NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 43 L 4.2195 8.1849 120.9516 54.8022 42.6276 177.2119 44 P 4.1595 0.0000 0.0000 60.6734 31.9503 173.8831 45 T 4.5586 8.1756 111.7156 59.4950 72.3352 174.1600 46 R 4.0923 8.1068 120.2086 58.1607 30.0798 177.0453 47 R 4.4649 7.8301 114.2429 56.9548 31.4202 176.7851 48 T 4.2719 7.0993 111.8941 63.9956 69.6245 175.1427 49 R 3.8582 8.1443 122.5168 56.5451 30.4688 176.7481 50 T 4.0368 8.5825 115.8807 61.9600 70.4935 174.2418 51 F 3.9877 8.9759 124.7788 61.9111 39.4637 177.6931 52 S 4.2703 8.4670 113.5639 61.7235 62.8034 176.0692 53 A 4.0290 7.9831 123.3098 55.8311 18.0674 179.7762 54 T 3.7570 7.8641 113.7668 66.8268 68.4417 176.6185 55 V 3.4427 7.3578 119.7220 66.0127 31.3910 177.9830 56 R 3.8681 7.9484 114.7314 59.4013 28.9733 178.0851 57 A 4.2709 8.0098 122.0675 54.3417 18.4118 179.6466 58 S 4.1986 7.9537 110.7718 61.5705 63.1226 176.3107 59 Q 4.2183 8.2527 121.6174 58.3400 28.7250 177.2454 60 G 3.8895 8.0325 106.1653 42.7422 0.0000 171.1536 61 P 4.2743 0.0000 0.0000 62.2076 31.9501 175.9264 62 V 4.1280 7.6511 120.0693 61.8125 32.7690 174.6715 63 Y 4.6886 8.1882 125.0109 56.1041 41.1800 174.8442 64 K 4.8224 8.3150 122.1845 55.8403 35.1645 175.2394 65 G 4.3569 8.3539 109.4600 46.2048 0.0000 172.0727 66 V 4.9797 8.0788 118.6745 60.6984 35.3269 174.3232 67 C 4.2851 9.0875 128.1908 60.0407 31.8058 173.9656 68 K 4.1439 9.1650 129.3518 59.2659 32.2914 176.2509 69 C 4.9360 7.6784 112.2302 57.1717 33.7628 171.7058 70 F 4.8158 8.0492 116.4903 57.6624 41.8929 172.5524 71 C 4.4087 7.4827 126.2622 57.3420 33.0016 174.1352 72 R 3.8374 8.7068 127.3363 59.5309 30.0445 177.6626 73 S 4.2873 8.2395 112.3627 61.6932 62.7581 175.8631 74 K 4.0208 7.7317 116.5523 56.6978 32.3482 177.4609 75 G 3.8062 8.7973 107.7823 45.9331 0.0000 172.4223 76 H 4.7136 6.9781 111.4713 55.0827 30.9691 173.3360 77 G 4.7944 7.8960 105.8906 45.8806 0.0000 171.4232 78 F 4.9759 8.8913 117.5508 55.6986 43.9556 173.9555 79 I 4.8627 8.6342 121.2305 59.9007 40.2905 174.9145 80 T 4.8778 8.7307 124.2374 61.2305 69.5467 172.7849 81 P 4.6952 0.0000 0.0000 63.0481 31.6485 176.5962 82 A 3.9545 8.6809 126.8431 55.4821 18.2278 178.4772 83 D 4.1961 8.4578 112.0706 55.2374 39.6360 176.1922 84 G 4.1876 8.4774 112.8832 44.0978 0.0000 170.5423 85 G 3.8346 8.6487 107.2581 42.2852 0.0000 171.6662 86 P 4.2678 0.0000 0.0000 62.8826 31.7785 176.2696 87 D 4.7497 8.5605 120.9723 54.6479 42.2794 175.1409 88 I 4.4549 9.1223 124.6302 59.7055 39.0382 175.4374 89 F 3.8143 8.4159 129.2379 58.4286 41.0101 174.0321 90 L 4.2907 5.8274 125.3200 54.0273 44.9877 174.2964 91 H 4.8270 8.7083 126.5648 54.8756 31.5943 175.6069 92 I 3.8770 8.3442 125.0539 64.2601 38.0053 178.1725 93 S 4.0362 8.5418 113.1233 61.4800 62.6360 174.7524 94 D 4.5582 8.0492 118.3720 54.4516 40.9839 175.8172 95 V 4.1829 7.8352 121.2086 61.8394 32.0699 174.8609 96 E 4.5794 8.2137 125.0988 55.4607 31.5312 175.0131 97 G 4.0375 8.7454 106.7802 44.3310 0.0000 173.8028 98 E 4.3107 8.8403 116.0762 58.3901 30.0927 176.1205 99 Y 4.8834 7.6122 116.8346 56.0044 39.3240 175.4399 100 V 2.7037 7.4459 123.3113 61.4339 32.3226 173.9771 101 P 4.5130 0.0000 0.0000 62.5075 32.1083 175.9549 102 V 4.4143 9.6557 123.6868 60.3774 34.2869 174.6913 103 E 4.2939 8.8147 124.9378 58.7326 29.5164 177.6406 104 G 4.0051 8.9616 113.1040 44.8653 0.0000 173.3761 105 D 4.5537 8.4783 120.9629 54.8224 41.9518 175.1922 106 E 4.9470 9.3474 124.8251 55.3285 31.6102 175.2540 107 V 5.7024 9.3350 119.1561 59.0296 36.2390 174.7167 108 T 5.2431 8.3791 114.0724 61.0123 71.4850 172.8078 109 Y 5.3268 7.9643 118.6866 57.4338 41.7577 173.3764 110 K 4.9956 8.9496 120.2979 55.5960 34.7847 175.4032 111 M 5.3816 8.5804 120.3931 