NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 10 A 4.3687 8.1233 123.5869 52.4233 20.6009 179.0802 11 S 3.9702 8.0230 111.5402 60.6036 62.8221 174.6325 12 L 4.0664 8.9335 123.9216 58.3841 42.0667 178.7646 13 I 3.6581 7.6721 118.8177 64.3965 37.1738 178.1024 14 E 3.9493 8.0547 119.1421 59.6564 29.3015 179.1612 15 D 4.3934 9.2158 119.6170 57.5889 40.9994 179.1008 16 S 4.8362 8.1168 116.9166 61.2840 62.9408 176.9010 17 I 4.0799 7.9141 124.0159 63.6261 36.5720 178.7148 18 V 3.7120 7.7029 118.8922 65.5426 31.5395 176.9858 19 D 4.6700 8.3463 116.2398 53.2528 39.8486 177.3044 20 G 3.9694 7.6334 108.1578 45.7813 0.0000 174.8236 21 T 3.9940 8.8100 110.7847 63.1633 68.7832 174.0718 22 L 5.0859 7.8691 122.5070 53.0379 44.4356 176.3923 23 S 4.5896 9.3538 120.1340 56.5421 64.7386 173.7079 24 I 3.8896 7.9833 122.4843 63.0125 37.1652 176.5291 25 D 4.8025 9.5135 123.6292 54.8125 39.3228 173.9585 26 Q 4.4397 7.6937 121.1569 54.7876 30.0371 175.4771 27 R 3.6178 8.0948 119.9480 55.6810 30.3080 176.3402 28 V 3.9377 7.3954 118.9255 61.0316 32.7477 174.1093 29 P 4.3695 0.0000 0.0000 61.9778 32.0430 177.3360 30 S 4.2985 8.2960 115.7999 58.5415 64.8653 175.5193 31 T 3.8994 8.3976 113.5662 65.0553 68.3612 176.3624 32 N 4.2689 8.0655 118.9560 56.0435 38.5746 176.7784 33 E 3.9195 8.1426 120.6749 59.2703 29.8054 178.7988 34 L 3.9786 8.0192 118.7763 57.7960 41.6231 179.3375 35 A 4.0485 8.7297 121.0068 55.1935 18.1813 179.6079 36 A 3.9408 8.5092 119.6968 55.0665 18.2339 179.4912 37 F 4.1075 8.2034 118.2689 61.9502 39.6652 176.7090 38 H 4.2984 8.2618 112.3554 55.4312 29.6992 175.1464 39 R 3.8054 7.5996 119.3939 57.4354 27.5343 173.9991 40 I 4.6711 7.9212 109.9482 58.6266 41.4974 174.4733 41 N 4.5527 8.4649 118.6208 52.4306 39.4709 173.7086 42 P 4.2619 0.0000 0.0000 66.3027 31.0280 178.4643 43 A 3.9727 9.4631 121.4552 55.2544 18.3713 179.7774 44 T 3.8286 8.1648 114.1064 66.6956 68.5358 176.8504 45 A 4.0371 7.9614 122.3044 55.0219 18.3668 179.1567 46 R 3.8191 8.2102 117.7799 59.8256 30.1531 178.5602 47 N 4.5954 7.9740 118.0469 55.1236 37.0895 177.3371 48 G 3.6056 7.9330 108.2429 47.7230 0.0000 175.7810 49 L 4.0673 7.9921 121.3132 57.5971 41.3646 179.5963 50 T 3.8629 8.1742 116.2754 66.7428 68.4328 176.5251 51 L 4.0170 8.3140 121.1647 57.8699 41.5180 179.6839 52 L 4.0380 7.6904 119.0903 57.5424 41.4210 179.7405 53 V 4.1895 7.6668 119.6509 65.5362 31.3005 177.6897 54 E 3.9516 8.1185 116.8942 59.6649 29.5338 179.2812 55 A 4.1940 7.8946 118.4202 53.3535 18.3923 178.4814 56 G 3.9564 8.0764 105.3099 45.5427 0.0000 174.6196 57 I 4.0806 8.1119 122.7282 63.2058 38.4780 175.8756 58 L 5.5132 7.9399 120.0288 53.0107 46.1038 175.0623 59 Y 5.4281 8.6679 118.3386 55.3126 41.3882 174.4606 60 K 5.0609 8.8861 118.3423 55.1739 36.0048 175.3949 61 K 4.4777 8.9218 121.6616 54.2611 33.5394 175.9794 62 R 3.9472 8.7897 123.9597 58.1026 29.9988 176.3329 63 G 4.0006 9.0034 112.1998 46.0953 0.0000 173.3320 64 I 4.4282 9.4879 120.0730 61.8674 40.7141 174.9029 65 G 4.0034 8.1251 108.5322 44.7927 0.0000 175.5176 *67 F 4.5319 8.5647 122.4923 56.5132 40.9469 173.3389 68 V 3.9891 8.2436 121.5802 62.8906 32.4266 175.5079 69 S 5.0416 9.1073 123.1797 58.0530 63.2790 174.7990 70 A 4.2760 8.8729 127.7094 54.0666 18.6052 178.3054 71 Q 4.2931 8.3606 114.6309 56.8281 29.9661 177.7300 72 A 4.0209 8.0476 120.6926 54.8959 18.2186 177.5202 73 P 4.1501 0.0000 0.0000 65.9592 31.4538 178.5624 74 A 4.0217 7.9611 118.6491 55.2139 18.4716 179.4950 75 L 3.9652 7.9900 117.4755 57.9913 41.6816 179.8914 76 I 3.7679 8.3941 120.0721 64.5035 37.1289 178.7558 77 R 3.9721 8.0693 118.9486 59.1826 29.6108 178.7679 78 E 4.0157 8.2735 119.2648 59.1532 29.4578 179.1320 79 R 4.0713 7.8424 117.9582 59.1783 30.1518 179.1970 80 R 4.0100 8.0799 118.0053 59.4117 30.0689 178.8745 81 D 4.5164 8.2401 118.2867 57.0512 40.7830 178.6038 82 A 4.1566 7.8627 119.9257 54.7233 18.3609 179.4568 83 A 4.0503 7.8162 119.8853 55.0039 18.4825 179.6516 84 F 4.2509 8.4849 119.1440 61.3868 