NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 22 S 4.4540 8.3301 117.1036 57.5778 64.1929 174.0800 23 A 4.0966 8.4845 127.5285 49.6237 20.2956 176.0865 24 L 3.8360 8.2534 122.7033 58.8135 42.5354 177.3599 25 H 4.0779 8.0257 114.2598 58.8068 28.0743 177.2410 26 W 4.6582 7.5532 123.3019 60.1075 28.8921 179.2753 27 R 3.9838 7.9356 120.0408 61.4514 28.8794 180.9810 28 A 4.1564 8.5896 122.0690 54.6202 18.2662 179.6511 29 A 3.9977 8.0933 119.5691 55.2547 18.5607 179.9066 30 G 3.5875 8.1917 103.9154 48.1058 0.0000 175.5173 31 A 3.9908 8.2283 123.7829 54.7347 18.2819 179.5588 32 A 3.8880 8.3644 119.5754 55.4997 18.4293 180.0677 33 T 3.6646 7.9144 114.2994 66.7354 68.5695 177.1494 34 V 3.5651 7.8323 120.1606 65.8768 31.4622 177.7866 35 L 3.9385 8.0858 120.2447 57.9072 41.8745 178.7035 36 L 3.8514 8.0502 120.4475 58.1275 42.0488 178.9345 37 V 3.5974 7.7683 118.1273 66.2454 31.3212 178.0533 38 I 3.7067 7.8467 119.3259 64.3832 36.9520 178.5946 39 V 3.6101 8.1147 119.4073 65.8202 31.2626 178.0486 40 L 3.9718 8.3713 119.1332 57.7964 41.5452 179.4824 41 L 4.0390 7.9704 118.5173 57.9382 41.6343 179.5636 42 A 4.2177 8.3692 120.9485 55.0146 18.2195 179.8854 43 G 3.7733 8.7685 104.6585 48.1410 0.0000 176.0818 44 S 4.4485 8.7237 118.2341 61.5326 62.8761 176.1670 45 Y 4.3605 8.3432 122.0858 61.0197 38.5715 178.2624 46 L 4.0920 8.8402 120.0192 57.4284 41.6383 179.3978 47 A 3.9158 8.4114 121.2372 55.0421 18.3068 179.7555 48 V 3.5590 7.3533 118.1119 65.4933 31.3339 177.9020 49 L 3.7929 7.3029 118.0765 58.1200 41.9152 178.5206 50 A 4.1652 7.9393 119.8452 55.0517 18.7178 179.1004 51 E 4.0434 8.5582 117.4444 58.0079 29.7332 177.7982 52 R 4.0870 7.3758 118.0879 57.4586 30.4864 176.8888 53 G 3.8616 8.9991 109.6032 45.0151 0.0000 173.0867 54 A 4.5022 7.8606 123.5216 49.3904 19.4717 174.4816 55 P 4.3325 0.0000 0.0000 65.1797 31.6979 177.0943 56 G 3.9364 8.9459 111.5309 45.1058 0.0000 173.6685 57 A 4.0251 7.6450 122.6472 52.4511 18.7270 177.2643 58 Q 4.3498 8.2447 119.0819 55.9204 31.0434 176.3739 59 L 4.1731 7.3119 122.8308 53.9084 40.5098 176.4743 60 I 4.4731 7.2428 109.0112 59.9204 39.3629 176.5718 61 T 4.3114 7.2384 111.5567 59.4521 72.5065 173.9309 62 Y 4.3126 7.9451 121.6301 60.9243 38.0697 177.2034 63 P 4.3884 0.0000 0.0000 65.8233 31.5958 178.9409 64 R 4.2515 8.1120 113.8928 59.0689 29.4055 178.4413 65 A 4.2288 8.0699 121.8508 54.9891 18.3715 179.3054 66 L 4.6397 8.4641 120.5099 57.6640 42.2277 179.0341 67 W 4.4053 8.3760 127.9379 60.3036 30.7425 177.6679 68 W 3.9422 9.0511 128.9719 60.4313 30.0286 178.0627 69 S 3.2335 8.5016 114.5559 61.0225 62.3803 176.8002 70 V 3.4572 7.6009 122.0084 65.5994 31.4305 177.7071 71 E 3.7797 7.4111 117.5515 57.8183 29.1882 178.8083 72 T 3.6804 6.9154 116.6274 66.0125 68.9752 176.6922 73 A 4.0773 7.8664 123.1370 54.9859 18.1511 178.8504 74 T 4.0576 7.9078 106.1000 61.3638 68.9875 175.2300 75 C 4.1401 7.7970 118.2341 60.9308 26.5593 174.8053 76 V 3.3037 7.2363 120.9958 65.4459 31.4610 177.0550 77 G 3.9385 7.4258 105.6356 46.0425 0.0000 173.0826 78 Y 4.3311 7.5588 116.6185 60.2926 38.4765 179.0391 79 G 4.3149 8.6753 105.2894 45.3347 0.0000 173.7787 80 D 4.6853 8.2158 119.9449 55.3064 40.0632 176.6414 81 L 4.5423 7.6394 117.8396 53.3684 45.7301 174.4353 82 Y 4.7952 7.1489 117.5926 55.4710 40.0884 172.2093 83 P 4.5004 0.0000 0.0000 62.9637 32.1218 176.5670 84 V 4.3326 9.2751 112.9473 61.3570 33.4097 176.5518 85 T 4.5629 7.9505 111.1907 59.6049 71.9483 175.2467 86 L 3.7987 8.2793 122.9165 58.4729 42.0465 179.3796 87 W 4.1800 8.1691 118.2245 59.3735 29.0819 178.7745 88 G 3.6108 8.3548 106.0733 47.8686 0.0000 176.1013 89 R 4.0963 8.4787 120.9560 58.9081 30.0949 179.1451 90 L 3.9892 8.0842 119.0906 57.7517 41.5878 179.6758 91 V 3.7671 