4.3744 8.4095 113.3128 45.5979 0.0000 173.0180 31 G 3.5914 8.7950 112.6228 44.8655 0.0000 173.2736 32 G 4.1099 8.8277 112.3174 43.7171 0.0000 172.1325 33 G 4.9269 7.0662 122.8169 45.0480 0.0000 171.1098 34 S 4.3474 6.4141 109.5644 58.5812 66.4486 176.7011 35 G 3.7868 8.7247 108.8840 45.0020 0.0000 172.1101 36 T 4.5078 8.1263 115.0056 61.3097 69.5575 173.3292 37 P 4.7477 0.0000 0.0000 63.2093 31.8417 176.7838 38 T 4.1257 8.9448 112.8695 64.1197 69.6366 173.4865 39 D 4.5643 7.5094 119.2773 51.8533 41.9342 175.1192 40 D 4.3516 8.8085 117.9088 57.8760 40.7497 178.3485 41 L 3.9200 7.9934 120.2531 58.3278 42.0717 178.3676 42 D 4.5376 8.8963 118.1229 57.5156 41.1568 178.4646 43 R 3.9128 8.1071 118.6027 59.0862 29.9847 178.3732 44 C 4.3891 8.1810 116.7422 60.3506 38.0647 175.4821 45 C 4.4320 8.2481 117.5878 59.7050 39.8639 176.0054 46 Q 3.6064 8.0474 121.5453 58.9780 28.4703 178.2987 47 V 3.4910 7.6638 119.3272 66.2130 31.5260 177.4697 48 H 3.9416 8.1546 117.8994 59.2977 29.7839 176.9997 49 D 4.2165 8.4818 121.1105 57.4709 40.6563 178.5765 50 N 4.3943 8.4436 117.2868 56.3541 38.5250 176.6487 51 C 4.2837 8.4301 120.2172 59.8911 41.9049 175.3237 52 Y 4.1601 7.9962 118.4184 61.1742 37.2059 178.0962 53 N 4.4290 8.0186 116.2954 56.3839 38.9140 177.2404 54 Q 4.1241 8.2185 119.3299 58.9456 28.8518 178.5657 55 A 4.0424 8.1326 121.7057 55.0678 18.1698 179.3111 56 Q 4.4037 7.8115 116.4224 57.5583 28.8547 177.8718 57 E 4.1725 7.8357 118.9851 57.1659 30.1052 176.9538 58 I 3.9711 7.3444 121.6431 60.4971 37.8643 175.4546 59 T 3.9497 8.5989 121.7689 65.3900 68.4920 174.0107 60 G 3.8038 8.8258 113.5981 46.2330 0.0000 173.0920 61 C 4.5757 8.1247 120.6515 54.8043 44.8022 172.9294 62 R 4.7098 8.1962 126.6956 53.3825 29.3629 174.2471 63 P 3.8398 0.0000 0.0000 65.3590 31.6519 179.3563 64 K 3.9524 7.8787 116.4742 58.1351 31.9641 178.2904 65 W 4.5162 7.2390 115.2752 56.1572 30.8415 176.0081 66 K 4.0472 8.1747 120.9783 56.4963 31.8676 176.0146 67 T 4.2529 8.4718 123.8105 62.6115 69.1277 173.6492 68 Y 4.8669 7.6001 124.0888 55.3639 40.9863 174.6060 69 T 4.9797 9.8398 117.2666 62.1045 70.6889 173.7577 70 Y 5.4112 8.6084 123.2001 55.9688 41.8005 173.6524 71 Q 4.2222 9.5172 119.8728 54.5720 33.1160 172.8961 72 C 5.3326 8.6669 124.4540 55.1892 46.4031 172.7963 73 T 4.6377 8.6578 121.9486 63.1576 72.6877 174.4751 74 Q 3.2218 9.8112 123.6368 57.1324 26.1643 174.9174 75 G 3.9422 8.1118 101.8845 45.9201 0.0000 172.5846 76 T 4.5430 7.9280 117.0240 61.2680 70.8928 172.4702 77 L 5.1966 8.4566 127.8228 53.7455 43.9874 175.5305 78 T 4.7711 9.1223 122.3126 62.1163 73.1476 172.0359 79 C 5.1218 8.7230 122.6046 55.5698 38.6278 173.9619 80 K 4.3197 8.9640 123.4783 55.6496 33.2756 177.8521 81 G 3.9138 8.5930 109.6542 46.3731 0.0000 173.8842 82 R 4.4703 7.6085 118.5855 55.8426 29.9810 175.3602 83 N 4.9945 7.8444 113.0794 50.9769 40.8089 175.1879 84 N 4.7301 8.3524 120.1248 51.8319 40.3948 175.8072 85 S 4.0575 8.5841 113.4696 61.9235 62.1597 176.6041 86 C 4.2098 8.2233 120.0847 59.6412 44.7395 175.1622 87 A 4.0050 9.0086 122.5092 55.1807 18.0081 179.4587 88 A 3.9015 8.5578 119.6426 55.4612 18.3993 180.1012 89 T 3.7182 7.7991 114.1021 67.1536 68.5228 177.0261 90 T 3.8129 7.8111 115.0091 65.0285 67.2860 175.4181 91 C 2.8765 7.9708 120.6206 59.1864 44.6794 175.1304 92 D 4.1255 7.8115 119.5137 57.2970 40.8924 177.3920 93 C 4.1592 8.1615 117.0631 60.2334 41.4458 175.9294 94 D 3.8995 8.1402 120.4450 57.1855 40.3893 178.8256 95 R 3.7783 8.1214 119.5099 59.5285 30.1037 178.5861 96 L 3.9320 7.9929 118.5154 57.5780 41.5329 179.4713 97 A 3.6856 7.7251 120.1697 54.8361 18.1902 179.4894 98 A 3.4594 7.8434 119.3302 55.2002 18.1794 179.9930 99 I 3.6243 7.3668 117.3238 64.4995 37.4180 177.5077 100 C 4.4301 8.1121 119.3523 59.8107 42.1706 175.5723 101 F 4.2793 8.6593 119.5519 60.7145 38.1980 177.5430 102 A 4.2660 7.9718 119.1715 54.0503 18.2425 178.2618 103 G 3.8978 7.8018 103.4272 45.2223 0.0000 173.1636 104 A 4.7244 7.3799 122.3834 49.4907 