NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- *-2 H 4.7801 8.4449 117.3866 55.0175 31.0753 174.4232 -1 H 4.0321 9.5708 119.1380 58.2969 29.4672 174.5755 0 H 4.6699 9.6254 114.6683 55.9458 27.0879 173.4927 1 M 4.3281 8.7893 119.9982 54.5312 33.9104 177.0547 2 L 5.3753 8.8667 124.6706 52.9452 41.6134 175.9074 3 I 4.5157 7.9825 117.3628 59.2740 40.6965 174.6523 4 K 5.0931 8.8425 122.7503 54.7638 35.1951 175.4436 5 V 4.7405 8.8166 122.9968 61.1081 34.6666 174.2504 6 K 5.0471 8.8224 127.9644 55.3031 33.9692 177.0495 7 T 4.6052 8.5421 115.3680 60.3269 70.0526 175.6137 8 L 4.1886 8.4441 121.3549 56.8979 41.5335 178.1254 9 T 4.3087 7.9740 107.1338 61.1597 69.7689 175.3499 10 G 3.9290 8.4782 111.3907 44.5649 0.0000 173.5605 11 K 3.9957 7.7353 122.6395 56.6059 33.1747 175.0430 12 E 5.0233 8.8007 129.2160 55.0902 30.7420 175.0190 13 I 4.6322 8.8426 120.7528 59.0558 40.7851 174.0482 14 E 5.0087 8.7122 125.1864 55.2546 31.3410 174.9955 15 I 4.7220 8.6045 125.0817 59.6732 42.3864 173.4024 16 D 5.3826 8.6310 124.8878 52.7875 43.3228 175.1317 17 I 4.8790 8.8280 118.9461 59.6278 42.0005 173.3806 18 E 5.0782 9.0351 120.2353 53.6112 33.0635 176.0528 19 P 4.2651 0.0000 0.0000 65.7806 31.3861 178.3517 20 T 4.0871 7.7013 107.5754 63.1174 69.5321 174.7316 21 D 4.3866 7.9430 124.0440 54.2277 41.4857 176.4340 22 K 5.2343 8.4163 122.6407 55.5459 33.2040 178.2100 23 V 3.6047 8.4634 120.2695 66.0734 31.3595 177.9204 24 E 3.9069 8.3291 118.6360 59.8800 29.3810 179.6328 25 R 4.2196 7.8773 119.2850 58.6102 30.2454 178.4705 26 I 3.6878 7.7026 119.3561 64.3426 37.0655 178.3336 27 K 4.2429 7.9051 120.4780 58.9911 31.3359 179.2382 28 E 3.9789 8.1633 118.9035 59.5203 29.4870 179.6933 29 R 3.9713 8.0596 118.1890 58.8731 29.9732 179.3449 30 V 3.6039 7.6816 117.7635 65.9636 31.6560 177.3654 31 E 3.9594 8.3745 119.5368 59.6711 29.1353 178.3746 32 E 3.9253 7.9335 117.6495 59.0984 29.6334 178.4185 33 K 4.2326 7.3745 115.9342 58.0074 32.7951 177.7386 34 E 4.5829 8.6797 116.8575 55.2194 31.2525 176.7374 35 G 3.8610 7.9688 106.1092 45.2506 0.0000 173.2406 36 I 3.9247 7.3738 120.5190 59.7027 37.2195 174.1945 37 P 4.2966 0.0000 0.0000 62.1553 31.8660 175.9089 38 P 4.1835 0.0000 0.0000 66.1844 31.5671 179.2372 39 Q 4.0590 8.0989 115.6539 57.8669 28.0421 181.2599 40 Q 4.2929 8.0592 114.7302 57.0085 29.0149 176.0515 41 Q 4.1575 7.9861 119.1766 55.3762 29.5731 174.9426 42 R 4.4632 8.3934 121.1085 54.4548 33.1803 174.4844 43 L 4.9947 8.3091 124.1688 53.8655 44.2881 176.1730 44 I 5.0884 8.3690 121.5907 60.0012 41.6658 173.6370 45 Y 4.9955 8.7769 127.5611 56.6069 42.1796 175.4269 46 S 3.4955 9.2515 122.3645 59.4862 60.6692 173.5005 47 G 3.9116 8.4050 109.6547 46.0411 0.0000 174.9565 48 K 4.2738 8.1707 122.7701 53.6293 32.6302 181.1836 49 Q 4.7288 8.5352 125.5222 54.5568 29.4552 175.2980 50 M 3.6015 8.2120 127.8108 54.7336 32.5915 176.1355 51 N 4.4453 9.7298 124.9475 53.4690 39.8493 175.2908 52 D 4.4221 9.2038 126.5902 57.7329 41.0820 178.6211 53 E 4.1115 8.5761 117.6088 57.8235 30.4147 176.9717 54 K 4.4268 7.8552 118.5614 56.0263 33.3882 175.4778 55 T 5.1497 7.9350 106.9991 60.1880 72.2620 174.4936 56 A 4.2720 8.8231 124.7627 55.3802 18.8354 180.2142 57 A 4.0313 8.2997 118.8859 55.3578 18.5864 179.4690 58 D 4.2449 7.8324 114.4486 56.9918 40.8598 177.0831 59 Y 4.5713 7.3346 114.6437 56.7104 38.2401 175.4735 60 K 3.8008 7.8866 117.9955 57.3727 30.2249 176.3270 61 I 3.8272 7.7748 122.5461 61.5801 36.5998 176.8065 62 L 4.6379 8.0571 132.8465 53.1663 42.9782 173.4483 63 G 3.7682 9.1227 105.0557 49.9139 0.0000 175.1000 64 G 4.0012 8.9188 104.2043 45.5995 0.0000 174.1450 65 S 4.3795 7.9950 116.1720 58.8212 64.2910 174.0262 66 V 4.7326 8.4458 121.1893 61.3316 33.4589 174.9908 67 L 4.8332 9.1273 128.6852 54.3787 44.0668 175.6523 68 H 5.2457 8.6907 117.1587 54.0640 32.4027 173.0103 69 L 4.7971 8.7026 123.7167 54.6171 42.2906 176.5602 70 V 4.6005 8.4744 121.7631 61.4399 35.0787 173.6255 71 L 4.7808 8.3992 124.7778 53.2814 45.4746 175.1594 72 A 4.6526 8.3055 123.1339 50.2144 21.4859 