8.2847 118.1596 65.9302 31.4253 177.9268 92 A 4.2866 8.3470 120.6426 55.2549 18.2083 179.6767 93 V 3.5554 8.0402 116.7807 66.1740 31.4870 178.3977 94 V 3.5843 7.7272 117.4435 65.9586 31.3070 178.1645 95 V 3.5320 7.8035 117.9079 66.1748 31.2990 177.7017 96 M 3.9423 8.2955 118.7808 58.5871 31.7887 178.9413 97 V 3.5701 8.0514 118.1005 65.9778 31.6146 177.8775 98 A 4.0651 8.4187 120.9998 54.9461 18.0982 179.9469 99 G 3.9021 8.2125 105.6424 47.5874 0.0000 175.8861 100 I 3.8086 8.0844 123.4401 64.3477 37.0869 178.6398 101 T 3.8600 8.1897 116.5830 66.7158 68.4057 176.8250 102 S 3.9950 8.1568 117.0059 61.8161 62.8832 176.9555 103 F 4.3242 8.3822 120.7526 60.4106 38.5923 178.0593 104 G 3.6786 8.5762 105.9003 47.7001 0.0000 175.5606 105 L 4.0180 8.1642 122.8030 57.7349 41.9781 179.2867 106 V 3.6577 7.6413 118.0798 66.1464 31.4497 178.0663 107 T 3.8730 8.0317 115.3671 66.7545 68.3174 176.4632 108 A 3.9439 8.0707 122.3164 54.9010 18.3367 179.6039 109 A 3.6074 7.7289 119.1790 55.0595 18.4007 179.8691 110 L 3.9547 8.1107 117.5062 57.7056 41.6584 179.5816 111 A 3.9828 8.0393 120.8016 55.4736 18.2561 179.7751 112 T 3.7132 7.6562 114.2479 66.3352 68.4515 176.5856 113 W 4.3328 7.8832 130.1309 60.7418 30.7084 178.1012 114 F 4.2443 8.0203 117.7207 60.4555 38.3014 177.8834 115 V 3.6947 8.4921 118.5793 65.8260 31.4432 178.3967 116 G 3.6800 8.5819 108.2538 48.5266 0.0000 176.5375 117 R 4.0038 8.0593 123.5749 61.1123 29.5196 180.3431 118 E 4.1797 8.5861 122.9428 59.6790 29.5041 179.5608 119 Q 4.0688 8.2075 120.9285 60.0162 28.0315 181.1239 120 E 4.1287 8.0798 119.7931 59.5219 29.4313 179.4612 121 R 3.7497 8.0693 119.3584 59.3596 30.1101 178.2134 122 R 4.4571 7.5797 117.7546 57.1429 29.9010 181.0287 123 G 4.0643 8.8090 109.0143 48.8577 0.0000 174.5768 *124 H 4.5017 8.4083 121.8985 54.1706 28.5723 176.4265 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 22 S 8.33 4.45 0.00 3.65 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 23 A 8.48 4.10 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 24 L 8.25 3.84 0.00 1.74 1.65 0.90 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 25 H 8.03 4.08 0.00 3.02 3.32 0.00 5.70 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 W 7.55 4.66 0.00 3.39 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 27 R 7.94 3.98 0.00 1.85 1.94 0.00 3.27 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.52 0.00 28 A 8.59 4.16 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 29 A 8.09 4.00 1.55 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 0.00 0.00 0.00 0.00 0.00 0.00 30 G 8.19 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 31 A 8.23 3.99 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 32 A 8.36 3.89 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 33 T 7.91 3.66 4.38 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 1.16 0.00 0.00 34 V 7.83 3.57 2.06 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 0.98 0.00 0.00 0.94 0.00 0.00 35 L 8.09 3.94 0.00 2.01 1.73 0.91 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 36 L 8.05 3.85 0.00 1.75 1.70 0.85 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 37 V 7.77 3.60 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 0.98 0.00 0.00 0.96 0.00 0.00 38 I 7.85 3.71 2.02 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 1.40 0.62 0.91 0.00 0.00 39 V 8.11 3.61 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 1.04 0.00 0.00 0.98 0.00 0.00 40 L 8.37 3.97 0.00 1.88 1.74 0.93 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 41 L 7.97 4.04 0.00 1.86 1.74 0.93 0.83 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 42 A 8.37 4.22 1.43 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 0.00 0.00 43 G 8.77 3.77 