20.6875 175.5722 105 P 4.3733 0.0000 0.0000 62.6126 32.0543 175.3974 106 Y 4.1648 8.5367 123.4147 55.8908 39.6422 174.4887 107 N 4.8168 8.4626 127.3882 51.8138 38.8805 174.9216 108 D 4.6668 8.8797 127.2077 57.5219 41.0652 178.3902 109 T 4.2052 8.2396 111.4799 62.8528 67.5909 174.3425 110 N 4.5332 8.1361 117.6359 53.5232 39.2779 173.6038 111 Y 4.2528 7.3640 120.3714 58.2574 39.9831 174.7562 112 N 3.9559 7.8660 125.2327 54.3316 37.6079 173.1180 113 I 4.0034 6.8285 111.1114 59.7183 39.9003 176.7799 114 D 4.4459 8.1856 120.0675 53.4977 40.6268 176.3430 115 L 3.8927 8.2457 127.4745 57.7068 41.6272 179.2342 116 K 3.9081 8.1256 117.2613 58.8834 32.2117 177.6795 117 A 4.4198 8.0199 119.0786 52.8118 19.6769 178.0828 118 R 4.5418 7.9998 113.4392 55.8142 31.7885 175.4970 119 C 4.9881 8.2167 116.7564 56.5465 41.1420 174.0275 120 Q 4.1867 8.1080 123.5322 56.1547 28.4978 176.0403 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 1 N 8.28 4.80 0.00 2.96 3.10 0.00 0.00 5.75 5.79 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 2 L 8.03 3.78 0.00 1.62 1.56 0.87 0.63 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 3 Y 8.74 3.88 0.00 2.97 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 4 Q 8.70 3.81 0.00 1.89 1.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.58 0.00 0.00 0.00 0.00 0.00 2.48 2.52 0.00 5 F 8.34 4.33 0.00 3.19 3.15 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 6 K 7.90 3.47 0.00 1.41 1.02 0.00 1.01 0.00 0.00 0.61 0.00 0.00 2.13 0.00 0.00 2.37 0.00 0.00 0.00 0.00 0.37 1.21 7.81 7 N 7.54 4.36 0.00 2.73 2.83 0.00 0.00 7.05 7.23 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 8 M 7.92 4.10 0.00 1.99 2.19 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.52 0.00 9 I 7.35 3.52 1.82 0.00 0.00 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 -0.07 0.78 0.00 0.00 10 E 7.76 4.34 0.00 2.07 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 2.39 2.54 0.00 11 C 7.69 4.40 0.00 3.15 3.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 T 7.78 4.06 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 13 V 8.09 4.50 2.25 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 1.19 0.00 0.00 0.92 0.00 0.00 14 P 0.00 4.24 0.00 2.09 2.12 0.00 3.74 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.27 0.00 15 A 7.34 4.19 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *17 R 7.74 4.05 0.00 1.83 1.97 0.00 2.89 0.00 0.00 2.25 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.30 0.00 18 S 8.26 4.64 0.00 3.95 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 19 W 9.05 4.50 0.00 3.59 3.26 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 20 W 6.95 3.19 0.00 2.97 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 21 D 8.02 4.26 0.00 1.93 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 0.00 0.00 0.00 22 F 7.88 4.73 0.00 3.21 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 23 A 8.01 4.46 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 24 D 7.78 4.99 0.00 2.68 2.27 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 25 Y 8.52 4.92 0.00 3.07 2.67 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 26 G 8.00 3.85 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 0.00 0.00 0.00 27 C 9.26 4.48 0.00 3.09 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 28 Y 8.57 4.34 0.00 3.26 3.22 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 0.00 29 C 8.43 4.62 0.00 3.46 3.46 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 30 G 8.41 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 0.00 0.00 0.00 31 G 8.79 3.59 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 0.00 0.00 0.00 32 G 8.83 4.11 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 0.00 0.00 0.00 33 G 7.07 4.