54.4728 35.2628 174.6227 112 C 4.7679 8.9435 119.6250 58.2575 35.7893 172.3860 113 S 5.1979 8.5942 117.6642 56.5271 64.7959 173.2066 114 I 4.2210 8.1347 126.9924 59.7790 37.9970 174.1177 115 P 5.4608 0.0000 0.0000 61.5867 32.1433 174.9021 116 P 4.3683 0.0000 0.0000 65.0893 33.4034 177.4404 *118 N 5.3312 8.2955 112.4211 51.5948 40.1162 176.4385 119 E 3.9057 9.5984 124.0264 57.0291 29.1446 175.4404 120 K 4.0179 8.5178 120.0796 57.3630 34.1260 176.5106 121 L 5.3433 8.5336 121.5076 53.3547 45.6488 174.6869 122 Q 5.1112 9.5038 120.1195 54.8897 33.2450 172.8144 123 A 5.4296 8.4927 124.2493 50.2608 21.0967 176.3674 124 V 4.3718 8.8500 114.9760 59.4233 36.1094 174.8112 125 E 3.8199 8.3886 119.5136 57.4776 26.6294 174.0651 126 V 4.6311 8.0903 118.6210 61.4376 33.7750 175.0497 127 V 4.6000 8.7287 129.1595 61.0882 33.8639 174.8027 128 I 4.5080 8.4660 129.1564 61.2564 36.3311 175.6315 129 T 4.1497 8.8164 119.3555 63.9142 70.0085 175.2046 130 H 4.8608 7.8186 119.1028 53.9943 33.0647 172.9895 131 L 4.1645 8.5840 123.9357 53.7682 42.1895 176.7481 132 A 4.0867 8.8551 127.4759 51.9012 18.6692 175.8811 133 P 4.3887 0.0000 0.0000 65.4139 31.9266 178.5266 134 G 3.5778 8.0583 106.2941 48.8695 0.0000 174.2591 135 T 4.2592 7.3851 115.5325 61.6672 69.8093 174.2027 136 K 4.2466 8.1841 121.6451 56.3771 32.8613 176.3615 137 H 4.8173 8.5895 119.5745 54.1414 30.6576 173.7198 138 E 4.9881 8.5903 122.6488 54.7157 33.2741 174.4070 139 T 4.9044 7.8550 108.8108 58.2454 71.9932 173.9565 140 W 4.3367 7.9465 122.7370 58.2904 29.8958 176.4240 141 S 4.3617 8.8989 116.9226 58.7859 62.9196 169.2472 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 43 L 8.18 4.22 0.00 1.72 1.81 0.89 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 44 P 0.00 4.16 0.00 2.14 2.00 0.00 3.56 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.09 0.00 45 T 8.18 4.56 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 0.94 0.00 0.00 46 R 8.11 4.09 0.00 1.86 1.97 0.00 3.21 0.00 0.00 3.21 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.68 0.00 47 R 7.83 4.46 0.00 1.81 1.94 0.00 3.39 0.00 0.00 3.21 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.54 0.00 48 T 7.10 4.27 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 1.20 0.00 0.00 49 R 8.14 3.86 0.00 1.95 1.87 0.00 3.28 0.00 0.00 3.28 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.60 0.00 50 T 8.58 4.04 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 1.24 0.00 0.00 51 F 8.98 3.99 0.00 3.13 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 52 S 8.47 4.27 0.00 4.00 4.01 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 53 A 7.98 4.03 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 54 T 7.86 3.76 4.16 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 1.13 0.00 0.00 55 V 7.36 3.44 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 1.06 0.00 0.00 0.67 0.00 0.00 56 R 7.95 3.87 0.00 2.13 2.20 0.00 2.89 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 1.92 1.76 0.00 57 A 8.01 4.27 1.48 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 0.00 0.00 0.00 0.00 0.00 0.00 58 S 7.95 4.20 0.00 4.02 4.07 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 0.00 0.00 0.00 0.00 59 Q 8.25 4.22 0.00 2.18 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.91 0.00 0.00 0.00 0.00 0.00 2.37 2.46 0.00 60 G 8.03 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 61 P 0.00 4.27 0.00 1.33 1.69 0.00 3.64 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.97 0.00 62 V 7.65 4.13 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 0.66 0.00 0.00 0.81 0.00 0.00 63 Y 8.19 4.69 0.00 1.72 2.51 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 0.00 0.00 0.00 0.00 64 K 8.32 4.82 