NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 S 4.0945 8.3349 116.7841 57.8916 64.4361 171.0033 5 L 3.3797 8.1155 126.6209 52.8229 37.7825 172.5276 6 K 4.6524 9.2605 120.9122 56.1607 34.4857 176.6728 7 K 4.6354 8.9179 118.0706 54.5118 33.1631 176.7387 8 G 4.0089 7.1804 106.0699 46.5778 0.0000 173.0486 9 V 4.3952 8.1521 116.8908 67.5446 32.1595 177.7260 10 F 3.7804 7.7184 111.2721 57.8746 36.3905 175.4357 11 V 3.9122 7.1130 121.1402 61.0811 33.3063 176.2677 12 D 4.5651 8.3724 122.3314 53.4773 39.9584 176.5297 13 D 4.2578 8.4432 123.6982 57.9031 41.7642 179.3549 14 H 4.0228 8.3843 113.5598 59.1308 28.6942 176.7626 15 L 3.8643 7.2593 120.7406 57.4577 41.3344 179.4561 16 L 3.9354 7.6245 118.2373 58.5837 41.5266 178.6737 17 E 4.0685 8.2524 117.7004 60.3186 29.1741 178.6286 18 K 4.4418 7.8008 113.7626 57.4369 32.0426 178.2578 19 V 4.1658 7.3684 119.0061 63.4074 33.8000 176.7922 20 L 4.2818 8.7250 119.8096 56.8694 41.6375 178.7841 21 E 4.0517 8.8492 118.0277 59.0387 30.0272 178.6317 22 L 4.0934 7.8229 120.7256 57.4800 41.9098 177.6860 23 N 4.5774 7.6410 112.7764 53.7101 39.7173 175.5259 24 A 4.2996 7.7867 125.0675 51.4357 17.3475 178.0711 25 K 3.8264 8.5039 116.1371 55.5006 29.8640 175.4611 26 G 3.8708 7.4150 109.4526 45.8167 0.0000 173.5866 27 E 3.9186 8.6413 127.1262 57.0814 28.7984 178.0970 28 K 4.6835 8.3516 119.6911 55.3500 36.9728 176.2845 29 R 4.3135 8.5744 117.9087 56.2862 29.5558 177.4996 30 L 4.2397 7.6130 121.5386 55.2215 40.1720 175.0451 31 I 4.7384 7.7298 123.0973 58.5925 41.9360 173.4649 32 K 4.9649 8.5887 125.7119 55.0700 33.8949 174.8500 33 T 4.8171 8.1323 115.2563 60.8426 71.3219 174.0497 34 W 4.5323 8.9433 120.9659 55.7745 31.5217 175.3108 35 S 4.7758 8.3716 114.4044 56.6663 63.1327 174.0324 36 R 4.4547 8.5497 121.6868 56.6193 30.3915 177.9189 37 R 4.1562 8.1137 117.8320 59.1632 30.4304 176.9579 38 S 4.5771 7.9068 111.6512 58.2767 64.4802 173.2407 39 T 4.6368 7.5520 116.4783 61.4980 69.9375 174.9591 40 I 3.6788 8.3744 125.6693 61.8679 38.2301 175.6348 41 V 3.9426 8.0441 124.0888 60.6646 31.7354 174.1348 42 P 4.0388 0.0000 0.0000 64.2532 31.4296 177.2262 43 E 3.8059 9.0864 126.9713 57.8193 29.6510 176.6112 44 M 4.5043 8.7349 117.2872 55.3971 31.3927 177.0667 45 V 3.6959 8.8237 114.8788 61.2335 33.1716 177.1450 46 G 3.3751 7.8477 107.6105 46.7706 0.0000 174.2804 47 H 4.9741 7.2208 117.3690 53.0507 27.7841 174.1077 48 T 4.7235 8.2069 111.4612 61.5349 69.5947 173.6824 49 I 4.7597 8.1700 121.5603 59.8924 42.1361 174.4223 50 A 5.6651 8.6314 128.5349 49.8656 18.3439 176.2793 51 V 3.8758 7.8066 120.8255 62.9298 33.5175 174.9719 52 Y 4.7630 7.5199 127.4136 57.4713 40.5781 174.3161 53 N 4.1510 6.3276 115.6015 52.7550 38.7818 175.2009 54 G 3.7507 5.6806 108.3886 45.0648 0.0000 173.1887 55 K 4.3611 6.2461 117.4836 56.2576 34.6280 175.0134 56 Q 4.8793 7.1548 116.1029 55.2114 31.3297 172.9377 57 H 5.2266 8.5473 117.4487 56.1765 30.0956 175.2461 58 V 4.5844 8.0436 112.1210 58.9539 35.7079 173.1321 59 P 4.8755 0.0000 0.0000 62.9330 32.1683 176.5489 60 V 4.2124 8.6958 123.7326 59.6917 33.5360 173.4913 61 Y 4.7133 8.6564 128.0657 57.6118 37.5691 174.9052 62 I 3.5290 7.8186 125.8766 61.5021 38.8007 173.9342 63 T 4.7976 7.7075 120.3713 60.5345 71.0035 174.1999 64 E 4.0226 8.7880 120.2043 59.4079 29.9604 177.9247 65 N 4.4626 8.3334 116.1394 56.2300 38.8364 176.0285 66 M 4.6987 7.0197 113.3251 53.7079 30.8216 177.9345 67 V 3.9255 7.5174 128.6936 63.9442 32.0793 178.6887 68 G 3.7634 8.5333 103.8969 44.7121 0.0000 174.0890 69 H 4.8712 7.4138 114.7963 54.4203 30.1456 174.6953 70 K 5.2322 7.9250 122.5109 55.9353 34.1653 177.2180 71 L 4.3353 8.9585 122.2823 57.5746 41.4423 180.1154 72 G 3.6005 8.1190 105.6847 47.8796 0.0000 175.3316 73 E 4.0477 7.7110 119.8100 57.4369 29.5601 177.8326 74 F 4.7882 7.5635 115.8760 56.8734 39.6193 175.9883 75 A 4.5815 8.3819 125.3459 48.6661 19.0866 173.7910 76 P 4.1222 0.0000 0.0000 63.6247 31.0800 176.8026 77 T 4.0604 7.8195 112.5992 63.5907 69.7220 175.3978 78 R 4.3107 7.4999 122.7874 54.8224 31.5546 176.0367 79 T 4.6241 9.0362 115.8077 61.0851 70.7371 174.3605 80 Y 5.6839 8.7977 135.0000 59.0590 38.3320 172.0619 81 R 3.4619 7.6594 117.8322 55.4527 30.8573 176.3257 *82 G 3.7274 8.4167 106.2548 46.1704 0.0000 172.8019 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 8.12 3.38 0.00 1.76 1.93 1.15 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 6 K 9.26 4.65 0.00 1.82 1.86 0.00 1.53 0.00 0.00 1.71 0.00 0.00 2.93 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.29 1.36 7.81 7 K 8.92 4.64 0.00 1.72 1.82 0.00 1.80 0.00 0.00 1.72 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 8.15 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 7.72 3.78 0.00 3.36 3.43 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 11 V 7.11 3.91 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 