39.4927 177.2553 85 A 4.0181 8.8735 120.6437 55.2430 17.9789 179.5374 86 A 3.9243 7.7939 118.1882 55.4335 18.4944 179.7529 87 T 3.7339 7.5859 113.4020 65.9817 68.3719 175.6260 88 Y 4.3892 7.6763 117.3198 59.5315 39.4379 178.4221 89 V 3.6815 7.4483 118.2814 65.5592 31.7044 177.8223 90 A 3.9486 8.5931 120.9095 54.8467 18.3388 177.8727 91 P 4.1580 0.0000 0.0000 65.3946 31.2847 178.5746 92 L 3.9657 7.5757 118.0215 58.2140 42.0289 179.0349 93 I 3.7122 7.9184 119.7486 64.5427 37.0930 178.0587 94 D 4.3640 8.2270 119.6267 57.4963 40.6386 178.6090 95 E 3.9963 8.3000 119.6302 59.4059 29.6434 178.8811 96 S 4.4506 8.4983 115.5352 61.8530 63.0221 176.8855 97 I 3.7546 8.0069 122.4619 64.5809 36.6401 177.9329 98 H 4.1683 8.1267 118.0187 59.1439 29.8314 176.6843 99 L 3.9693 8.0460 118.4820 54.6778 41.6188 177.3751 100 G 3.6734 7.4424 106.5046 46.1031 0.0000 173.2607 101 F 4.9301 8.0422 118.5242 56.1120 40.3976 176.9470 102 T 4.3641 8.3291 115.3578 61.0786 71.1489 175.8554 103 R 3.8880 8.5375 121.3461 59.5322 30.1212 178.5198 104 A 4.0631 8.0327 120.2088 55.1759 18.3966 179.4075 105 R 3.8452 7.9809 116.9605 59.7077 30.0914 178.8977 106 I 3.7332 7.8049 119.6451 64.4049 36.9423 178.1197 107 H 4.1086 8.5941 117.3785 58.7658 28.4819 177.5834 108 A 3.9676 8.0221 122.4510 55.2333 18.2296 179.3926 109 L 3.8205 8.2903 119.1736 58.1753 42.0487 179.1488 110 L 3.9813 8.1035 119.2794 58.0216 41.5949 179.3045 111 D 4.3735 7.9604 118.4792 57.0644 40.4937 178.4581 112 Q 3.8956 8.0225 119.6500 59.4280 29.1802 178.4826 113 V 3.6894 7.9925 117.8668 65.6376 31.7917 177.3909 114 A 4.3608 7.9478 120.6317 54.3515 18.2403 176.6448 115 E 3.8130 8.0901 122.2660 59.7276 29.3235 177.9212 116 S 4.3362 8.7336 121.3840 57.9162 59.9196 168.8986 117 R 4.2017 7.3574 118.0871 57.0287 30.2446 177.6861 118 G 3.7336 8.5319 107.0920 46.4945 0.0000 173.1501 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 10 A 8.12 4.37 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 11 S 8.02 3.97 0.00 4.03 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 12 L 8.93 4.07 0.00 1.79 1.71 0.73 0.81 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 13 I 7.67 3.66 1.99 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.69 0.89 0.00 0.00 14 E 8.05 3.95 0.00 2.17 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 2.34 2.52 0.00 15 D 9.22 4.39 0.00 2.51 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 16 S 8.12 4.84 0.00 4.04 3.86 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 17 I 7.91 4.08 2.00 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 1.39 1.68 0.92 0.00 0.00 18 V 7.70 3.71 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 0.85 0.00 0.00 0.97 0.00 0.00 19 D 8.35 4.67 0.00 2.82 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 20 G 7.63 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 0.00 0.00 0.00 21 T 8.81 3.99 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 1.22 0.00 0.00 22 L 7.87 5.09 0.00 1.69 1.54 0.87 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 23 S 9.35 4.59 0.00 3.84 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 24 I 7.98 3.89 1.92 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 1.46 0.50 1.05 0.00 0.00 25 D 9.51 4.80 0.00 2.90 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 26 Q 7.69 4.44 0.00 2.07 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.07 6.96 0.00 0.00 0.00 0.00 0.00 2.27 2.26 0.00 27 R 8.09 3.62 0.00 1.35 1.30 0.00 2.89 0.00 0.00 3.03 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.42 0.00 28 V 7.40 3.94 1.90 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 0.74 0.00 0.00 0.83 0.00 0.00 29 P 0.00 4.37 0.00 2.00 2.20 0.00 3.65 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.97 0.00 30 S 8.30 4.30 0.00 4.01 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 31 T 8.40 3.90 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 32 N 8.07 4.27 0.00 2.78 2.91 0.00 0.00 6.80 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 