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 0.00 0.00 0.00 44 S 8.72 4.45 0.00 4.23 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 0.00 45 Y 8.34 4.36 0.00 3.11 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 46 L 8.84 4.09 0.00 1.92 1.83 1.05 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 47 A 8.41 3.92 1.16 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 0.00 0.00 48 V 7.35 3.56 2.06 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 0.69 0.00 0.00 0.62 0.00 0.00 49 L 7.30 3.79 0.00 1.33 1.74 0.83 1.48 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 50 A 7.94 4.17 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 51 E 8.56 4.04 0.00 1.97 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 2.34 2.24 0.00 52 R 7.38 4.09 0.00 1.72 1.80 0.00 3.03 0.00 0.00 3.14 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.60 0.00 53 G 9.00 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 0.00 0.00 0.00 54 A 7.86 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 55 P 0.00 4.33 0.00 2.04 2.02 0.00 3.64 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.09 0.00 56 G 8.95 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 57 A 7.65 4.03 1.23 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 0.00 0.00 0.00 58 Q 8.24 4.35 0.00 1.80 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 7.52 0.00 0.00 0.00 0.00 0.00 2.17 2.16 0.00 59 L 7.31 4.17 0.00 1.30 1.21 0.56 -0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 60 I 7.24 4.47 1.73 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 1.53 0.74 0.83 0.00 0.00 61 T 7.24 4.31 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 1.12 0.00 0.00 62 Y 7.95 4.31 0.00 3.21 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 63 P 0.00 4.39 0.00 2.22 2.18 0.00 3.67 0.00 0.00 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.26 0.00 64 R 8.11 4.25 0.00 2.23 2.29 0.00 2.95 0.00 0.00 3.37 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.74 0.00 65 A 8.07 4.23 1.55 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 0.00 0.00 0.00 0.00 0.00 0.00 66 L 8.46 4.64 0.00 2.05 2.05 1.04 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 67 W 8.38 4.41 0.00 3.49 3.33 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 68 W 9.05 3.94 0.00 3.43 3.54 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 69 S 8.50 3.23 0.00 3.97 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 0.00 70 V 7.60 3.46 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 1.06 0.00 0.00 1.05 0.00 0.00 71 E 7.41 3.78 0.00 1.68 1.20 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 1.59 1.81 0.00 72 T 6.92 3.68 3.56 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 0.88 0.00 0.00 73 A 7.87 4.08 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 74 T 7.91 4.06 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 1.16 0.00 0.00 75 C 7.80 4.14 0.00 3.01 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 76 V 7.24 3.30 1.55 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 -0.21 0.00 0.00 0.67 0.00 0.00 77 G 7.43 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 78 Y 7.56 4.33 0.00 3.44 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 79 G 8.68 4.31 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 0.00 80 D 8.22 4.69 0.00 2.95 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 81 L 7.64 4.54 0.00 1.84 1.53 1.19 0.74 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 82 Y 7.15 4.80 0.00 3.08 3.05 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 83 P 0.00 4.50 0.00 2.19 1.86 0.00 4.02 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.17 0.00 84 V 9.28 4.33 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 0.83 0.00 0.00 0.98 0.00 0.00 