NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -2 G 4.3876 8.3544 109.7674 46.0895 0.0000 172.9094 -1 S 4.4951 8.3399 111.0378 57.5578 63.7332 175.5208 -1 D 4.6651 8.3699 115.7378 53.4578 41.0332 177.2208 2 W 4.2938 8.8235 121.7179 56.5490 30.6783 175.6718 3 V 4.3067 8.3390 115.9993 59.8866 32.5270 175.9807 4 I 4.0016 8.1964 125.2462 60.2668 37.7022 174.4663 5 P 4.4447 0.0000 0.0000 61.7337 31.8841 174.5270 6 P 4.6285 0.0000 0.0000 63.0972 32.4055 175.5852 7 I 4.4344 8.7683 123.5114 59.8779 39.2271 174.3137 8 N 5.4653 8.8039 124.4478 51.4047 40.7166 173.9285 9 L 4.9317 8.7724 125.6432 52.2995 45.2719 173.8575 10 P 5.0682 0.0000 0.0000 62.7371 32.2423 176.2142 11 E 4.2538 9.4464 121.2451 55.9722 31.8524 175.9832 12 N 4.5007 8.6833 114.0217 53.9656 36.9013 175.6526 13 S 4.3308 7.2736 114.2119 58.6742 63.4251 173.4473 *15 G 2.9316 8.1712 108.2308 45.2073 0.0000 170.7846 16 P 4.2007 0.0000 0.0000 62.6130 32.2689 175.3498 17 F 5.2594 8.1051 117.6343 54.8453 41.5848 173.8759 18 P 4.6819 0.0000 0.0000 63.2285 32.1775 175.4657 19 Q 4.3680 9.4411 125.8324 54.7292 30.1155 174.5647 20 E 4.0734 8.7445 127.0219 56.5434 29.5241 175.9043 21 L 4.5957 9.4071 126.0169 55.3504 42.2156 176.5749 22 V 4.5161 7.2005 116.7277 60.3621 35.5288 173.6232 23 R 4.6030 8.5769 122.2931 55.8656 30.3313 176.1010 24 I 4.3670 8.7297 127.3790 59.5807 38.6407 175.4650 25 R 3.9068 8.1771 122.2326 54.3401 32.8668 173.9399 26 S 4.7718 8.8098 112.7851 56.0547 63.8867 174.9769 27 G 3.9535 8.9660 116.8635 48.8926 0.0000 174.3749 28 R 4.0780 7.5846 116.1687 57.4814 29.9479 177.2751 29 D 5.2398 8.0345 118.7245 51.5785 38.3155 174.4452 *32 L 3.9393 7.9245 127.5287 55.2874 42.8972 175.6662 33 S 4.6095 8.4892 121.8982 58.2285 63.6288 173.2535 34 L 4.9999 8.4075 124.4211 52.8330 44.7267 175.8913 35 R 4.6095 8.3642 120.3466 54.7980 33.0271 173.6879 36 Y 5.5683 9.0765 123.2715 55.8677 40.8681 174.8628 37 S 4.8020 8.5746 115.4447 57.2490 66.6493 173.0877 38 V 5.2200 8.4640 114.4707 60.0453 34.5623 174.8247 39 T 4.7839 8.9947 112.4144 60.4702 72.8985 172.8531 40 G 4.1598 9.5322 108.2992 43.6000 0.0000 171.2175 41 P 4.5657 0.0000 0.0000 64.5094 31.4014 176.5082 42 G 4.6362 9.2706 112.5130 44.5905 0.0000 174.2151 43 A 4.6831 8.9101 120.2059 52.1581 20.3761 176.4630 44 D 4.8245 8.9849 115.7733 51.8761 40.9719 177.0416 45 Q 4.7708 7.6099 118.4732 53.3225 33.1459 172.6230 46 P 4.7989 0.0000 0.0000 62.7127 32.1587 174.0655 47 P 4.4360 0.0000 0.0000 63.2204 31.9477 175.4803 48 T 4.3914 8.7196 119.4974 62.0919 68.9520 174.9231 49 G 3.9369 8.7150 114.3143 46.3731 0.0000 174.8927 50 I 3.6521 7.2928 123.4047 63.2131 37.8954 176.1545 51 F 5.6867 8.3838 118.7900 54.8092 41.7708 175.2541 52 I 4.7933 8.2345 113.5356 59.5177 41.1485 173.2970 53 I 5.0447 8.1918 123.1523 59.0047 41.0511 174.3091 54 N 4.4846 8.9494 127.8659 53.0002 39.4973 173.7886 55 P 4.6075 0.0000 0.0000 64.6868 31.8573 178.1855 56 I 4.0988 8.0811 109.6531 62.7602 38.5208 176.9742 57 S 4.2360 8.8334 115.3713 58.5898 63.5358 175.3443 58 G 3.5167 8.4119 107.6947 46.0303 0.0000 172.0297 59 Q 4.3330 7.8615 121.8904 55.5922 30.1600 174.6078 60 L 4.9150 8.7416 129.8433 54.3630 43.0452 175.5737 61 S 5.4303 9.3686 122.3529 56.7201 67.0591 173.2365 62 V 4.3430 8.9731 121.6892 60.4937 33.2957 176.3803 63 T 4.4235 8.1695 112.3310 62.1524 70.1941 174.0943 64 K 3.2185 7.0100 119.0858 54.0562 35.4708 173.3461 65 P 4.5732 0.0000 0.0000 62.9196 