NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 D 4.6479 8.3649 119.5593 52.9670 41.5625 174.2208 2 I 4.2389 8.2397 120.6567 60.5667 38.2005 170.6328 3 V 4.4430 9.1774 121.3309 59.9485 34.7292 174.5018 4 L 5.2883 8.3678 121.5678 53.3442 45.1222 175.4681 5 T 4.7208 9.2253 120.1094 61.9440 71.1217 173.1198 6 Q 5.2799 8.8058 125.2023 54.6385 31.1959 175.3461 7 S 4.7670 9.0854 118.0342 56.4880 67.5530 172.5480 8 P 4.7576 0.0000 0.0000 61.8217 32.3288 176.3341 9 A 4.4004 8.4987 121.3296 54.9391 19.3085 177.6118 10 S 5.1480 7.8216 107.2495 57.4171 66.1311 173.8282 11 L 4.7300 9.2465 122.9145 53.9719 45.8558 174.3525 12 S 5.4696 8.7062 120.9077 57.1391 64.8675 173.2302 13 A 4.9050 9.3941 125.0094 51.0525 23.1521 175.3034 14 S 5.0217 9.3074 115.7975 56.6525 65.5262 174.5446 15 V 4.0187 8.3472 121.4910 64.5862 32.0007 176.3794 16 G 4.0326 9.4241 114.8141 45.4706 0.0000 173.5307 17 E 4.4540 7.8971 119.0177 56.5220 31.0766 175.7923 18 T 4.9686 8.2250 118.1064 62.2247 70.2655 174.5807 19 V 4.5565 8.5876 118.7851 59.7717 36.3592 174.6307 20 T 5.0787 8.3242 118.1992 61.7227 71.6986 173.4517 21 I 4.7236 8.8306 119.4218 59.3969 40.9195 174.5033 22 T 5.2931 9.2346 120.8930 62.1713 71.8243 172.6345 23 C 5.3818 9.9014 127.0527 55.7428 42.7950 173.4086 24 R 5.3985 9.5675 126.9967 55.0804 32.4553 171.1970 25 A 5.2064 8.7909 124.6776 49.9884 21.0428 177.0419 26 S 4.5718 8.5942 114.5062 58.2964 63.7527 174.0872 27 G 4.1115 7.5370 107.2957 44.4393 0.0000 172.7681 28 N 4.2201 8.6142 119.7004 53.5277 39.4347 174.7400 29 I 3.9867 8.0148 117.4330 59.8864 38.3983 175.1444 30 H 3.6427 8.9057 117.1549 57.3245 26.5608 175.2574 31 N 4.4169 8.2820 112.1157 53.9212 37.3715 175.7119 32 Y 4.6966 7.8043 118.6798 56.7215 36.6672 172.9558 33 L 5.2483 7.8060 122.3264 52.9267 45.8716 174.7823 34 A 5.3837 9.1424 127.4615 49.9766 22.8217 174.7889 35 W 5.4568 9.0437 118.9704 55.1682 33.0849 174.4083 36 Y 5.3030 10.1570 121.4574 56.2973 41.8334 174.0792 37 Q 4.6536 9.3514 123.8480 54.2584 31.9920 173.9979 38 Q 4.8532 9.1479 126.7409 54.4052 32.3776 174.3772 39 K 4.7900 8.5704 125.2332 54.4918 34.9575 175.8278 40 Q 4.0785 8.7771 123.0380 57.9293 29.0910 176.7369 41 G 3.9630 8.9158 113.3359 46.5274 0.0000 172.7471 42 K 4.6869 7.7873 116.8863 54.1112 36.3487 176.1846 43 S 4.5384 8.2453 114.3271 56.6243 64.3061 172.1655 44 P 4.7086 0.0000 0.0000 63.4182 32.2204 175.7581 45 Q 4.6934 9.0708 119.3054 53.9674 33.1064 174.5021 46 L 4.1241 8.9931 126.3049 55.7907 42.4981 175.2938 47 L 4.4975 9.2763 125.9139 55.9165 43.6310 176.3765 48 V 5.1535 7.6682 117.8359 61.2717 35.3232 173.1805 49 Y 5.1118 8.8198 123.7928 55.1369 41.9921 173.7310 50 Y 3.9317 9.5894 118.1440 59.2400 37.4635 171.2216 51 T 3.9248 8.5167 123.3305 64.4695 68.0007 174.5000 52 T 4.5730 7.5525 105.9603 61.3565 70.6372 173.7432 53 T 4.0727 7.7772 121.0354 62.9842 69.3307 174.2194 54 L 4.6822 8.4019 126.6187 54.3430 42.9265 176.9206 55 A 4.6240 9.4348 127.3551 52.0302 19.9646 177.5369 56 D 4.5656 8.5948 118.2922 54.5796 40.3680 178.0758 57 G 4.0713 8.8648 110.6055 45.0774 0.0000 174.0184 58 V 3.7326 7.3432 120.1160 61.5162 31.6820 174.1171 59 P 4.5078 0.0000 0.0000 62.9355 31.6753 176.9235 60 S 4.5149 8.5571 113.5105 59.3329 63.4253 174.9760 61 R 4.0695 7.9210 118.1832 58.0107 30.3856 175.7957 62 F 5.1046 7.7780 119.2719 56.3506 40.4023 175.5561 63 S 4.6697 9.3321 117.6117 56.9167 66.4720 173.2850 64 G 4.5354 8.8330 108.8638 44.1170 0.0000 171.7538 65 S 4.6751 8.9902 114.7278 57.2484 67.0463 172.8874 66 G 4.1836 7.9775 106.1748 43.3553 0.0000 172.2419 67 S 4.2416 7.7430 113.3444 57.9454 67.1714 179.8770 68 G 3.6598 8.1117 112.6140 47.2845 0.0000 174.8717 69 T 4.7976 8.6477 114.4951 60.8741 70.5915 171.8627 70 Q 4.7821 7.8524 124.0010 54.9414 31.8578 173.7179 71 Y 5.3416 9.2492 123.2745 56.6235 42.7735 174.6433 72 S 5.3392 9.6240 116.6355 57.0128 68.3017 172.8941 73 L 4.5593 