NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 N 4.7981 8.2833 118.1532 52.1263 38.9362 174.9642 2 L 3.8191 8.2941 118.5064 57.2911 41.3665 178.0407 3 Y 3.9543 8.8105 120.3329 60.8291 39.0544 177.8613 4 Q 3.8207 8.5702 119.0856 58.6320 28.7490 178.2662 5 F 4.3576 8.2678 121.7897 61.2569 39.4445 176.8550 6 K 3.4185 7.9383 119.2625 59.6658 31.8122 178.4046 7 N 4.3943 7.7457 116.4174 56.4119 38.3885 177.1654 8 M 4.1000 8.2611 120.4899 58.5635 32.0692 178.9487 9 I 3.5413 7.4828 119.6526 64.5022 37.4042 178.5470 10 Q 4.2284 8.4910 119.2009 58.9643 28.2331 177.9568 11 C 4.4556 8.1439 118.8773 58.7362 43.8704 174.8360 12 T 4.1084 7.7960 109.8452 61.6995 70.3812 175.1073 13 V 4.4718 8.0204 121.6784 60.5003 31.1328 174.0336 14 P 4.5939 0.0000 0.0000 64.1172 32.3351 178.8618 15 S 4.0717 7.6043 114.8115 60.9227 63.1684 174.4215 *17 R 4.8816 7.5322 117.3820 55.4893 31.1386 174.9755 18 S 4.2206 8.0820 114.7811 57.7958 63.0848 175.3003 19 W 4.4974 9.0302 124.7676 59.7523 27.8993 177.9617 20 A 3.0922 6.5466 120.0059 53.5670 17.4416 178.7712 21 D 4.0730 7.5521 117.0313 56.3644 40.7943 177.6481 22 F 4.6259 7.9655 115.6756 57.3105 39.7065 176.1732 23 A 4.5968 7.9050 121.4522 53.1786 19.1808 176.9946 24 D 5.1206 7.6436 114.7096 53.0173 42.4229 172.1497 25 Y 4.6657 8.8173 122.8458 56.1046 42.5179 176.4037 26 G 4.0195 8.0874 116.4107 45.7138 0.0000 172.2670 27 C 4.3505 9.5617 115.1119 58.5108 40.6120 174.7526 28 Y 4.4592 8.6947 115.2754 57.8907 39.7997 175.0530 29 C 4.7005 8.2823 118.4461 59.4755 38.8545 170.8870 30 G 4.2527 9.0441 112.5233 44.4778 0.0000 173.4231 31 K 4.0573 9.0600 118.1739 59.4298 32.3367 177.7972 32 G 3.6935 6.9814 105.3312 45.1404 0.0000 174.3199 33 G 4.1862 8.0896 110.7788 43.3232 0.0000 171.2757 34 S 4.4272 6.9937 111.3034 57.3575 66.4134 173.9977 35 G 3.8869 8.7063 107.2478 44.8833 0.0000 172.6103 36 T 4.3663 8.0251 115.0696 61.9193 69.1949 173.6003 37 P 4.8151 0.0000 0.0000 63.0150 31.9282 177.0680 38 V 3.8720 8.7195 115.0786 63.4627 32.2314 175.1936 39 D 4.5427 7.4556 117.2301 51.6211 41.7599 175.7588 40 D 4.3844 8.6047 118.0893 57.5372 40.7130 178.6727 41 L 3.9858 7.9880 120.4109 58.2480 42.1039 178.3891 42 D 4.5738 8.9505 118.2181 57.3364 41.1274 178.3577 43 R 3.8603 8.2121 118.8284 59.4210 30.0646 178.0907 44 C 4.2835 8.3265 116.2464 60.6309 39.1280 175.7640 45 C 4.4546 8.3263 117.4193 59.6975 40.0189 175.9772 46 Q 3.4324 8.2629 121.8182 59.3384 28.4796 178.3945 47 T 3.7802 7.9372 116.7968 66.7510 68.3654 176.1685 48 H 3.9330 8.2402 120.2052 59.1997 29.8920 177.0738 49 D 4.2536 8.4035 121.0060 57.6021 40.7467 178.6081 50 N 4.4060 8.3970 117.1210 56.2869 38.3589 176.7363 51 C 4.2843 8.4309 120.4610 59.8491 44.7539 175.1437 52 Y 4.2111 8.1603 118.5008 61.4100 37.2430 178.5429 53 N 4.6780 8.1455 117.5604 55.6657 38.8836 176.8589 54 E 4.0720 8.4594 120.7473 59.1948 29.7641 178.7161 55 A 4.0299 8.3771 121.0803 55.0715 17.8547 179.2430 56 E 4.1832 8.3629 118.6242 58.9811 29.2532 179.1807 57 N 4.4668 7.9598 115.2804 54.5574 39.1249 175.5527 58 I 3.9732 7.4353 122.9563 60.3681 37.8886 175.5913 59 S 4.3220 8.5276 120.2047 59.6155 63.2397 174.5463 60 G 3.7977 8.8666 111.9743 45.7720 0.0000 173.1080 61 C 4.6042 8.0896 120.8973 55.0735 44.4279 172.7960 62 R 4.7013 8.1442 126.0377 53.1730 30.6047 173.8606 63 P 3.9477 0.0000 0.0000 65.4698 31.7184 177.9141 64 Y 4.2412 7.9023 114.8865 59.8009 37.9462 176.9775 65 F 4.6518 7.9342 116.4338 57.0269 41.2734 175.6103 66 K 4.0320 8.0524 122.2117 56.3838 32.2657 176.0104 67 T 4.1949 8.4998 124.0676 62.8609 68.5363 173.8738 68 Y 4.7273 7.5502 126.0912 55.4362 40.6905 174.1068 69 S 5.1329 9.5133 114.8876 56.9766 64.3858 172.8406 70 Y 5.3481 8.5251 123.6381 56.0986 41.1564 173.3052 71 E 4.4041 9.4337 120.2185 54.4190 33.6579 173.4155 72 C 5.5215 8.5976 125.0721 55.1907 46.1059 173.2477 73 T 4.6444 8.8082 116.3239 61.5069 71.4306 173.9933 74 Q 3.4810 9.7146 123.4784 57.1244 26.0921 174.6679 75 G 3.9926 8.7447 104.4587 45.5452 0.0000 174.0221 76 T 4.6260 7.9228 116.3569 61.4416 71.4776 172.5950 77 L 5.2762 8.4071 125.1490 53.6652 43.6095 176.0287 78 T 4.6754 8.9861 119.7429 61.9595 72.3298 172.2216 79 C 4.9597 8.8094 123.6782 55.9760 39.7165 173.8885 80 K 4.4158 8.8965 123.6381 55.4936 32.6418 178.6355 81 G 3.6941 8.7652 110.6590 48.2952 