175.3653 73 L 4.6410 8.5291 125.4175 53.7674 43.5291 177.8073 74 R 4.0974 8.6503 121.6797 58.5490 29.8446 175.2424 75 G 4.0382 7.8153 105.6011 45.0988 0.0000 173.7551 76 G 3.7305 8.2261 107.4384 46.0793 0.0000 173.4940 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 *-2 H 8.44 4.78 0.00 2.95 2.94 0.00 7.18 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 -1 H 9.57 4.03 0.00 3.34 3.42 0.00 5.97 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0 H 9.63 4.67 0.00 3.17 3.34 0.00 5.80 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 1 M 8.79 4.33 0.00 1.91 2.01 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.55 0.00 2 L 8.87 5.38 0.00 1.50 1.63 0.93 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 3 I 7.98 4.52 1.76 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.66 0.92 0.00 0.00 4 K 8.84 5.09 0.00 1.66 1.70 0.00 1.60 0.00 0.00 1.57 0.00 0.00 2.77 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.34 1.33 7.81 5 V 8.82 4.74 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 1.01 0.00 0.00 0.88 0.00 0.00 6 K 8.82 5.05 0.00 1.69 1.72 0.00 1.74 0.00 0.00 1.78 0.00 0.00 3.04 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.36 1.24 7.81 7 T 8.54 4.61 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 1.25 0.00 0.00 8 L 8.44 4.19 0.00 1.66 1.78 0.92 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 9 T 7.97 4.31 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 1.21 0.00 0.00 10 G 8.48 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 0.00 0.00 0.00 11 K 7.74 4.00 0.00 1.84 1.71 0.00 1.62 0.00 0.00 1.76 0.00 0.00 2.83 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.43 1.39 7.81 12 E 8.80 5.02 0.00 2.01 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 2.23 2.28 0.00 13 I 8.84 4.63 1.86 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.93 0.90 0.00 0.00 14 E 8.71 5.01 0.00 1.98 1.86 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 2.21 2.45 0.00 15 I 8.60 4.72 1.83 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 1.09 0.74 0.87 0.00 0.00 16 D 8.63 5.38 0.00 2.75 2.46 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 0.00 17 I 8.83 4.88 1.84 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 1.18 0.69 0.87 0.00 0.00 18 E 9.04 5.08 0.00 2.01 1.81 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 2.19 2.36 0.00 19 P 0.00 4.27 0.00 2.13 2.23 0.00 3.52 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.52 0.00 20 T 7.70 4.09 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 1.19 0.00 0.00 21 D 7.94 4.39 0.00 2.84 2.64 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 22 K 8.42 5.23 0.00 1.82 1.95 0.00 2.15 0.00 0.00 1.70 0.00 0.00 2.85 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.54 1.39 7.81 23 V 8.46 3.60 2.23 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 1.02 0.00 0.00 1.01 0.00 0.00 24 E 8.33 3.91 0.00 2.05 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 2.35 2.52 0.00 25 R 7.88 4.22 0.00 1.91 1.99 0.00 3.15 0.00 0.00 3.30 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.51 0.00 26 I 7.70 3.69 2.01 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.84 0.86 0.00 0.00 27 K 7.91 4.24 0.00 2.00 1.84 0.00 1.77 0.00 0.00 1.92 0.00 0.00 2.92 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.59 1.31 7.81 28 E 8.16 3.98 0.00 2.22 1.99 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 2.32 2.54 0.00 29 R 8.06 3.97 0.00 1.97 1.95 0.00 3.26 0.00 0.00 3.07 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.75 0.00 30 V 7.68 3.60 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 1.09 0.00 0.00 0.95 0.00 0.00 31 E 8.37 3.96 0.00 2.19 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 0.00 2.31 2.50 0.00 32 E 7.93 3.93 0.00 2.19 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 0.00 2.32 2.36 0.00 33 K 7.37 4.23 0.00 1.96 1.83 0.00 1.69 0.00 0.00 1.62 0.00 0.00 2.98 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.42 1.60 7.81 34 E 8.68 4.58 0.00 1.87 1.91 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 