33 E 8.14 3.92 0.00 2.03 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 2.26 2.33 0.00 34 L 8.02 3.98 0.00 1.92 1.79 0.92 0.47 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 35 A 8.73 4.05 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 36 A 8.51 3.94 1.41 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 0.00 0.00 37 F 8.20 4.11 0.00 2.98 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 38 H 8.26 4.30 0.00 3.24 3.31 0.00 5.86 0.00 0.00 0.00 0.00 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 R 7.60 3.81 0.00 1.86 1.96 0.00 3.05 0.00 0.00 3.24 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.45 0.00 40 I 7.92 4.67 1.88 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 1.38 0.70 0.96 0.00 0.00 41 N 8.46 4.55 0.00 2.75 2.73 0.00 0.00 6.63 7.71 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 42 P 0.00 4.26 0.00 2.30 2.32 0.00 3.76 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 2.08 2.05 0.00 43 A 9.46 3.97 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 44 T 8.16 3.83 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 1.21 0.00 0.00 45 A 7.96 4.04 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 46 R 8.21 3.82 0.00 1.99 2.11 0.00 3.15 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 1.63 1.69 0.00 47 N 7.97 4.60 0.00 3.04 3.07 0.00 0.00 6.49 6.55 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 48 G 7.93 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 49 L 7.99 4.07 0.00 1.91 1.71 0.90 0.48 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 50 T 8.17 3.86 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 1.22 0.00 0.00 51 L 8.31 4.02 0.00 1.84 1.73 0.93 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 52 L 7.69 4.04 0.00 1.83 1.73 0.92 0.83 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 53 V 7.67 4.19 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 1.55 0.00 0.00 0.99 0.00 0.00 54 E 8.12 3.95 0.00 2.09 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 2.65 2.47 0.00 55 A 7.89 4.19 1.39 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 0.00 0.00 0.00 56 G 8.08 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 57 I 8.11 4.08 2.03 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 1.26 0.81 0.93 0.00 0.00 58 L 7.94 5.51 0.00 1.55 1.55 0.88 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 59 Y 8.67 5.43 0.00 2.88 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 60 K 8.89 5.06 0.00 1.92 1.85 0.00 1.59 0.00 0.00 1.75 0.00 0.00 2.79 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.37 1.51 7.81 61 K 8.92 4.48 0.00 1.94 1.75 0.00 1.27 0.00 0.00 1.32 0.00 0.00 2.13 0.00 0.00 2.37 0.00 0.00 0.00 0.00 1.22 0.76 7.81 62 R 8.79 3.95 0.00 1.77 1.91 0.00 3.41 0.00 0.00 3.26 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.74 0.00 63 G 9.00 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 64 I 9.49 4.43 2.16 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 1.30 0.90 1.14 0.00 0.00 65 G 8.13 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 *67 F 8.56 4.53 0.00 1.56 2.68 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 0.00 0.00 0.00 0.00 68 V 8.24 3.99 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 0.97 0.00 0.00 0.93 0.00 0.00 69 S 9.11 5.04 0.00 4.24 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 70 A 8.87 4.28 1.30 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 0.00 0.00 0.00 0.00 0.00 0.00 71 Q 8.36 4.29 0.00 2.12 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.66 0.00 0.00 0.00 0.00 0.00 2.34 2.44 0.00 72 A 8.05 4.02 1.49 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 0.00 0.00 73 P 0.00 4.15 0.00 2.18 2.13 0.00 3.78 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.19 0.00 74 A 7.96 4.02 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 75 L 7.99 3.97 0.00 1.95 1.75 1.01 0.86 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 76 I 8.39 3.77 1.93 