0.0000 174.9815 82 D 4.6004 7.4261 118.1499 54.2392 39.6554 176.1560 83 N 4.5704 7.5971 118.4670 52.8145 39.3047 175.5839 84 N 4.6851 8.5645 120.8304 52.1535 40.0212 175.7566 85 A 3.9979 8.4105 121.0439 55.3711 18.2614 180.1703 86 C 4.1532 8.2031 116.2008 59.8955 41.3452 175.3764 87 A 3.9851 8.7562 122.5262 55.2872 17.8874 179.5078 88 A 3.9349 8.5271 119.5976 55.1682 18.3392 180.1038 89 S 3.9760 8.0985 113.6533 61.7942 63.0148 177.0261 90 V 3.5362 7.9729 121.1722 66.1661 31.1956 177.1573 91 C 3.0161 8.2112 118.5534 59.2190 44.0152 175.0621 92 D 4.1228 7.9936 119.6929 57.3030 40.8022 177.3461 93 C 4.1215 8.3401 117.3917 60.3726 39.5202 176.0584 94 D 3.7939 7.9548 120.0847 57.0185 40.3784 178.8285 95 R 3.7962 8.1267 119.5758 59.5556 30.0755 178.6584 96 L 3.9481 8.0461 118.6445 57.5350 41.4836 179.4975 97 A 3.7029 7.8338 120.6148 54.9200 18.0727 179.4504 98 A 3.4174 7.7960 118.4590 55.1524 18.7846 179.7103 99 I 3.7563 7.6524 118.2272 64.5997 37.3155 177.7265 100 C 4.2721 8.2666 119.5067 59.8700 37.8447 175.5935 101 F 4.3068 8.5618 119.5064 60.6914 38.1649 177.5425 102 A 4.2208 7.8443 119.3218 54.3921 18.2939 178.9583 103 G 3.8303 7.8038 100.9805 44.1526 0.0000 173.4013 104 A 4.7998 7.1107 123.7745 49.4137 20.9544 175.3188 105 P 4.3542 0.0000 0.0000 62.7563 32.0226 175.3884 106 Y 4.1102 8.5007 123.1970 55.8135 39.8054 174.3102 107 N 4.8294 8.6275 126.9928 51.8714 39.4655 175.0841 108 D 4.6233 8.9176 126.6915 57.4146 41.1731 178.9138 109 A 4.0064 8.3180 120.6355 54.5040 18.6617 177.5340 110 N 4.3838 8.1137 112.3503 53.0611 39.1712 174.3324 111 Y 4.3366 7.3924 121.2463 58.4358 39.5722 174.9634 112 N 4.1001 8.2797 125.9460 53.2777 37.7314 173.7386 113 I 3.8386 7.0551 109.7146 60.2834 39.0998 176.5510 114 D 4.4807 8.2104 120.6181 53.2553 40.5662 176.4415 115 L 3.8789 8.1999 127.2221 57.4839 41.5990 178.9765 116 K 3.7916 8.0986 116.4862 59.7211 32.0921 178.5124 117 A 4.2241 7.8994 118.5000 53.8458 18.7937 178.7515 118 R 4.5245 8.0728 113.7183 56.1138 31.1642 175.9013 119 C 5.0122 7.8027 115.8925 56.5248 41.5132 173.8169 120 N 4.5091 8.3084 122.6909 53.6813 38.1443 175.1374 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 3.05 3.13 0.00 0.00 6.13 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 8.29 3.82 0.00 1.54 1.69 0.87 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 3 Y 8.81 3.95 0.00 2.93 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 4 Q 8.57 3.82 0.00 1.83 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.56 0.00 0.00 0.00 0.00 0.00 2.46 2.49 0.00 5 F 8.27 4.36 0.00 3.20 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 6 K 7.94 3.42 0.00 1.17 1.54 0.00 1.07 0.00 0.00 0.61 0.00 0.00 2.13 0.00 0.00 2.34 0.00 0.00 0.00 0.00 0.64 0.21 7.81 7 N 7.75 4.39 0.00 2.77 2.83 0.00 0.00 7.06 7.27 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 8 M 8.26 4.10 0.00 2.02 2.29 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.64 0.00 9 I 7.48 3.54 1.85 0.00 0.00 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 -0.09 0.83 0.00 0.00 10 Q 8.49 4.23 0.00 2.14 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.78 0.00 0.00 0.00 0.00 0.00 2.49 2.51 0.00 11 C 8.14 4.46 0.00 3.09 3.32 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 12 T 7.80 4.11 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 1.28 0.00 0.00 13 V 8.02 4.47 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 1.19 0.00 0.00 0.89 0.00 0.00 14 P 0.00 4.59 0.00 2.23 2.18 0.00 3.45 0.00 0.00 4.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.92 0.00 15 S 7.60 4.07 0.00 4.06 4.17 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 *17 R 7.53 4.88 0.00 1.85 1.79 0.00 3.03 0.00 0.00 3.38 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.61 0.00 18 S 8.08 4.22 0.00 3.70 3.47 0.00 0.00 0.00 0.00 0.00 0.00 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 9.03 4.50 0.00 3.69 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 20 A 6.55 3.09 0.42 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 21 D 7.55 4.07 0.00 2.00 1.75 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 22 F 7.97 4.63 0.00 3.20 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 23 A 7.91 4.60 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.64 5.12 0.00 2.66 