8.5192 124.0815 53.0262 44.6288 174.8253 74 K 4.7837 9.1094 128.3241 54.6180 34.7060 174.7299 75 I 4.4110 8.5379 128.4024 59.3506 39.3700 174.4778 76 N 4.3833 9.0621 126.0277 54.1126 39.2885 176.1676 77 S 4.0271 8.3226 110.3588 57.5577 60.7706 170.4719 78 L 3.8897 8.8758 125.6080 54.9407 42.3425 176.9556 79 Q 4.9487 9.2952 121.5285 53.3211 30.8631 175.1075 80 P 4.6639 0.0000 0.0000 65.8396 31.5346 178.5903 81 D 4.5758 8.1554 116.1966 55.6146 39.4923 176.7246 82 D 4.7866 7.9968 118.7768 55.4081 41.3734 176.9868 83 F 4.4335 7.7887 117.5853 57.0059 39.9616 176.5675 84 G 3.8322 7.6420 109.6189 45.4688 0.0000 171.2543 85 S 5.3082 8.1784 116.5889 56.9912 65.7534 173.1059 86 Y 5.1247 8.9258 121.3659 56.4297 41.0329 174.3402 87 Y 5.6401 9.3833 120.8182 56.4578 42.0867 172.1486 88 C 4.9880 9.1206 117.5145 53.9071 44.1682 172.2893 89 Q 4.7654 8.8037 121.3891 54.8452 32.6747 173.2431 90 H 6.0142 8.1530 120.1944 52.7762 32.1659 173.5874 91 F 5.1900 8.7049 115.3752 57.1992 39.9488 175.6681 92 W 4.5134 9.0420 130.5481 56.2882 30.9008 176.7503 93 S 3.3990 7.7255 123.9663 58.9967 61.1309 172.8036 94 T 3.9269 8.4391 117.3196 62.3573 68.5973 172.2207 95 P 4.6067 0.0000 0.0000 62.5470 32.7441 175.6083 *97 T 4.4196 8.2380 111.1942 61.9295 70.5404 172.2314 98 F 5.1231 8.6046 119.9362 55.5771 41.9449 175.8953 99 G 4.0514 9.0556 111.6659 44.4592 0.0000 174.4570 100 G 3.6968 8.5500 107.8635 46.7411 0.0000 175.1939 101 G 3.7557 8.8024 105.1307 45.8755 0.0000 172.8921 102 T 4.7812 8.5201 116.7438 61.3447 72.2724 172.9318 103 K 4.5937 9.1378 129.0356 55.3262 33.8558 174.9975 104 L 5.1431 9.3883 131.2382 53.8481 43.6509 174.6048 105 E 5.0622 9.1879 126.9490 54.0030 32.5831 175.7456 106 I 3.4302 7.8869 124.5933 61.0078 38.6142 175.4235 107 K 4.1908 8.6929 130.1507 56.6481 31.6673 176.2138 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 4.65 0.00 2.71 2.53 0.00 0.00 0.00 0.00 0.00 0.00 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 8.24 4.24 1.85 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.19 0.89 0.00 0.00 3 V 9.18 4.44 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 4 L 8.37 5.29 0.00 1.64 1.51 0.86 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 5 T 9.23 4.72 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 6 Q 8.81 5.28 0.00 2.01 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.83 6.70 0.00 0.00 0.00 0.00 0.00 2.38 2.44 0.00 7 S 9.09 4.77 0.00 3.75 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 8 P 0.00 4.76 0.00 2.22 2.01 0.00 3.70 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.09 0.00 9 A 8.50 4.40 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 10 S 7.82 5.15 0.00 3.87 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 11 L 9.25 4.73 0.00 1.73 1.51 0.93 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 12 S 8.71 5.47 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 A 9.39 4.90 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 14 S 9.31 5.02 0.00 3.81 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 15 V 8.35 4.02 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 0.90 0.00 0.00 1.13 0.00 0.00 16 G 9.42 4.03 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 0.00 0.00 0.00 17 E 7.90 4.45 0.00 1.93 1.83 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 2.32 2.40 0.00 18 T 8.23 4.97 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 1.19 0.00 0.00 19 V 8.59 4.56 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 0.62 0.00 0.00 0.68 0.00 0.00 20 T 8.32 5.08 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 1.15 0.00 0.00 21 I 8.83 4.72 1.91 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.50 0.82 0.00 0.00 22 T 9.23 5.29 4.44 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 1.30 0.00 0.00 23 C 9.90 5.38 0.00 2.77 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 24 R 9.57 5.40 0.00 1.47 1.74 0.00 3.30 