85 T 7.95 4.56 4.30 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 1.24 0.00 0.00 86 L 8.28 3.80 0.00 1.66 1.60 0.65 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 87 W 8.17 4.18 0.00 3.47 3.28 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 88 G 8.35 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 89 R 8.48 4.10 0.00 2.03 2.00 0.00 3.23 0.00 0.00 3.17 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.78 0.00 90 L 8.08 3.99 0.00 1.85 1.72 -0.04 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 91 V 8.28 3.77 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 1.20 0.00 0.00 92 A 8.35 4.29 1.80 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 93 V 8.04 3.56 2.26 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 1.08 0.00 0.00 0.97 0.00 0.00 94 V 7.73 3.58 2.31 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 1.07 0.00 0.00 1.03 0.00 0.00 95 V 7.80 3.53 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 0.82 0.00 0.00 1.02 0.00 0.00 96 M 8.30 3.94 0.00 2.03 2.23 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 2.79 2.48 0.00 97 V 8.05 3.57 2.09 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 1.10 0.00 0.00 0.95 0.00 0.00 98 A 8.42 4.07 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 99 G 8.21 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 0.00 100 I 8.08 3.81 1.89 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 1.53 0.85 0.93 0.00 0.00 101 T 8.19 3.86 4.41 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 1.19 0.00 0.00 102 S 8.16 3.99 0.00 3.72 3.56 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 0.00 103 F 8.38 4.32 0.00 3.14 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 0.00 104 G 8.58 3.68 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 0.00 0.00 0.00 105 L 8.16 4.02 0.00 1.83 1.81 0.89 1.07 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 0.00 106 V 7.64 3.66 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 1.16 0.00 0.00 1.00 0.00 0.00 107 T 8.03 3.87 4.46 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 1.24 0.00 0.00 108 A 8.07 3.94 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 0.00 109 A 7.73 3.61 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 0.00 110 L 8.11 3.95 0.00 1.83 1.49 1.03 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 111 A 8.04 3.98 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 0.00 112 T 7.66 3.71 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 0.89 0.00 0.00 113 W 7.88 4.33 0.00 3.27 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 0.00 114 F 8.02 4.24 0.00 3.16 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 0.00 115 V 8.49 3.69 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 1.01 0.00 0.00 0.96 0.00 0.00 116 G 8.58 3.68 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 0.00 0.00 0.00 117 R 8.06 4.00 0.00 1.84 1.95 0.00 3.27 0.00 0.00 3.09 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.51 0.00 118 E 8.59 4.18 0.00 2.10 1.95 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 2.27 2.34 0.00 119 Q 8.21 4.07 0.00 2.12 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.59 0.00 0.00 0.00 0.00 0.00 2.29 2.27 0.00 120 E 8.08 4.13 0.00 2.26 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 2.36 2.56 0.00 121 R 8.07 3.75 0.00 1.86 2.10 0.00 3.21 0.00 0.00 3.36 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.63 0.00 122 R 7.58 4.46 0.00 1.98 1.80 0.00 3.44 0.00 0.00 3.23 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.50 0.00 123 G 8.81 4.06 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 0.00 0.00 0.00 *124 H 8.41 4.50 0.00 2.90 2.80 0.00 7.24 0.00 0.00 0.00 0.00 6.91 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.