2.20 2.31 0.00 35 G 7.97 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 0.00 0.00 0.00 36 I 7.37 3.92 1.86 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.57 0.90 0.00 0.00 37 P 0.00 4.30 0.00 2.17 1.99 0.00 3.60 0.00 0.00 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.11 0.00 38 P 0.00 4.18 0.00 2.17 2.10 0.00 3.60 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.08 0.00 39 Q 8.10 4.06 0.00 2.07 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 7.02 0.00 0.00 0.00 0.00 0.00 2.28 1.96 0.00 40 Q 8.06 4.29 0.00 2.20 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 6.79 0.00 0.00 0.00 0.00 0.00 2.37 2.32 0.00 41 Q 7.99 4.16 0.00 2.27 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.80 6.74 0.00 0.00 0.00 0.00 0.00 2.36 2.50 0.00 42 R 8.39 4.46 0.00 1.89 1.82 0.00 3.27 0.00 0.00 3.33 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.55 0.00 43 L 8.31 4.99 0.00 1.51 1.49 0.86 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 44 I 8.37 5.09 2.00 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 1.54 0.92 0.00 0.00 45 Y 8.78 5.00 0.00 2.93 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 46 S 9.25 3.50 0.00 3.69 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 G 8.41 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 0.00 0.00 0.00 48 K 8.17 4.27 0.00 1.64 1.69 0.00 1.80 0.00 0.00 1.57 0.00 0.00 2.82 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.34 1.24 7.81 49 Q 8.54 4.73 0.00 2.06 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.72 7.02 0.00 0.00 0.00 0.00 0.00 2.31 2.38 0.00 50 M 8.21 3.60 0.00 1.50 1.77 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 1.28 0.00 51 N 9.73 4.45 0.00 2.85 2.86 0.00 0.00 6.78 8.36 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 52 D 9.20 4.42 0.00 2.75 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 53 E 8.58 4.11 0.00 1.92 2.06 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 2.32 2.33 0.00 54 K 7.86 4.43 0.00 2.11 1.96 0.00 1.67 0.00 0.00 1.70 0.00 0.00 2.93 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.52 1.59 7.81 55 T 7.93 5.15 4.43 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 1.27 0.00 0.00 56 A 8.82 4.27 1.38 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 57 A 8.30 4.03 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 58 D 7.83 4.24 0.00 2.62 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 0.00 0.00 0.00 0.00 59 Y 7.33 4.57 0.00 3.21 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 60 K 7.89 3.80 0.00 2.01 1.97 0.00 1.74 0.00 0.00 1.72 0.00 0.00 3.01 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.42 1.42 7.81 61 I 7.77 3.83 1.94 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 0.29 0.43 0.65 0.00 0.00 62 L 8.06 4.64 0.00 1.66 1.41 0.92 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 63 G 9.12 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 64 G 8.92 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.00 4.38 0.00 3.62 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 66 V 8.45 4.73 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 0.73 0.00 0.00 1.01 0.00 0.00 67 L 9.13 4.83 0.00 1.54 1.54 0.80 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 68 H 8.69 5.25 0.00 3.15 3.17 0.00 5.80 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 L 8.70 4.80 0.00 1.67 1.59 0.91 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 70 V 8.47 4.60 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 0.73 0.00 0.00 0.94 0.00 0.00 71 L 8.40 4.78 0.00 1.55 1.46 0.92 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 72 A 8.31 4.65 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 73 L 8.53 4.64 0.00 1.63 1.59 0.92 0.93 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 74 R 8.65 4.10 0.00 1.83 1.84 0.00 3.26 0.00 0.00 3.23 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.19 0.00 75 G 7.82 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 76 G 8.23 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.