NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 D 4.5134 8.3649 120.1926 53.8034 41.4368 174.7768 2 I 3.8542 8.2218 128.8423 60.1131 37.7068 170.7082 3 V 4.1269 9.7884 129.8464 61.8956 33.7815 174.4072 4 L 5.1004 8.4845 126.3429 53.4456 44.7367 175.3068 5 T 4.6491 8.7720 121.8990 61.9019 70.7208 173.9564 6 Q 4.6412 8.6975 126.2900 55.0195 30.0536 176.1609 7 S 3.9527 8.5385 117.3208 61.6426 62.1678 174.3970 8 H 5.0888 7.8464 117.5759 52.7936 32.3597 173.9275 9 K 4.2616 8.6111 121.5267 58.3177 33.2186 176.3127 10 F 5.4821 8.1097 115.7170 55.9505 42.7496 174.6580 11 M 4.8151 9.3054 120.9069 54.5689 35.5835 174.0503 12 S 5.6225 8.5399 121.5617 56.7177 65.4859 173.1107 13 T 4.0831 7.0637 116.6689 62.4878 71.7500 171.3594 14 S 4.9027 7.8183 117.7719 55.6161 65.7428 172.8831 15 V 4.4317 7.6222 122.6378 64.3466 31.7614 174.7756 16 G 4.0680 8.9271 113.1868 45.7410 0.0000 173.3783 17 D 4.7016 7.7485 118.6069 53.7704 42.8299 175.1822 18 R 5.0931 8.3316 119.3460 54.7405 32.2163 174.8858 19 V 4.5341 8.8879 125.7556 61.1518 35.2290 174.2411 20 S 5.0315 8.5022 121.0874 56.8597 66.2108 173.2112 21 I 4.6302 8.7349 126.1475 59.6278 39.8168 174.8606 22 T 5.3039 8.4521 116.1827 60.2257 72.1029 172.4320 23 C 5.3992 9.7940 123.1077 54.9997 48.2916 172.2955 24 K 5.3271 8.9291 127.3954 54.6723 34.2285 174.6838 25 A 5.1441 8.9603 129.8983 50.9185 20.2805 177.2073 26 S 4.3048 8.7696 114.3814 59.7028 64.2035 174.0065 *29 Q 4.2697 7.8054 118.2577 55.6040 29.9029 174.1123 30 D 4.7202 8.3904 119.1552 54.7721 41.8036 176.8519 31 V 4.2388 8.8768 119.4636 60.4673 34.0154 177.4539 32 G 3.7613 7.8641 114.4902 47.4037 0.0000 175.9735 *39 T 4.7117 8.5868 113.2316 61.1715 70.5946 174.0749 40 A 3.9241 7.9274 124.0949 51.9608 16.2823 178.0891 41 V 4.4736 7.0638 119.8515 60.3734 34.9658 175.4217 42 A 5.1032 8.7829 128.2821 49.9082 22.6523 174.6952 43 W 5.2990 8.9629 119.6130 55.1692 32.5184 174.6023 44 Y 5.3434 9.7740 120.9773 56.2785 41.8314 174.1211 45 Q 4.8806 9.3952 122.9341 54.3666 32.2667 174.0829 46 Q 4.7237 8.8768 126.8877 54.4909 31.9690 174.1623 47 K 4.7984 8.5692 125.4222 54.1054 34.7645 174.4920 48 P 4.1920 0.0000 0.0000 64.2219 31.6813 176.7191 49 G 3.9398 8.9335 109.3130 46.3004 0.0000 172.7502 50 Q 4.6225 7.6167 116.6522 53.6539 32.8065 174.8199 51 S 4.5982 8.2212 113.4294 56.4354 64.6202 172.3523 52 P 4.6551 0.0000 0.0000 62.9095 32.1011 175.5202 53 K 4.7021 9.0814 124.0486 54.2941 34.9954 174.9785 54 L 3.9544 8.8191 129.7678 55.5465 42.5134 175.0808 55 L 4.5892 9.0273 125.1077 55.9558 43.9640 176.2877 56 I 5.4357 7.6559 118.4570 59.6985 41.5534 173.6261 57 Y 5.1736 8.2953 122.4112 55.1108 42.0831 174.5310 58 W 4.5650 8.7581 116.0736 57.1857 27.1845 175.9575 *67 A 4.7925 8.0244 120.2126 51.4741 20.5685 179.2486 68 S 4.8255 8.0078 104.5155 58.1796 65.0767 173.6962 69 T 4.2995 8.1442 118.7121 62.9350 69.5607 174.3447 70 R 4.6036 8.4326 125.7110 56.1195 31.2406 176.0284 71 H 4.9075 9.0573 123.2341 55.6116 31.7989 174.2115 72 T 3.7149 8.2608 119.0280 68.0946 67.8128 173.3017 73 G 3.9454 8.8084 116.1586 45.7076 0.0000 173.4128 74 V 3.8558 7.5974 120.5999 61.4944 32.2399 174.0439 75 P 4.5667 0.0000 0.0000 62.3054 31.9213 176.9314 76 D 4.4198 8.8086 120.0858 56.0464 39.5753 177.6573 77 R 3.9077 8.0538 120.4532 58.8244 31.1781 175.9004 78 F 5.0744 8.3501 117.8390 56.4897 40.5369 176.0376 79 T 4.6033 8.9736 119.5776 62.0924 72.5418 173.5184 80 G 4.4772 8.8879 113.3181 44.4173 0.0000 172.1507 81 S 4.6525 8.8980 113.8793 57.7771 66.8729 173.7028 82 G 4.0609 9.6405 105.9954 45.5972 0.0000 172.7600 83 S 4.4839 7.8812 110.0853 58.6463 64.5769 174.8235 84 G 4.2196 8.5553 113.4371 46.3847 0.0000 174.5713 *87 T 4.5054 7.6920 114.8394 60.6930 70.8390 172.8548 88 D 5.2740 7.2732 120.1103 52.9222 43.8213 174.9968 89 F 5.3760 9.4869 122.2911 56.1105 43.4378 174.5260 90 T 5.2889 9.1866 116.9481 62.0769 73.3716 172.4503 91 L 4.3862 8.4979 127.8673 53.2783 44.3685 175.0381 92 T 4.9273 8.5261 122.3506 61.7515 