4.57 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 8.44 4.26 0.00 2.76 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 14 H 8.38 4.02 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 7.26 3.86 0.00 1.83 1.75 0.97 0.37 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 7.62 3.94 0.00 1.84 1.73 0.88 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 17 E 8.25 4.07 0.00 2.06 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 0.00 2.32 2.39 0.00 18 K 7.80 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 0.85 0.00 0.00 0.93 0.00 0.00 20 L 8.73 4.28 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 1.91 0.00 0.00 0.00 0.00 0.00 0.00 21 E 8.85 4.05 0.00 2.04 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 4.09 0.00 1.82 1.71 0.81 0.65 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 23 N 7.64 4.58 0.00 2.91 2.98 0.00 0.00 7.10 7.29 0.00 0.00 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 7.79 4.30 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 25 K 8.50 3.83 0.00 1.93 1.95 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 8.64 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 8.35 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 1.85 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 0.94 0.00 0.00 32 K 8.59 4.96 0.00 1.55 1.29 0.00 1.58 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 8.13 4.82 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 1.21 0.00 0.00 34 W 8.94 4.53 0.00 3.52 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 35 S 8.37 4.78 0.00 4.03 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 0.00 36 R 8.55 4.45 0.00 2.08 2.16 0.00 3.10 0.00 0.00 3.28 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.71 0.00 37 R 8.11 4.16 0.00 1.98 2.19 0.00 3.37 0.00 0.00 3.39 7.33 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 7.91 4.58 0.00 3.78 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 1.11 0.00 0.00 40 I 8.37 3.68 1.99 0.00 0.00 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 1.11 0.65 0.87 0.00 0.00 41 V 8.04 3.94 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 3.81 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 8.73 4.50 0.00 1.91 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 8.82 3.70 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 0.72 0.00 0.00 0.80 0.00 0.00 46 G 7.85 3.38 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 0.00 0.00 0.00 0.00 47 H 7.22 4.97 0.00 3.11 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 0.60 0.87 0.00 0.00 50 A 8.63 5.67 1.19 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 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 7.52 4.76 0.00 2.52 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 6.33 4.15 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 5.68 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 6.25 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 1.44 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 8.55 5.23 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 8.04 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 0.93 0.00 0.00 0.97 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 4.71 0.00 2.91 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 3.53 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 1.05 0.72 0.00 0.00 63 T 7.71 4.80 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 1.19 0.00 0.00 64 E 8.79 4.02 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 8.33 4.46 0.00 2.74 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 2.14 1.73 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 2.43 2.35 0.00 67 V 7.52 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 1.06 0.00 0.00 68 G 8.53 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 69 H 7.41 4.87 0.00 3.62 3.54 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 7.93 5.23 0.00 2.29 2.09 0.00 1.86 0.00 0.00 2.04 0.00 0.00 3.15 0.00 0.00 3.24 0.00 0.00 0.00 0.00 1.58 1.53 7.81 71 L 8.96 4.34 0.00 1.77 1.84 0.98 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 72 G 8.12 3.60 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 0.00 0.00 0.00 73 E 7.71 4.05 0.00 1.57 1.52 0.00 0.00 0.00 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 2.34 0.00 74 F 7.56 4.79 0.00 3.20 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 8.38 4.58 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 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 1.99 0.00 77 T 7.82 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 1.94 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 9.04 4.62 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 8.80 5.68 0.00 2.95 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 81 R 7.66 3.46 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.