32.1448 175.6264 66 L 4.9643 8.3702 120.0532 53.2966 46.6947 175.2366 67 D 4.9120 8.3513 119.1234 53.2775 43.7074 175.5964 68 R 4.0782 9.4412 127.9369 59.6342 30.2492 177.6454 69 E 4.0955 7.7652 114.7855 58.9620 29.6539 178.2783 70 L 4.2608 7.8597 117.9879 56.3368 42.2301 176.8417 71 I 4.4017 7.4038 117.0439 59.4636 40.2549 175.2107 72 A 4.4936 8.5168 127.3288 54.0664 20.0416 176.8867 73 R 5.0326 7.4897 108.6340 55.4126 32.1940 174.7249 74 F 4.8704 9.0089 119.6370 56.2904 42.4954 174.5346 75 H 5.2561 8.8463 120.1075 54.9018 31.4892 172.2009 76 L 4.8842 8.5517 126.2971 53.1674 45.2560 175.4271 77 R 5.0170 8.4037 116.9491 55.1330 34.5708 174.8140 78 A 5.1181 8.9518 126.1464 51.3324 21.0460 175.6931 79 H 5.3541 9.5086 116.9288 54.0175 33.5787 172.5561 80 A 4.9756 8.3740 120.6312 50.4788 22.5069 175.2915 81 V 4.7448 8.2582 121.1636 60.9570 35.7033 174.5584 82 D 4.9439 9.0553 127.2925 52.6204 40.5633 176.9329 83 I 3.7043 7.7224 118.8514 63.5276 37.8505 175.9279 84 N 4.6527 8.7037 115.8299 53.0449 38.6934 175.8185 85 G 3.9492 8.7184 107.6750 45.1023 0.0000 173.7955 86 N 4.5350 7.9726 117.7564 52.4430 39.4023 174.2709 87 Q 4.4934 8.5605 123.8248 56.2934 29.8787 175.6645 88 V 4.2027 8.2003 117.8411 62.0515 33.7205 175.7772 89 E 4.6372 7.8905 116.5829 54.4385 31.9240 174.2290 90 N 4.8090 8.3242 118.7036 51.2146 40.1779 172.7388 91 P 4.9084 0.0000 0.0000 62.7757 31.8797 175.3166 92 I 4.5606 8.1995 115.3623 59.2647 40.4154 174.2342 93 D 5.0239 8.6057 124.1920 54.1399 42.1062 175.7478 94 I 4.6052 8.6698 122.7904 59.4315 40.8800 174.5724 95 V 5.0005 8.3982 125.5683 61.1311 34.8789 174.0222 96 I 5.1314 8.6752 127.1789 59.6325 41.0070 173.9061 97 N 5.4309 9.3811 124.4161 51.4538 41.4856 173.6450 98 V 4.8135 8.9050 124.5586 61.5069 33.0547 175.7197 99 I 4.2037 8.7758 121.2941 61.0207 37.7028 175.4353 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 G 8.35 4.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.34 4.50 0.00 3.91 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 -1 D 8.37 4.67 0.00 2.74 2.55 0.00 0.00 0.00 0.00 0.00 0.00 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 W 8.82 4.29 0.00 3.30 3.10 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 0.00 0.00 0.00 0.00 3 V 8.34 4.31 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.00 0.00 0.98 0.00 0.00 4 I 8.20 4.00 1.88 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 1.44 0.50 0.90 0.00 0.00 5 P 0.00 4.44 0.00 2.04 1.99 0.00 3.68 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 2.02 2.12 0.00 6 P 0.00 4.63 0.00 1.94 2.00 0.00 3.66 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 2.04 2.14 0.00 7 I 8.77 4.43 1.86 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 1.21 0.82 0.93 0.00 0.00 8 N 8.80 5.47 0.00 2.60 2.75 0.00 0.00 6.82 7.85 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 9 L 8.77 4.93 0.00 1.74 1.57 1.04 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 10 P 0.00 5.07 0.00 2.15 2.06 0.00 3.87 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.99 0.00 11 E 9.45 4.25 0.00 2.19 2.21 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 2.32 2.32 0.00 12 N 8.68 4.50 0.00 2.89 2.94 0.00 0.00 7.02 6.88 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 13 S 7.27 4.33 0.00 4.17 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 *15 G 8.17 2.93 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 16 P 0.00 4.20 0.00 2.13 1.98 