NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 S 4.0913 8.3349 116.7839 57.8517 64.4383 171.0438 5 L 3.3745 8.1085 126.5630 52.8393 37.8199 172.5291 6 K 4.6470 9.2672 121.0044 56.1758 34.4771 176.6650 7 K 4.6325 8.9300 118.0219 54.5114 33.1540 176.7551 8 G 4.0105 7.1771 106.0345 46.5886 0.0000 173.1003 9 V 4.3973 8.1621 117.0711 67.4116 32.1523 177.6121 10 F 3.7833 7.7588 111.0718 57.8443 36.4081 175.4094 11 V 3.9181 7.1146 121.3909 61.0664 33.2793 176.2273 12 D 4.5595 8.3691 122.3303 53.4609 40.0086 176.4595 13 D 4.2495 8.4498 123.7084 57.9213 41.7810 179.3655 14 H 4.0029 8.3588 113.5558 59.1101 28.8127 176.7812 15 L 3.8651 7.2679 120.8146 57.4633 41.3379 179.4478 16 L 3.9440 7.6410 118.0446 58.5968 41.5131 178.6598 17 E 4.0576 8.2496 117.6516 60.3373 29.1732 178.6114 18 K 4.4418 7.8071 113.8161 57.4475 32.0546 178.2594 19 V 4.1680 7.3735 118.9706 63.3614 33.7778 176.7830 20 L 4.2854 8.7143 119.8207 56.8617 41.6542 178.7650 21 E 4.0521 8.8935 118.0622 58.9989 30.0278 178.0856 22 L 3.9987 7.8230 121.1704 57.6594 42.4316 177.6782 23 N 4.4272 7.8892 113.1637 54.4073 38.3854 175.5890 24 A 4.3093 7.7989 123.0149 51.3824 17.2275 178.1362 25 K 3.7750 8.4667 116.1127 55.4489 29.8553 175.5453 26 G 3.8720 7.4067 109.5024 45.8711 0.0000 173.5837 27 E 3.9205 8.6280 127.0700 57.0855 28.8171 178.0778 28 K 4.6833 8.3405 119.6979 55.3575 36.9786 176.2829 29 R 4.3122 8.5713 117.9013 56.2796 29.5574 177.4815 30 L 4.2376 7.6119 121.5196 55.2252 40.1899 175.0436 31 I 4.7392 7.7321 123.1329 58.6028 41.9337 173.4625 32 K 4.9648 8.5910 125.7347 55.0594 33.8458 174.8421 33 T 4.8123 8.1384 115.2561 60.8123 71.3275 174.0404 34 W 4.4749 8.9439 121.0102 55.7614 31.4676 175.3007 35 S 4.7820 8.3738 114.4002 56.6598 63.4010 174.0321 36 R 4.4599 8.4866 121.8132 56.5960 30.4594 178.7546 37 R 4.0216 8.1163 117.7995 59.1601 30.4203 176.9777 38 S 4.5741 7.4477 109.4973 58.2470 64.4194 173.4295 39 T 4.6371 7.5466 116.5193 61.5082 69.9453 174.9524 40 I 3.6811 8.3722 125.6271 61.8727 38.2257 175.6271 41 V 3.9452 8.0428 124.0856 60.6672 31.6421 174.1397 42 P 4.0441 0.0000 0.0000 64.2486 31.5075 177.2256 43 E 3.9760 9.0863 127.0145 57.8438 29.6432 176.6561 44 M 4.4922 8.8285 116.9660 55.4120 31.4185 177.0781 45 V 3.6933 8.7793 115.0231 61.2545 33.1707 177.1340 46 G 3.3641 7.8645 107.6640 46.7798 0.0000 174.2740 47 H 4.9755 7.2282 117.3726 53.0594 27.7928 174.1027 48 T 4.7239 8.2111 111.4461 61.5555 69.5835 173.6898 49 I 4.7630 8.1699 121.5897 59.8934 42.1349 174.4170 50 A 5.6719 8.6326 128.5180 49.8731 18.3107 176.3378 51 V 3.8795 7.8132 120.8273 62.9344 33.5276 174.9118 52 Y 4.7554 7.5049 126.9880 57.3492 40.5681 174.3468 53 N 4.1582 6.3881 115.4170 52.7661 38.7577 175.2123 54 G 3.7487 5.7502 108.4222 45.0735 0.0000 173.2192 55 K 4.3576 6.2602 117.5154 56.2715 34.5866 175.0285 56 Q 4.8779 7.1489 116.0592 55.2134 31.3246 172.9318 57 H 5.2418 8.5435 117.4244 56.1705 30.0960 175.2505 58 V 4.5843 7.9631 112.1388 58.9374 35.6857 173.1554 59 P 4.8805 0.0000 0.0000 62.9286 32.1734 176.5477 60 V 4.2086 8.7035 123.7085 59.7222 33.5655 173.5144 61 Y 4.7239 8.6594 128.0823 57.5779 37.4941 174.8836 62 I 3.5206 7.8228 125.7686 61.5013 39.1725 173.9401 63 T 4.7453 7.7066 120.3959 60.5257 71.0214 174.1864 64 E 3.9699 8.7971 120.0480 59.4318 29.9609 177.8901 65 N 4.4588 8.3385 116.1451 56.2035 38.8476 176.0104 66 M 4.6986 7.0153 113.1091 53.6898 30.8386 177.8882 67 V 3.9254 7.5066 128.5306 63.9498 32.0768 178.6030 68 G 3.7657 8.5374 103.8789 44.7600 0.0000 174.2122 69 H 4.8639 7.4404 114.9118 54.4233 29.9958 174.7036 70 K 5.2683 7.8770 122.5817 56.2212 34.1916 177.2491 71 L 4.1744 8.9312 122.0291 57.6532 42.1790 179.8727 72 G 3.5690 8.2983 107.8021 48.7638 0.0000 175.4884 73 E 3.9158 7.6721 119.2883 57.7435 29.6138 177.9767 74 F 4.7923 7.7710 115.9235 56.8683 39.5283 176.0074 75 A 4.5823 8.3595 125.4006 48.7061 19.1219 173.8069 76 P 4.1228 0.0000 0.0000 63.6208 31.1030 176.8398 77 T 4.0602 7.8446 112.6088 63.6058 69.7221 