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 1.54 0.73 0.93 0.00 0.00 77 R 8.07 3.97 0.00 1.98 1.98 0.00 3.28 0.00 0.00 3.09 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.78 0.00 78 E 8.27 4.02 0.00 2.24 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 0.00 2.33 2.37 0.00 79 R 7.84 4.07 0.00 2.17 1.98 0.00 3.20 0.00 0.00 3.27 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.90 0.00 80 R 8.08 4.01 0.00 2.03 2.01 0.00 3.14 0.00 0.00 3.19 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.92 0.00 81 D 8.24 4.52 0.00 2.84 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 82 A 7.86 4.16 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 83 A 7.82 4.05 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 84 F 8.48 4.25 0.00 3.26 3.35 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 85 A 8.87 4.02 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 86 A 7.79 3.92 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 87 T 7.59 3.73 3.66 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 0.00 0.00 0.00 0.37 0.00 0.00 88 Y 7.68 4.39 0.00 2.26 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 89 V 7.45 3.68 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 1.16 0.00 0.00 0.99 0.00 0.00 90 A 8.59 3.95 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 91 P 0.00 4.16 0.00 2.12 2.07 0.00 3.59 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.07 0.00 92 L 7.58 3.97 0.00 1.99 1.87 0.93 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 93 I 7.92 3.71 2.03 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 1.84 0.75 0.93 0.00 0.00 94 D 8.23 4.36 0.00 2.81 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 E 8.30 4.00 0.00 2.12 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 0.00 2.38 2.50 0.00 96 S 8.50 4.45 0.00 4.15 4.08 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 97 I 8.01 3.75 2.03 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 1.22 0.92 0.00 0.00 98 H 8.13 4.17 0.00 3.09 3.51 0.00 5.94 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 L 8.05 3.97 0.00 1.11 0.90 1.09 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 100 G 7.44 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 0.00 101 F 8.04 4.93 0.00 3.04 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 0.00 102 T 8.33 4.36 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 1.26 0.00 0.00 103 R 8.54 3.89 0.00 1.93 2.02 0.00 3.25 0.00 0.00 3.36 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.70 0.00 104 A 8.03 4.06 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 R 7.98 3.85 0.00 2.01 2.19 0.00 3.09 0.00 0.00 3.15 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.52 0.00 106 I 7.80 3.73 1.96 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.85 0.87 0.00 0.00 107 H 8.59 4.11 0.00 3.35 3.33 0.00 5.62 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 A 8.02 3.97 1.39 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 0.00 0.00 0.00 109 L 8.29 3.82 0.00 1.69 1.75 0.82 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 110 L 8.10 3.98 0.00 2.11 1.72 0.94 1.28 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 0.00 111 D 7.96 4.37 0.00 2.80 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 0.00 112 Q 8.02 3.90 0.00 2.18 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.98 0.00 0.00 0.00 0.00 0.00 2.35 2.36 0.00 113 V 7.99 3.69 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 0.86 0.00 0.00 0.92 0.00 0.00 114 A 7.95 4.36 1.41 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 0.00 0.00 115 E 8.09 3.81 0.00 2.03 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 2.34 2.53 0.00 116 S 8.73 4.34 0.00 4.05 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 0.00 117 R 7.36 4.20 0.00 1.83 1.99 0.00 3.10 0.00 0.00 3.21 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.78 0.00 118 G 8.53 3.73 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 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.