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 S 6.41 4.35 0.00 3.86 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 35 G 8.72 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 36 T 8.13 4.51 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 1.25 0.00 0.00 37 P 0.00 4.75 0.00 2.05 2.01 0.00 3.71 0.00 0.00 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.88 0.00 38 T 8.94 4.13 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 1.18 0.00 0.00 39 D 7.51 4.56 0.00 2.92 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 40 D 8.81 4.35 0.00 2.74 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 41 L 7.99 3.92 0.00 1.60 1.65 0.54 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 42 D 8.90 4.54 0.00 3.18 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 R 8.11 3.91 0.00 2.11 1.94 0.00 3.19 0.00 0.00 3.16 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.83 0.00 44 C 8.18 4.39 0.00 3.51 3.52 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 45 C 8.25 4.43 0.00 3.33 3.44 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 46 Q 8.05 3.61 0.00 1.10 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.80 0.00 0.00 0.00 0.00 0.00 1.99 1.26 0.00 47 V 7.66 3.49 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 0.98 0.00 0.00 0.90 0.00 0.00 48 H 8.15 3.94 0.00 3.21 3.37 0.00 5.64 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 49 D 8.48 4.22 0.00 2.94 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 50 N 8.44 4.39 0.00 2.83 2.85 0.00 0.00 6.67 8.51 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 51 C 8.43 4.28 0.00 3.12 3.18 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 52 Y 8.00 4.16 0.00 3.08 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 53 N 8.02 4.43 0.00 2.95 2.92 0.00 0.00 7.10 7.40 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 54 Q 8.22 4.12 0.00 2.28 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.79 0.00 0.00 0.00 0.00 0.00 2.53 2.52 0.00 55 A 8.13 4.04 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 Q 7.81 4.40 0.00 2.21 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.93 0.00 0.00 0.00 0.00 0.00 2.37 2.56 0.00 57 E 7.84 4.17 0.00 2.05 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 2.35 2.63 0.00 58 I 7.34 3.97 1.99 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 1.29 0.68 0.91 0.00 0.00 59 T 8.60 3.95 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 60 G 8.83 3.80 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 0.00 0.00 0.00 61 C 8.12 4.58 0.00 3.02 3.15 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 62 R 8.20 4.71 0.00 2.03 2.10 0.00 3.19 0.00 0.00 3.30 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.63 0.00 63 P 0.00 3.84 0.00 1.25 0.49 0.00 3.49 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.84 0.00 64 K 7.88 3.95 0.00 0.79 0.86 0.00 1.50 0.00 0.00 1.89 0.00 0.00 3.13 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.39 1.17 7.81 65 W 7.24 4.52 0.00 3.49 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 66 K 8.17 4.05 0.00 1.80 1.74 0.00 1.71 0.00 0.00 1.73 0.00 0.00 3.13 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.50 1.53 7.81 67 T 8.47 4.25 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 1.18 0.00 0.00 68 Y 7.60 4.87 0.00 3.15 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 69 T 9.84 4.98 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 1.25 0.00 0.00 70 Y 8.61 5.41 0.00 3.16 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 71 Q 9.52 4.22 0.00 1.97 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.59 6.79 0.00 0.00 0.00 0.00 0.00 2.20 2.19 0.00 72 C 8.67 5.33 0.00 3.06 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 73 T 8.66 4.64 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 74 Q 9.81 3.22 0.00 2.11 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.03 0.00 0.00 0.00 0.00 0.00 2.28 2.33 0.00 75 G 8.11 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 76 T 7.93 4.54 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 1.21 0.00 0.00 77 L 8.46 5.20 0.00 1.64 1.55 0.89 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 78 T 9.12 4.77 4.26 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 