0.00 0.00 3.17 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.41 0.00 25 A 8.79 5.21 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 26 S 8.59 4.57 0.00 3.92 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 27 G 7.54 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 0.00 0.00 0.00 0.00 28 N 8.61 4.22 0.00 2.53 2.46 0.00 0.00 6.85 7.94 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 29 I 8.01 3.99 1.91 0.00 0.00 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.56 0.80 0.00 0.00 30 H 8.91 3.64 0.00 3.05 3.38 0.00 5.96 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 N 8.28 4.42 0.00 2.45 2.03 0.00 0.00 6.98 6.74 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 32 Y 7.80 4.70 0.00 3.20 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 33 L 7.81 5.25 0.00 0.96 0.97 0.41 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 34 A 9.14 5.38 1.42 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 35 W 9.04 5.46 0.00 3.20 3.12 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 0.00 0.00 0.00 0.00 36 Y 10.16 5.30 0.00 3.20 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 37 Q 9.35 4.65 0.00 1.85 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.76 0.00 0.00 0.00 0.00 0.00 2.03 1.54 0.00 38 Q 9.15 4.85 0.00 2.22 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.53 0.00 0.00 0.00 0.00 0.00 2.28 2.40 0.00 39 K 8.57 4.79 0.00 1.81 1.72 0.00 1.66 0.00 0.00 1.76 0.00 0.00 3.02 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.51 1.52 7.81 40 Q 8.78 4.08 0.00 2.02 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.85 0.00 0.00 0.00 0.00 0.00 2.37 2.46 0.00 41 G 8.92 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 42 K 7.79 4.69 0.00 1.73 1.69 0.00 1.72 0.00 0.00 1.76 0.00 0.00 3.04 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.58 1.51 7.81 43 S 8.25 4.54 0.00 3.93 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 44 P 0.00 4.71 0.00 1.82 2.00 0.00 3.53 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 1.73 1.94 0.00 45 Q 9.07 4.69 0.00 2.19 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.99 0.00 0.00 0.00 0.00 0.00 2.30 2.37 0.00 46 L 8.99 4.12 0.00 1.81 1.66 0.75 0.93 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 47 L 9.28 4.50 0.00 1.57 1.46 1.03 0.10 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 48 V 7.67 5.15 2.35 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 1.27 0.00 0.00 0.94 0.00 0.00 49 Y 8.82 5.11 0.00 3.01 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 50 Y 9.59 3.93 0.00 3.08 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 51 T 8.52 3.92 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 1.41 0.00 0.00 52 T 7.55 4.57 4.23 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 1.26 0.00 0.00 53 T 7.78 4.07 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 0.89 0.00 0.00 54 L 8.40 4.68 0.00 1.54 1.61 1.01 0.92 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 55 A 9.43 4.62 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 56 D 8.59 4.57 0.00 2.71 2.47 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 57 G 8.86 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 58 V 7.34 3.73 2.17 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 0.62 0.00 0.00 0.95 0.00 0.00 59 P 0.00 4.51 0.00 2.40 2.26 0.00 3.80 0.00 0.00 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.13 0.00 60 S 8.56 4.51 0.00 4.01 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 61 R 7.92 4.07 0.00 1.82 2.11 0.00 3.00 0.00 0.00 3.22 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.03 0.00 62 F 7.78 5.10 0.00 3.06 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 63 S 9.33 4.67 0.00 3.77 3.87 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 64 G 8.83 4.54 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 0.00 0.00 0.00 65 S 8.99 4.68 0.00 3.83 3.93 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 66 G 7.98 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 0.00 0.00 0.00 0.00 67 S 7.74 4.24 0.00 3.85 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 68 G 8.11 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 69 T 8.65 4.80 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 70 Q 7.85 4.78 0.00 2.04 1.