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 0.00 0.00 0.00 0.00 25 Y 8.82 4.67 0.00 2.98 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 26 G 8.09 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 0.00 0.00 0.00 27 C 9.56 4.35 0.00 3.02 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 28 Y 8.69 4.46 0.00 3.27 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 29 C 8.28 4.70 0.00 3.44 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 9.04 4.25 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 0.00 31 K 9.06 4.06 0.00 1.80 1.98 0.00 1.80 0.00 0.00 1.78 0.00 0.00 3.05 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.57 1.54 7.81 32 G 6.98 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 0.00 0.00 0.00 33 G 8.09 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 0.00 0.00 0.00 0.00 34 S 6.99 4.43 0.00 3.92 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 35 G 8.71 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 0.00 0.00 0.00 36 T 8.03 4.37 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 4.82 0.00 2.08 2.05 0.00 3.72 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.96 0.00 38 V 8.72 3.87 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 0.69 0.00 0.00 0.93 0.00 0.00 39 D 7.46 4.54 0.00 2.89 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 40 D 8.60 4.38 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 41 L 7.99 3.99 0.00 1.77 1.72 0.60 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 42 D 8.95 4.57 0.00 3.17 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 43 R 8.21 3.86 0.00 2.11 1.96 0.00 3.21 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.94 0.00 44 C 8.33 4.28 0.00 3.46 3.43 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 0.00 45 C 8.33 4.45 0.00 3.40 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 46 Q 8.26 3.43 0.00 1.14 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.80 0.00 0.00 0.00 0.00 0.00 1.95 1.16 0.00 47 T 7.94 3.78 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 1.17 0.00 0.00 48 H 8.24 3.93 0.00 3.19 3.43 0.00 5.59 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 8.40 4.25 0.00 2.97 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 50 N 8.40 4.41 0.00 2.92 2.86 0.00 0.00 6.72 8.52 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 51 C 8.43 4.28 0.00 3.07 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 8.16 4.21 0.00 3.14 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 53 N 8.15 4.68 0.00 2.91 2.92 0.00 0.00 6.91 6.94 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 54 E 8.46 4.07 0.00 2.21 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 0.00 2.30 2.37 0.00 55 A 8.38 4.03 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 56 E 8.36 4.18 0.00 2.21 2.02 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 2.30 2.18 0.00 57 N 7.96 4.47 0.00 2.87 2.88 0.00 0.00 7.04 7.48 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 58 I 7.44 3.97 1.96 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 1.35 0.63 0.91 0.00 0.00 59 S 8.53 4.32 0.00 3.97 3.88 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 60 G 8.87 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 8.09 4.60 0.00 3.01 3.14 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 62 R 8.14 4.70 0.00 1.97 2.01 0.00 3.12 0.00 0.00 3.28 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.61 0.00 63 P 0.00 3.95 0.00 0.99 0.68 0.00 3.61 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 2.01 1.85 0.00 64 Y 7.90 4.24 0.00 2.14 2.21 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 65 F 7.93 4.65 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 66 K 8.05 4.03 0.00 1.80 1.76 0.00 1.69 0.00 0.00 1.74 0.00 0.00 3.11 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.49 1.61 7.81 67 T 8.50 4.19 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 68 Y 7.55 4.73 0.00 3.17 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 69 S 9.51 5.13 0.00 3.95 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 70 Y 8.53 5.35 0.00 3.20 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 71 E 9.43 4.40 0.00 1.91 1.72 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 2.14 2.14 0.00 72 C 8.60 5.52 0.00 3.06 2.93 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 