0.00 1.87 1.73 0.00 1.81 0.00 0.00 2.14 0.00 0.00 2.88 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.51 1.47 7.81 65 G 8.35 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 0.00 0.00 0.00 0.00 66 V 8.08 4.98 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 1.09 0.00 0.00 0.97 0.00 0.00 67 C 9.09 4.29 0.00 3.01 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 9.16 4.14 0.00 1.84 1.97 0.00 2.07 0.00 0.00 1.67 0.00 0.00 2.93 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.54 1.43 7.81 69 C 7.68 4.94 0.00 3.07 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 70 F 8.05 4.82 0.00 2.97 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 71 C 7.48 4.41 0.00 2.83 2.48 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 0.00 0.00 0.00 0.00 72 R 8.71 3.84 0.00 1.99 2.01 0.00 3.42 0.00 0.00 3.32 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 2.03 0.00 73 S 8.24 4.29 0.00 3.85 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 74 K 7.73 4.02 0.00 1.56 1.64 0.00 1.76 0.00 0.00 1.69 0.00 0.00 2.97 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.37 1.34 7.81 75 G 8.80 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 76 H 6.98 4.71 0.00 2.74 3.27 0.00 5.46 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 77 G 7.90 4.79 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 78 F 8.89 4.98 0.00 3.01 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 79 I 8.63 4.86 1.59 0.00 0.00 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.93 0.69 0.00 0.00 80 T 8.73 4.88 4.27 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 1.23 0.00 0.00 81 P 0.00 4.70 0.00 1.97 2.02 0.00 3.97 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 2.16 2.08 0.00 82 A 8.68 3.95 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 83 D 8.46 4.20 0.00 2.82 2.83 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 84 G 8.48 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 85 G 8.65 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 86 P 0.00 4.27 0.00 2.07 2.05 0.00 3.68 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 2.05 2.15 0.00 87 D 8.56 4.75 0.00 2.56 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 88 I 9.12 4.45 1.65 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 1.07 0.92 0.87 0.00 0.00 89 F 8.42 3.81 0.00 3.04 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 5.83 4.29 0.00 1.48 1.26 0.83 0.77 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 H 8.71 4.83 0.00 3.53 3.23 0.00 5.74 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 I 8.34 3.88 2.05 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 1.66 0.89 0.00 0.00 93 S 8.54 4.04 0.00 4.01 4.07 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 0.00 0.00 0.00 0.00 94 D 8.05 4.56 0.00 2.89 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 95 V 7.84 4.18 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 1.05 0.00 0.00 0.86 0.00 0.00 96 E 8.21 4.58 0.00 2.13 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 0.00 2.38 2.25 0.00 97 G 8.75 4.04 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 0.00 0.00 0.00 98 E 8.84 4.31 0.00 1.93 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 0.00 2.21 1.47 0.00 99 Y 7.61 4.88 0.00 2.82 2.74 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 0.00 100 V 7.45 2.70 1.69 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 0.65 0.00 0.00 -0.40 0.00 0.00 101 P 0.00 4.51 0.00 1.46 1.70 0.00 2.84 0.00 0.00 3.