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.49 6.74 0.00 0.00 0.00 0.00 0.00 2.18 2.28 0.00 71 Y 9.25 5.34 0.00 3.15 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 72 S 9.62 5.34 0.00 3.72 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 73 L 8.52 4.56 0.00 0.27 0.26 0.56 -0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 74 K 9.11 4.78 0.00 1.69 1.50 0.00 1.54 0.00 0.00 1.56 0.00 0.00 2.87 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.20 1.40 7.81 75 I 8.54 4.41 1.43 0.00 0.00 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.64 0.18 -0.06 0.00 0.00 76 N 9.06 4.38 0.00 2.42 2.64 0.00 0.00 7.23 7.58 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 77 S 8.32 4.03 0.00 3.92 3.75 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 78 L 8.88 3.89 0.00 1.68 1.27 0.71 0.36 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 79 Q 9.30 4.95 0.00 2.02 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.99 6.77 0.00 0.00 0.00 0.00 0.00 2.39 2.44 0.00 80 P 0.00 4.66 0.00 2.28 2.22 0.00 3.67 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.18 0.00 81 D 8.16 4.58 0.00 2.87 2.88 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 82 D 8.00 4.79 0.00 2.49 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 83 F 7.79 4.43 0.00 3.13 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 84 G 7.64 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 85 S 8.18 5.31 0.00 3.78 3.48 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 86 Y 8.93 5.12 0.00 3.00 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 87 Y 9.38 5.64 0.00 3.20 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 88 C 9.12 4.99 0.00 2.10 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 89 Q 8.80 4.77 0.00 1.50 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.69 0.00 0.00 0.00 0.00 0.00 1.33 1.16 0.00 90 H 8.15 6.01 0.00 3.41 3.27 0.00 5.73 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 F 8.70 5.19 0.00 2.95 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 92 W 9.04 4.51 0.00 3.59 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 93 S 7.73 3.40 0.00 3.97 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 94 T 8.44 3.93 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 1.16 0.00 0.00 95 P 0.00 4.61 0.00 1.62 1.61 0.00 3.79 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.67 0.00 *97 T 8.24 4.42 4.23 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 1.26 0.00 0.00 98 F 8.60 5.12 0.00 2.78 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 99 G 9.06 4.05 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 0.00 0.00 0.00 100 G 8.55 3.70 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 0.00 0.00 0.00 101 G 8.80 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 0.00 102 T 8.52 4.78 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 1.29 0.00 0.00 103 K 9.14 4.59 0.00 1.84 1.74 0.00 1.71 0.00 0.00 1.62 0.00 0.00 2.85 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.57 1.46 7.81 104 L 9.39 5.14 0.00 2.07 1.83 0.61 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 105 E 9.19 5.06 0.00 1.96 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 2.25 2.28 0.00 106 I 7.89 3.43 0.67 0.00 0.00 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.21 0.64 0.00 0.00 107 K 8.69 4.19 0.00 1.87 1.66 0.00 1.89 0.00 0.00 1.74 0.00 0.00 2.95 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.41 1.39 7.81 * Residues marked with a * may have inaccurate shift predictions.