NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.8102 8.3044 120.6226 55.5464 33.6431 174.2676 2 F 4.6657 9.1654 127.5624 56.2281 42.8185 171.8358 3 Q 5.1452 7.9980 123.5573 54.6192 33.4018 173.6275 4 Q 4.5192 8.8170 121.1529 55.1801 32.9279 173.2758 5 E 5.1716 8.6652 124.7919 55.6477 31.6497 175.7222 6 V 4.5236 8.5135 119.8505 61.0728 35.1897 172.7363 7 T 4.9345 8.3703 119.6597 62.1219 70.4868 174.2441 8 I 4.1634 8.8374 128.3073 61.2175 37.7742 176.6272 9 T 4.2673 8.6593 116.2364 61.7238 70.2836 174.3002 *10 A 4.3267 7.6842 128.5461 51.3927 20.0382 175.0959 11 P 4.3517 0.0000 0.0000 65.6501 31.4902 176.7447 12 N 4.7349 8.2588 114.1679 51.8957 39.3476 175.9320 13 G 3.8054 7.6064 107.2443 46.6102 0.0000 175.7646 14 L 4.2653 8.3070 118.0600 53.8684 40.5307 176.6905 15 D 4.7381 8.3824 121.9466 53.5413 42.6458 177.6934 16 T 3.1923 7.7931 110.4295 64.3506 69.0611 175.4682 17 R 3.8943 8.1525 121.1375 59.7132 30.6686 176.9850 18 P 4.2980 0.0000 0.0000 65.4606 31.2612 178.4991 19 A 4.0006 8.5220 119.8808 55.1477 18.3016 179.5802 20 A 3.9448 8.2742 119.4597 55.2435 18.4427 179.6686 21 Q 3.9162 8.3093 118.1891 59.1670 29.0623 178.2245 22 F 4.0758 8.6010 121.9966 61.3902 39.4965 177.2533 23 V 3.8736 8.1993 119.4398 65.3577 31.0708 177.8709 24 K 3.9064 8.0015 118.4762 59.5507 32.3236 178.3915 25 E 3.9933 8.2989 118.7038 59.2088 29.3808 179.1303 26 A 4.0690 8.1242 121.2589 55.0922 18.2164 179.7547 27 K 4.1543 8.0722 115.8292 58.8270 32.1526 179.1488 28 G 3.3977 7.6782 104.8708 45.1506 0.0000 173.3662 29 F 4.9772 7.1838 119.7455 55.7625 41.0893 176.1617 30 T 4.1282 8.9429 114.5002 64.3265 69.2439 175.7043 31 S 4.4173 8.3256 118.0651 58.5541 64.4796 173.4618 32 E 4.3275 9.1232 124.2480 56.1299 30.5390 175.3284 33 I 5.0323 8.4658 127.4831 59.8376 40.3848 174.6028 34 T 5.0922 9.3503 123.0295 61.7050 72.2177 172.9835 35 V 4.8806 8.9870 125.4092 61.4606 34.3222 174.3708 36 T 5.1843 9.0351 124.0555 61.8349 72.2093 172.9143 37 S 4.6055 8.8798 120.4229 56.8083 65.7751 173.4240 38 N 4.1522 9.9452 126.5957 54.6891 37.1280 175.0312 39 G 4.0013 8.3347 104.3650 45.2954 0.0000 173.9288 40 K 4.3811 8.0401 120.7835 55.8052 33.2133 176.2657 41 S 5.4501 8.6648 120.4693 57.0831 65.7735 173.3170 42 A 4.7371 8.6971 122.7195 50.3968 22.9929 175.7228 43 S 4.6972 8.7553 115.3242 58.3484 62.9340 175.0728 44 A 4.3372 9.3366 129.5292 54.1396 18.4466 178.7175 45 K 4.3732 7.8439 114.0456 56.2090 32.5465 177.0039 46 S 4.4125 7.7596 114.5675 55.7080 64.4793 173.8042 47 L 3.9552 8.1901 131.8152 58.1182 41.6358 178.5022 48 F 4.5417 7.5342 116.2512 60.9684 39.2754 177.4736 49 K 4.2163 7.9874 117.7797 59.2192 31.8262 179.2822 50 L 4.0228 8.1261 120.8863 58.1358 41.8115 178.7670 51 Q 4.2031 8.1419 116.7733 57.9959 28.7193 177.7332 52 T 4.2078 7.6229 109.7663 62.0095 69.5793 174.8535 53 L 4.3500 7.1359 121.9577 53.8241 42.7359 177.4772 54 G 3.8529 8.3303 110.8760 44.8286 0.0000 174.3156 55 L 4.5947 7.9225 133.2504 53.9394 42.2908 176.5769 56 T 4.5595 7.3268 109.0910 59.7486 70.9522 173.8023 57 Q 4.1687 8.3137 122.6898 58.0202 29.1529 176.7706 58 G 3.9699 9.2956 113.5691 45.3094 0.0000 173.4697 59 T 4.1568 7.7168 117.8241 63.2199 69.7636 173.7851 60 V 4.5712 8.3421 126.4259 61.7747 32.7163 175.2423 61 V 4.7337 8.8513 121.4546 59.8871 35.2142 174.6212 62 T 4.9647 8.7974 120.7714 62.0304 70.9959 173.4513 63 I 4.9164 8.8009 127.6569 59.7960 39.5192 174.8575 64 S 5.4502 9.2589 123.1746 56.7358 66.4497 173.1615 65 A 5.2268 9.2187 124.1789 50.4149 23.1528 174.8574 66 E 4.8791 9.9694 121.0056 54.7813 32.9734 175.5845 67 G 4.4576 8.8925 114.9727 45.0206 0.0000 171.9815 68 E 4.0240 8.5661 116.9026 58.4399 29.6738 177.1131 69 D 4.9845 7.8409 119.0047 52.2024 40.3725 177.6060 70 E 3.8410 8.0272 121.3664 60.7419 29.1764 178.1453 71 Q 2.6658 7.6866 120.0882 58.2441 29.1723 178.1496 72 K 3.7990 7.7256 119.1395 59.6410 32.6302 178.7320 73 A 2.0000 7.6749 122.1146 54.2668 18.1627 179.8020 74 V 3.5105 7.4575 116.5914 66.0834 31.7005 177.9734 75 E 3.9577 8.1861 118.5174 59.9375 29.2549 179.2141 76 H 4.2464 8.1895 116.1093 58.7835 28.6766 177.9456 77 L 4.0231 8.0028 120.9438 57.5079 41.3745 179.6682 78 V 3.6629 8.1782 118.7290 65.7939 31.5137 178.0457 79 K 3.9393 7.9483 118.9414 59.3974 32.0902 178.4855 80 L 