1.22 0.00 0.00 79 C 8.72 5.12 0.00 2.80 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 80 K 8.96 4.32 0.00 1.77 1.74 0.00 1.68 0.00 0.00 1.66 0.00 0.00 2.81 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.44 7.81 81 G 8.59 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 0.00 0.00 0.00 82 R 7.61 4.47 0.00 1.78 1.93 0.00 3.42 0.00 0.00 3.27 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.75 0.00 83 N 7.84 4.99 0.00 2.75 2.81 0.00 0.00 7.12 8.00 0.00 0.00 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 N 8.35 4.73 0.00 3.00 2.99 0.00 0.00 5.83 7.64 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 85 S 8.58 4.06 0.00 3.90 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 86 C 8.22 4.21 0.00 3.03 3.22 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 0.00 87 A 9.01 4.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 A 8.56 3.90 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 89 T 7.80 3.72 4.35 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 1.18 0.00 0.00 90 T 7.81 3.81 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 1.20 0.00 0.00 91 C 7.97 2.88 0.00 2.36 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 92 D 7.81 4.13 0.00 2.98 2.56 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 93 C 8.16 4.16 0.00 3.25 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 94 D 8.14 3.90 0.00 2.59 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 95 R 8.12 3.78 0.00 1.76 1.80 0.00 3.22 0.00 0.00 3.12 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.63 0.00 96 L 7.99 3.93 0.00 1.64 1.63 0.87 0.52 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 97 A 7.73 3.69 0.97 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 0.00 0.00 98 A 7.84 3.46 1.22 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 0.00 0.00 0.00 99 I 7.37 3.62 1.95 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 1.37 0.67 0.89 0.00 0.00 100 C 8.11 4.43 0.00 3.17 3.27 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 0.00 101 F 8.66 4.28 0.00 2.90 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 0.00 102 A 7.97 4.27 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 0.00 103 G 7.80 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 A 7.38 4.72 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 P 0.00 4.37 0.00 2.10 2.04 0.00 3.69 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.11 0.00 106 Y 8.54 4.16 0.00 2.88 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 0.00 107 N 8.46 4.82 0.00 2.88 2.72 0.00 0.00 6.76 8.65 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 D 8.88 4.67 0.00 2.81 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 0.00 109 T 8.24 4.21 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 1.16 0.00 0.00 110 N 8.14 4.53 0.00 2.04 1.82 0.00 0.00 6.57 7.02 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 0.00 111 Y 7.36 4.25 0.00 3.00 3.02 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 0.00 112 N 7.87 3.96 0.00 1.80 2.38 0.00 0.00 7.19 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 0.00 113 I 6.83 4.00 1.76 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 1.13 0.62 0.77 0.00 0.00 114 D 8.19 4.45 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 0.00 115 L 8.25 3.89 0.00 1.67 1.64 0.87 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 116 K 8.13 3.91 0.00 1.72 1.81 0.00 1.75 0.00 0.00 1.69 0.00 0.00 3.03 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.40 1.49 7.81 117 A 8.02 4.42 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 R 8.00 4.54 0.00 1.86 1.89 0.00 3.07 0.00 0.00 3.19 7.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.58 0.00 119 C 8.22 4.99 0.00 3.00 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 0.00 120 Q 8.11 4.19 0.00 2.02 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.65 0.00 0.00 0.00 0.00 0.00 2.29 2.39 0.00 * Residues marked with a * may have inaccurate shift predictions.