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 1.77 0.00 102 V 9.66 4.41 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 0.78 0.00 0.00 0.87 0.00 0.00 103 E 8.81 4.29 0.00 1.98 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 2.34 2.54 0.00 104 G 8.96 4.01 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 0.00 0.00 0.00 105 D 8.48 4.55 0.00 2.63 2.59 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 0.00 106 E 9.35 4.95 0.00 2.06 1.92 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 2.37 2.42 0.00 107 V 9.33 5.70 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 0.77 0.00 0.00 1.05 0.00 0.00 108 T 8.38 5.24 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 1.20 0.00 0.00 109 Y 7.96 5.33 0.00 3.20 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 0.00 110 K 8.95 5.00 0.00 1.79 1.93 0.00 1.63 0.00 0.00 1.84 0.00 0.00 2.90 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.46 1.39 7.81 111 M 8.58 5.38 0.00 2.10 2.23 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.98 2.89 0.00 112 C 8.94 4.77 0.00 3.04 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 0.00 113 S 8.59 5.20 0.00 3.92 3.72 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 0.00 114 I 8.13 4.22 1.83 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.39 0.84 0.00 0.00 115 P 0.00 5.46 0.00 2.04 1.98 0.00 3.71 0.00 0.00 4.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.07 0.00 116 P 0.00 4.37 0.00 2.04 2.09 0.00 3.70 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.12 0.00 *118 N 8.30 5.33 0.00 2.79 2.63 0.00 0.00 7.63 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 0.00 119 E 9.60 3.91 0.00 2.13 1.85 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 2.21 2.32 0.00 120 K 8.52 4.02 0.00 1.70 1.80 0.00 1.60 0.00 0.00 1.82 0.00 0.00 2.85 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.55 1.51 7.81 121 L 8.53 5.34 0.00 1.62 1.61 0.94 0.91 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 0.00 122 Q 9.50 5.11 0.00 2.11 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.77 0.00 0.00 0.00 0.00 0.00 2.35 2.56 0.00 123 A 8.49 5.43 1.02 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 0.00 124 V 8.85 4.37 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 0.77 0.00 0.00 1.04 0.00 0.00 125 E 8.39 3.82 0.00 2.19 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 2.32 2.29 0.00 126 V 8.09 4.63 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 0.93 0.00 0.00 127 V 8.73 4.60 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 1.00 0.00 0.00 0.98 0.00 0.00 128 I 8.47 4.51 1.88 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 0.67 0.85 0.00 0.00 129 T 8.82 4.15 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 1.27 0.00 0.00 130 H 7.82 4.86 0.00 3.11 3.15 0.00 5.81 0.00 0.00 0.00 0.00 6.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 L 8.58 4.16 0.00 1.48 1.30 0.53 0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 132 A 8.86 4.09 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 0.00 133 P 0.00 4.39 0.00 2.04 2.10 0.00 3.67 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 2.01 2.06 0.00 134 G 8.06 3.58 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 0.00 0.00 0.00 135 T 7.39 4.26 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 1.16 0.00 0.00 136 K 8.18 4.25 0.00 1.71 1.71 0.00 1.70 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.41 1.43 7.81 137 H 8.59 4.82 0.00 3.02 2.98 0.00 5.65 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 E 8.59 4.99 0.00 1.83 1.76 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 2.28 2.25 0.00 139 T 7.85 4.90 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 0.76 0.00 0.00 140 W 7.95 4.34 0.00 3.17 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 0.00 141 S 8.90 4.36 0.00 4.21 4.10 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 * Residues marked with a * may have inaccurate shift predictions.