175.3087 78 R 4.3089 7.4984 122.8059 54.7969 31.5465 176.0564 79 T 4.6128 8.9818 115.9405 61.2446 70.6327 174.3189 80 Y 5.6649 8.7688 135.0000 59.0292 38.4394 172.1238 81 R 3.4778 7.6987 117.8332 55.5346 30.8008 176.3382 *82 G 3.7274 8.4171 106.2320 46.1726 0.0000 172.8011 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 4 S 8.33 4.09 0.00 3.86 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 5 L 8.11 3.37 0.00 1.75 1.92 1.14 0.51 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 6 K 9.27 4.65 0.00 1.82 1.86 0.00 1.53 0.00 0.00 1.71 0.00 0.00 2.94 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.29 1.36 7.81 7 K 8.93 4.63 0.00 1.72 1.82 0.00 1.80 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.33 1.46 7.81 8 G 7.18 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 9 V 8.16 4.40 2.02 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 0.68 0.00 0.00 0.94 0.00 0.00 10 F 7.76 3.78 0.00 3.36 3.45 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 11 V 7.11 3.92 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 0.72 0.00 0.00 0.84 0.00 0.00 12 D 8.37 4.56 0.00 2.71 2.44 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 13 D 8.45 4.25 0.00 2.76 2.69 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 0.00 0.00 0.00 0.00 14 H 8.36 4.00 0.00 3.33 3.56 0.00 5.49 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 L 7.27 3.87 0.00 1.82 1.75 0.97 0.42 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 16 L 7.64 3.94 0.00 1.85 1.73 0.94 1.25 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 17 E 8.25 4.06 0.00 2.06 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 2.32 2.39 0.00 18 K 7.81 4.44 0.00 1.79 1.81 0.00 1.59 0.00 0.00 1.65 0.00 0.00 3.14 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.48 1.66 7.81 19 V 7.37 4.17 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 0.84 0.00 0.00 0.90 0.00 0.00 20 L 8.71 4.29 0.00 1.60 1.67 0.91 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 21 E 8.89 4.05 0.00 2.02 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 0.00 2.48 2.29 0.00 22 L 7.82 4.00 0.00 1.79 1.71 0.80 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 23 N 7.89 4.43 0.00 2.88 2.97 0.00 0.00 7.10 7.49 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 24 A 7.80 4.31 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 25 K 8.47 3.78 0.00 1.93 1.96 0.00 1.90 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.33 1.42 7.81 26 G 7.41 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 0.00 0.00 0.00 27 E 8.63 3.92 0.00 1.94 1.77 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 2.30 2.39 0.00 28 K 8.34 4.68 0.00 1.68 1.65 0.00 1.77 0.00 0.00 1.76 0.00 0.00 3.05 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.34 1.36 7.81 29 R 8.57 4.31 0.00 2.01 2.12 0.00 3.13 0.00 0.00 3.23 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.74 0.00 30 L 7.61 4.24 0.00 1.63 1.66 0.92 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 31 I 7.73 4.74 1.85 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.52 0.97 0.00 0.00 32 K 8.59 4.96 0.00 1.54 1.28 0.00 1.57 0.00 0.00 1.59 0.00 0.00 2.73 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.14 1.31 7.81 33 T 8.14 4.81 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 34 W 8.94 4.47 0.00 3.52 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 35 S 8.37 4.78 0.00 4.03 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 36 R 8.49 4.46 0.00 2.15 2.28 0.00 3.03 0.00 0.00 3.39 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.71 0.00 37 R 8.12 4.02 0.00 1.98 2.19 0.00 3.37 0.00 0.00 3.39 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.79 0.00 38 S 7.45 4.57 0.00 3.85 3.98 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 39 T 7.55 4.64 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 1.12 0.00 0.00 40 I 8.37 3.68 1.99 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.64 0.80 0.00 0.00 41 V 8.04 3.95 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 0.77 0.00 0.00 0.87 0.00 0.00 42 P 0.00 4.04 0.00 2.18 1.96 0.00 3.71 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 2.08 2.05 0.00 43 E 9.09 3.98 0.00 2.10 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 2.23 2.24 0.00 44 M 8.83 4.49 0.00 1.88 2.07 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 2.64 2.54 0.00 45 V 8.78 3.69 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 0.80 0.00 0.00 0.80 0.00 0.00 46 G 7.86 3.36 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 47 H 7.23 4.98 0.00 3.12 3.17 0.00 5.70 0.00 0.00 0.00 0.00 6.