72.1811 172.9192 93 I 4.3981 8.4630 128.1154 59.3341 38.4811 176.4994 94 S 3.9811 8.4258 123.4627 60.7186 63.4409 174.5172 95 N 4.9387 7.5643 117.8879 50.2686 38.6769 171.7329 96 V 3.6299 8.8587 121.1202 63.4781 33.0989 175.2812 97 Q 4.7181 8.8033 126.9554 54.4810 30.9165 177.4269 98 S 4.1384 8.7228 116.2972 61.8719 62.8910 176.5413 99 E 4.2126 8.2176 115.2222 57.9650 29.2306 176.7698 100 D 4.8633 7.9082 118.8241 54.5891 41.4322 176.2693 101 L 4.3970 7.9592 120.4946 55.2979 42.1585 176.0084 102 A 4.3027 7.9099 122.0730 51.7868 23.7978 174.3220 103 D 4.9598 8.1326 117.4899 53.9863 43.0587 176.0016 104 Y 5.1991 8.2453 118.1042 56.4124 41.8950 174.5126 105 F 6.1451 9.7716 122.4312 54.9299 42.9539 171.8205 106 C 4.8635 8.9297 115.7374 53.5882 45.1239 172.3488 107 Q 4.7114 8.7189 121.2264 54.4236 32.3557 173.0879 108 Q 4.7468 8.5382 126.4041 53.9301 31.4855 175.0192 109 Y 5.4349 7.7370 125.0785 56.9708 38.0441 177.0626 110 S 4.2748 8.8277 117.7693 61.3646 63.8146 174.2664 111 S 4.2237 7.5471 112.9874 56.6971 65.6382 172.3676 *135 Y 4.8220 8.3360 117.9885 57.3944 38.7995 173.5159 136 P 4.7644 0.0000 0.0000 62.1276 32.5504 176.0367 137 L 4.3164 8.5108 120.3541 55.2776 42.2705 176.4921 138 T 4.8147 8.0797 111.7773 60.0126 72.5229 172.6073 139 F 5.2676 8.8820 120.2733 55.6123 41.6492 174.9838 140 G 4.1979 9.1032 108.0008 44.6227 0.0000 175.0827 141 A 4.2979 8.6811 122.7545 53.3452 18.7205 178.7036 142 G 3.6564 7.9897 99.5682 45.1478 0.0000 173.3902 143 T 4.6079 8.1594 115.7236 61.4677 72.5216 172.9839 144 K 4.6257 9.1999 129.7385 55.4160 33.5305 175.1409 145 L 5.0382 8.6838 130.0668 54.1470 43.2796 174.9281 146 E 5.0236 9.1217 125.9131 54.0399 33.6583 176.7915 147 L 5.2540 8.2307 118.8475 54.9129 41.8633 177.2881 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 D 8.36 4.51 0.00 2.64 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 2 I 8.22 3.85 1.83 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 1.21 0.75 0.88 0.00 0.00 3 V 9.79 4.13 2.10 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 0.97 0.00 0.00 0.94 0.00 0.00 4 L 8.48 5.10 0.00 1.76 1.51 0.83 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 5 T 8.77 4.65 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 1.24 0.00 0.00 6 Q 8.70 4.64 0.00 2.07 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.75 0.00 0.00 0.00 0.00 0.00 2.52 2.42 0.00 7 S 8.54 3.95 0.00 3.63 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 8 H 7.85 5.09 0.00 3.20 3.35 0.00 5.71 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 K 8.61 4.26 0.00 1.88 1.33 0.00 1.49 0.00 0.00 1.82 0.00 0.00 2.94 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.37 1.24 7.81 10 F 8.11 5.48 0.00 2.95 3.07 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 11 M 9.31 4.82 0.00 2.07 1.92 0.00 0.00 0.00 0.00 0.00 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.55 0.00 12 S 8.54 5.62 0.00 3.80 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 13 T 7.06 4.08 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 1.23 0.00 0.00 14 S 7.82 4.90 0.00 3.83 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 V 7.62 4.43 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 1.00 0.00 0.00 0.94 0.00 0.00 16 G 8.93 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 0.00 0.00 0.00 17 D 7.75 4.70 0.00 2.72 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 R 8.33 5.09 0.00 1.85 1.72 0.00 3.12 0.00 0.00 3.10 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.49 0.00 19 V 8.89 4.53 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 0.94 0.00 0.00 0.88 0.00 0.00 20 S 8.50 5.03 0.00 3.69 3.65 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 21 I 8.73 4.63 1.55 0.00 0.00 0.60 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 0.43 1.09 0.00 0.00 22 T 8.45 5.30 4.34 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 1.25 0.00 0.00 23 C 9.79 5.40 0.00 3.04 3.17 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 24 