4.2591 8.1704 122.1244 57.8438 41.8080 178.5331 81 M 4.0559 8.3902 117.0630 58.8249 32.2941 177.8661 82 A 4.1459 8.0927 119.5886 54.8786 18.7632 179.1154 83 E 4.1494 8.3455 117.3123 57.9727 29.7655 177.2691 84 L 3.8176 7.8262 117.7411 55.3268 42.2500 177.1864 85 E 4.2169 8.7615 119.9650 56.4741 29.8747 175.9928 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 M 8.30 4.81 0.00 2.04 2.06 0.00 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.60 0.00 2 F 9.17 4.67 0.00 3.13 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 Q 8.00 5.15 0.00 1.75 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 6.39 0.00 0.00 0.00 0.00 0.00 2.22 2.27 0.00 4 Q 8.82 4.52 0.00 2.09 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.83 0.00 0.00 0.00 0.00 0.00 2.27 2.31 0.00 5 E 8.67 5.17 0.00 1.87 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 2.24 2.26 0.00 6 V 8.51 4.52 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 0.95 0.00 0.00 7 T 8.37 4.93 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 I 8.84 4.16 1.84 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 1.22 0.68 0.87 0.00 0.00 9 T 8.66 4.27 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 *10 A 7.68 4.33 1.31 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 0.00 0.00 0.00 11 P 0.00 4.35 0.00 2.19 2.21 0.00 3.75 0.00 0.00 3.65 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 12 N 8.26 4.73 0.00 2.76 2.93 0.00 0.00 7.20 7.96 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 13 G 7.61 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 0.00 0.00 0.00 14 L 8.31 4.27 0.00 1.43 1.51 0.77 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 15 D 8.38 4.74 0.00 2.99 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 16 T 7.79 3.19 4.26 0.00 0.00 0.00 0.00 0.00 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 17 R 8.15 3.89 0.00 1.88 1.95 0.00 3.19 0.00 0.00 3.35 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.75 0.00 18 P 0.00 4.30 0.00 2.30 2.11 0.00 3.91 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.17 0.00 19 A 8.52 4.00 1.43 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 0.00 0.00 20 A 8.27 3.94 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 21 Q 8.31 3.92 0.00 2.33 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.78 0.00 0.00 0.00 0.00 0.00 2.40 2.39 0.00 22 F 8.60 4.08 0.00 3.21 3.24 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 23 V 8.20 3.87 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 1.09 0.00 0.00 1.17 0.00 0.00 24 K 8.00 3.91 0.00 1.88 1.95 0.00 1.83 0.00 0.00 1.68 0.00 0.00 3.01 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.40 1.44 7.81 25 E 8.30 3.99 0.00 2.06 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 0.00 2.29 2.47 0.00 26 A 8.12 4.07 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 27 K 8.07 4.15 0.00 1.85 1.84 0.00 1.66 0.00 0.00 1.67 0.00 0.00 3.04 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.45 1.64 7.81 28 G 7.68 3.40 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 0.00 29 F 7.18 4.98 0.00 3.16 3.16 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 30 T 8.94 4.13 4.26 0.00 0.00 0.00 0.00 0.00 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 31 S 8.33 4.42 0.00 3.83 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 32 E 9.12 4.33 0.00 2.06 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 0.00 2.32 2.31 0.00 33 I 8.47 5.03 1.90 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 1.32 0.89 0.94 0.00 0.00 34 T 9.35 5.09 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 1.30 0.00 0.00 35 V 8.99 4.88 2.12 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 0.94 0.00 0.00 1.10 0.00 0.00 36 T 9.04 5.18 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 1.27 0.00 0.00 37 S 8.88 4.61 0.00 3.80 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 N 9.95 4.15 0.00 2.83 2.81 0.00 0.00 7.26 7.97 0.00 0.00 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 G 8.33 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 40 K 8.04 4.38 0.00 1.94 1.75 0.00 1.52 0.00 0.00 1.85 0.00 0.00 3.10 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.43 1.46 7.81 41 S 8.66 5.45 0.00 3.74 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 