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 T 8.21 4.72 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 1.48 0.00 0.00 49 I 8.17 4.76 1.83 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.62 0.92 0.00 0.00 50 A 8.63 5.67 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 51 V 7.81 3.88 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 0.96 0.00 0.00 0.94 0.00 0.00 52 Y 7.50 4.76 0.00 2.48 2.82 0.00 0.00 0.00 0.00 0.00 0.00 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 N 6.39 4.16 0.00 2.63 2.67 0.00 0.00 6.19 7.00 0.00 0.00 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 G 5.75 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 0.00 0.00 0.00 55 K 6.26 4.36 0.00 1.59 1.59 0.00 1.72 0.00 0.00 1.75 0.00 0.00 2.97 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.30 1.45 7.81 56 Q 7.15 4.88 0.00 2.07 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.95 6.80 0.00 0.00 0.00 0.00 0.00 2.23 2.37 0.00 57 H 8.54 5.24 0.00 3.02 3.21 0.00 5.70 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 V 7.96 4.58 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 0.96 0.00 0.00 1.02 0.00 0.00 59 P 0.00 4.88 0.00 2.09 2.08 0.00 3.72 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.97 0.00 60 V 8.70 4.21 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 0.80 0.00 0.00 0.85 0.00 0.00 61 Y 8.66 4.72 0.00 2.92 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 62 I 7.82 3.52 1.62 0.00 0.00 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 1.06 0.70 0.00 0.00 63 T 7.71 4.75 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 1.20 0.00 0.00 64 E 8.80 3.97 0.00 2.09 2.02 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 2.26 2.32 0.00 65 N 8.34 4.46 0.00 2.73 2.97 0.00 0.00 6.92 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 66 M 7.02 4.70 0.00 2.18 1.73 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.35 0.00 67 V 7.51 3.93 1.96 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 0.75 0.00 0.00 1.09 0.00 0.00 68 G 8.54 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 69 H 7.44 4.86 0.00 3.62 3.53 0.00 5.74 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 K 7.88 5.27 0.00 2.29 2.08 0.00 1.84 0.00 0.00 2.04 0.00 0.00 3.14 0.00 0.00 3.24 0.00 0.00 0.00 0.00 1.58 1.53 7.81 71 L 8.93 4.17 0.00 1.79 1.84 1.00 0.90 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 72 G 8.30 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 7.67 3.92 0.00 1.57 1.53 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 2.25 2.28 0.00 74 F 7.77 4.79 0.00 3.17 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 75 A 8.36 4.58 1.24 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 0.00 0.00 0.00 76 P 0.00 4.12 0.00 2.17 2.10 0.00 3.77 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 1.99 2.00 0.00 77 T 7.84 4.06 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 1.20 0.00 0.00 78 R 7.50 4.31 0.00 1.85 1.93 0.00 3.20 0.00 0.00 3.24 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.71 0.00 79 T 8.98 4.61 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 1.24 0.00 0.00 80 Y 8.77 5.66 0.00 2.94 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 81 R 7.70 3.48 0.00 1.75 1.85 0.00 3.51 0.00 0.00 3.26 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.60 0.00 *82 G 8.42 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.