K 8.93 5.33 0.00 1.94 1.67 0.00 1.70 0.00 0.00 1.68 0.00 0.00 3.00 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.37 1.63 7.81 25 A 8.96 5.14 1.40 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 0.00 0.00 0.00 0.00 0.00 0.00 26 S 8.77 4.30 0.00 3.95 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 0.00 *29 Q 7.81 4.27 0.00 2.09 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.96 0.00 0.00 0.00 0.00 0.00 2.27 2.40 0.00 30 D 8.39 4.72 0.00 2.77 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 31 V 8.88 4.24 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 0.61 0.00 0.00 0.88 0.00 0.00 32 G 7.86 3.76 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 0.00 0.00 0.00 *39 T 8.59 4.71 4.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 40 A 7.93 3.92 0.64 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 0.00 0.00 0.00 0.00 0.00 0.00 41 V 7.06 4.47 1.25 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 0.22 0.00 0.00 -0.37 0.00 0.00 42 A 8.78 5.10 1.09 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 0.00 0.00 43 W 8.96 5.30 0.00 3.30 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 44 Y 9.77 5.34 0.00 3.10 2.96 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 45 Q 9.40 4.88 0.00 2.08 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.76 0.00 0.00 0.00 0.00 0.00 2.06 1.75 0.00 46 Q 8.88 4.72 0.00 2.25 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.55 0.00 0.00 0.00 0.00 0.00 2.29 2.44 0.00 47 K 8.57 4.80 0.00 1.75 1.70 0.00 1.75 0.00 0.00 1.83 0.00 0.00 2.88 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.44 1.45 7.81 48 P 0.00 4.19 0.00 2.05 2.01 0.00 3.80 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 2.05 2.11 0.00 49 G 8.93 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 50 Q 7.62 4.62 0.00 2.19 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.76 0.00 0.00 0.00 0.00 0.00 2.28 2.42 0.00 51 S 8.22 4.60 0.00 3.92 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 52 P 0.00 4.66 0.00 1.73 1.94 0.00 3.48 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 2.06 0.00 53 K 9.08 4.70 0.00 1.82 1.81 0.00 1.65 0.00 0.00 1.58 0.00 0.00 2.81 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.34 1.39 7.81 54 L 8.82 3.95 0.00 1.61 1.44 0.47 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 55 L 9.03 4.59 0.00 1.88 1.60 0.78 1.12 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 56 I 7.66 5.44 2.19 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.04 1.15 0.00 0.00 57 Y 8.30 5.17 0.00 2.80 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 58 W 8.76 4.56 0.00 3.46 3.23 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 *67 A 8.02 4.79 1.66 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 0.00 0.00 0.00 68 S 8.01 4.83 0.00 3.87 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 69 T 8.14 4.30 3.42 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 0.91 0.00 0.00 70 R 8.43 4.60 0.00 1.72 1.90 0.00 3.48 0.00 0.00 3.50 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.68 0.00 71 H 9.06 4.91 0.00 3.44 3.24 0.00 5.62 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 T 8.26 3.71 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 1.19 0.00 0.00 73 G 8.81 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 0.00 0.00 0.00 74 V 7.60 3.86 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 0.71 0.00 0.00 0.96 0.00 0.00 75 P 0.00 4.57 0.00 2.36 2.27 0.00 3.94 0.00 0.00 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.22 0.00 76 D 8.81 4.42 0.00 2.81 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 77 R 8.05 3.91 0.00 1.80 1.69 0.00 2.82 0.00 0.00 3.37 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 1.46 0.00 78 F 8.35 5.07 0.00 2.97 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 79 T 8.97 4.60 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 1.20 0.00 0.00 80 G 8.89 4.48 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 