73 T 8.81 4.64 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 1.22 0.00 0.00 74 Q 9.71 3.48 0.00 2.22 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.75 0.00 0.00 0.00 0.00 0.00 2.26 2.33 0.00 75 G 8.74 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 76 T 7.92 4.63 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 1.21 0.00 0.00 77 L 8.41 5.28 0.00 1.53 1.64 0.91 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 78 T 8.99 4.68 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 8.81 4.96 0.00 2.81 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 8.90 4.42 0.00 1.94 1.84 0.00 1.69 0.00 0.00 1.67 0.00 0.00 2.81 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.46 1.43 7.81 81 G 8.77 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 0.00 0.00 0.00 82 D 7.43 4.60 0.00 2.95 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 83 N 7.60 4.57 0.00 2.88 2.90 0.00 0.00 6.95 7.88 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 84 N 8.56 4.69 0.00 3.00 3.00 0.00 0.00 6.15 7.51 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 85 A 8.41 4.00 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 86 C 8.20 4.15 0.00 3.00 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 87 A 8.76 3.99 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 88 A 8.53 3.93 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 89 S 8.10 3.98 0.00 4.00 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 90 V 7.97 3.54 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 1.00 0.00 0.00 0.84 0.00 0.00 91 C 8.21 3.02 0.00 2.19 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 92 D 7.99 4.12 0.00 2.90 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 93 C 8.34 4.12 0.00 3.22 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 94 D 7.95 3.79 0.00 2.65 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 95 R 8.13 3.80 0.00 1.80 1.98 0.00 3.20 0.00 0.00 3.13 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.64 0.00 96 L 8.05 3.95 0.00 1.64 1.64 0.94 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 97 A 7.83 3.70 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.80 3.42 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 99 I 7.65 3.76 1.95 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 1.37 1.03 0.89 0.00 0.00 100 C 8.27 4.27 0.00 3.12 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 8.56 4.31 0.00 2.90 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 0.00 102 A 7.84 4.22 1.37 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 0.00 103 G 7.80 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 0.00 104 A 7.11 4.80 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 0.00 105 P 0.00 4.35 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 8.50 4.11 0.00 2.85 2.78 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 0.00 107 N 8.63 4.83 0.00 2.81 2.84 0.00 0.00 6.76 7.93 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 0.00 108 D 8.92 4.62 0.00 2.87 2.78 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 0.00 109 A 8.32 4.01 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 0.00 110 N 8.11 4.38 0.00 2.28 1.74 0.00 0.00 6.48 7.04 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 0.00 111 Y 7.39 4.34 0.00 2.93 3.03 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 0.00 112 N 8.28 4.10 0.00 1.78 2.46 0.00 0.00 7.19 7.56 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 0.00 113 I 7.06 3.84 1.75 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 1.21 0.58 0.73 0.00 0.00 114 D 8.21 4.48 0.00 2.68 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 0.00 115 L 8.20 3.88 0.00 1.67 1.63 0.87 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 116 K 8.10 3.79 0.00 1.83 1.87 0.00 1.72 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 1.43 1.50 7.81 117 A 7.90 4.22 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 8.07 4.52 0.00 1.82 1.90 0.00 3.06 0.00 0.00 3.16 7.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.59 0.00 119 C 7.80 5.01 0.00 3.00 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 0.00 120 N 8.31 4.51 0.00 2.70 2.72 0.00 0.00 6.97 7.56 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 * Residues marked with a * may have inaccurate shift predictions.