42 A 8.70 4.74 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 0.00 0.00 0.00 0.00 0.00 0.00 43 S 8.76 4.70 0.00 3.95 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 44 A 9.34 4.34 1.50 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 0.00 0.00 0.00 45 K 7.84 4.37 0.00 1.80 1.83 0.00 1.66 0.00 0.00 1.63 0.00 0.00 3.23 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.42 1.38 7.81 46 S 7.76 4.41 0.00 3.78 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 47 L 8.19 3.96 0.00 1.67 1.33 0.94 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 48 F 7.53 4.54 0.00 3.07 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 49 K 7.99 4.22 0.00 1.84 1.91 0.00 1.71 0.00 0.00 1.63 0.00 0.00 2.97 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.52 1.55 7.81 50 L 8.13 4.02 0.00 2.04 1.80 0.96 0.61 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 51 Q 8.14 4.20 0.00 2.34 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.86 0.00 0.00 0.00 0.00 0.00 2.44 2.58 0.00 52 T 7.62 4.21 4.26 0.00 0.00 0.00 0.00 0.00 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 53 L 7.14 4.35 0.00 1.77 1.61 0.96 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 54 G 8.33 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 0.00 0.00 0.00 55 L 7.92 4.59 0.00 1.64 1.55 0.85 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 56 T 7.33 4.56 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 57 Q 8.31 4.17 0.00 2.23 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 5.62 0.00 0.00 0.00 0.00 0.00 2.34 2.37 0.00 58 G 9.30 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.72 4.16 4.26 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 60 V 8.34 4.57 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 0.78 0.00 0.00 0.92 0.00 0.00 61 V 8.85 4.73 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 0.66 0.00 0.00 0.95 0.00 0.00 62 T 8.80 4.96 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 1.19 0.00 0.00 63 I 8.80 4.92 1.94 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.01 1.00 0.00 0.00 64 S 9.26 5.45 0.00 3.73 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 65 A 9.22 5.23 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 66 E 9.97 4.88 0.00 2.06 1.78 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 2.21 2.30 0.00 67 G 8.89 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 0.00 0.00 0.00 0.00 68 E 8.57 4.02 0.00 2.09 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 0.00 2.30 2.32 0.00 69 D 7.84 4.98 0.00 2.98 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 70 E 8.03 3.84 0.00 2.25 2.36 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 2.36 2.33 0.00 71 Q 7.69 2.67 0.00 1.51 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.88 0.00 0.00 0.00 0.00 0.00 1.97 1.17 0.00 72 K 7.73 3.80 0.00 2.07 2.07 0.00 1.44 0.00 0.00 1.77 0.00 0.00 2.91 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.68 1.49 7.81 73 A 7.67 2.00 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 V 7.46 3.51 2.32 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 1.38 0.00 0.00 1.14 0.00 0.00 75 E 8.19 3.96 0.00 1.88 1.88 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 2.33 2.34 0.00 76 H 8.19 4.25 0.00 3.32 3.49 0.00 5.81 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 L 8.00 4.02 0.00 1.74 1.78 0.73 0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 78 V 8.18 3.66 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 1.11 0.00 0.00 1.01 0.00 0.00 79 K 7.95 3.94 0.00 1.98 1.98 0.00 1.69 0.00 0.00 1.59 0.00 0.00 3.10 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.62 1.46 7.81 80 L 8.17 4.26 0.00 1.99 1.95 0.99 0.84 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 81 M 8.39 4.06 0.00 2.22 2.34 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.57 0.00 82 A 8.09 4.15 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 83 E 8.35 4.15 0.00 2.24 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 0.00 2.34 2.57 0.00 84 L 7.83 3.82 0.00 1.83 1.69 1.02 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 85 E 8.76 4.22 0.00 2.06 1.93 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 2.24 2.37 0.00 * Residues marked with a * may have inaccurate shift predictions.