0.00 81 S 8.90 4.65 0.00 3.92 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 82 G 9.64 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 83 S 7.88 4.48 0.00 3.97 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 84 G 8.56 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 0.00 0.00 0.00 0.00 *87 T 7.69 4.51 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 1.18 0.00 0.00 88 D 7.27 5.27 0.00 2.61 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 0.00 0.00 0.00 0.00 89 F 9.49 5.38 0.00 3.11 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 90 T 9.19 5.29 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 1.21 0.00 0.00 91 L 8.50 4.39 0.00 0.27 0.43 0.39 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.00 0.00 0.00 0.00 0.00 0.00 92 T 8.53 4.93 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 1.10 0.00 0.00 93 I 8.46 4.40 1.61 0.00 0.00 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.36 0.38 0.00 0.00 94 S 8.43 3.98 0.00 3.83 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 95 N 7.56 4.94 0.00 2.62 2.62 0.00 0.00 6.87 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 96 V 8.86 3.63 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 0.97 0.00 0.00 0.87 0.00 0.00 97 Q 8.80 4.72 0.00 2.07 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.64 6.57 0.00 0.00 0.00 0.00 0.00 2.40 2.47 0.00 98 S 8.72 4.14 0.00 3.90 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 99 E 8.22 4.21 0.00 2.14 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 2.34 2.44 0.00 100 D 7.91 4.86 0.00 2.93 2.96 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 0.00 101 L 7.96 4.40 0.00 1.61 1.82 1.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 102 A 7.91 4.30 1.07 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 0.00 0.00 103 D 8.13 4.96 0.00 2.74 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 0.00 0.00 0.00 0.00 104 Y 8.25 5.20 0.00 2.96 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 0.00 105 F 9.77 6.15 0.00 3.22 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 0.00 106 C 8.93 4.86 0.00 1.87 1.18 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 0.00 107 Q 8.72 4.71 0.00 1.84 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.82 0.00 0.00 0.00 0.00 0.00 1.76 1.16 0.00 108 Q 8.54 4.75 0.00 1.86 1.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.68 0.00 0.00 0.00 0.00 0.00 2.02 2.26 0.00 109 Y 7.74 5.43 0.00 2.77 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 0.00 110 S 8.83 4.27 0.00 3.86 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 0.00 111 S 7.55 4.22 0.00 3.93 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 *135 Y 8.34 4.82 0.00 3.06 2.85 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 0.00 136 P 0.00 4.76 0.00 2.22 2.08 0.00 3.81 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.01 0.00 137 L 8.51 4.32 0.00 1.55 1.51 1.02 0.81 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 0.00 138 T 8.08 4.81 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 1.26 0.00 0.00 139 F 8.88 5.27 0.00 2.78 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 0.00 140 G 9.10 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 0.00 0.00 0.00 141 A 8.68 4.30 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 0.00 142 G 7.99 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 0.00 0.00 0.00 0.00 143 T 8.16 4.61 4.34 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 1.26 0.00 0.00 144 K 9.20 4.63 0.00 1.62 1.62 0.00 2.22 0.00 0.00 1.76 0.00 0.00 2.87 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.55 1.44 7.81 145 L 8.68 5.04 0.00 2.21 1.73 0.95 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 146 E 9.12 5.02 0.00 1.97 1.84 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 2.31 2.40 0.00 147 L 8.23 5.25 0.00 1.72 1.57 0.94 1.14 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 * Residues marked with a * may have inaccurate shift predictions.