0.00 3.60 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.91 0.00 17 F 8.11 5.26 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 18 P 0.00 4.68 0.00 2.12 2.10 0.00 3.80 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.99 0.00 19 Q 9.44 4.37 0.00 2.11 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 7.03 0.00 0.00 0.00 0.00 0.00 2.32 2.26 0.00 20 E 8.74 4.07 0.00 1.90 1.89 0.00 0.00 0.00 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 2.19 0.00 21 L 9.41 4.60 0.00 1.66 1.64 1.12 0.92 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 22 V 7.20 4.52 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 0.75 0.00 0.00 0.91 0.00 0.00 23 R 8.58 4.60 0.00 1.67 1.85 0.00 3.15 0.00 0.00 3.19 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.74 0.00 24 I 8.73 4.37 1.75 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 1.21 1.36 0.85 0.00 0.00 25 R 8.18 3.91 0.00 1.75 1.52 0.00 3.11 0.00 0.00 3.05 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.51 0.00 26 S 8.81 4.77 0.00 4.02 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 27 G 8.97 3.95 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 0.00 0.00 0.00 28 R 7.58 4.08 0.00 1.88 2.02 0.00 3.18 0.00 0.00 3.29 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.60 0.00 29 D 8.03 5.24 0.00 2.84 2.93 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 *32 L 7.92 3.94 0.00 1.77 1.81 0.91 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 33 S 8.49 4.61 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 34 L 8.41 5.00 0.00 1.20 1.11 0.90 0.81 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 35 R 8.36 4.61 0.00 1.71 1.60 0.00 3.18 0.00 0.00 3.11 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.68 0.00 36 Y 9.08 5.57 0.00 3.08 2.85 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 37 S 8.57 4.80 0.00 3.85 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 38 V 8.46 5.22 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 0.79 0.00 0.00 0.98 0.00 0.00 39 T 8.99 4.78 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 1.16 0.00 0.00 40 G 9.53 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 0.00 0.00 0.00 0.00 41 P 0.00 4.57 0.00 2.19 2.12 0.00 3.74 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 2.09 2.15 0.00 42 G 9.27 4.64 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 0.00 0.00 0.00 43 A 8.91 4.68 1.27 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 0.00 0.00 0.00 44 D 8.98 4.82 0.00 2.80 2.78 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 45 Q 7.61 4.77 0.00 2.14 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 7.07 0.00 0.00 0.00 0.00 0.00 2.36 2.36 0.00 46 P 0.00 4.80 0.00 2.10 2.10 0.00 3.80 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.01 0.00 47 P 0.00 4.44 0.00 2.22 2.32 0.00 3.88 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 2.40 2.24 0.00 48 T 8.72 4.39 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 1.22 0.00 0.00 49 G 8.72 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 0.00 0.00 0.00 50 I 7.29 3.65 1.48 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.80 0.17 0.00 0.00 51 F 8.38 5.69 0.00 2.80 2.84 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 0.00 0.00 0.00 52 I 8.23 4.79 1.90 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 1.24 0.91 0.00 0.00 53 I 8.19 5.04 1.91 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 1.24 0.95 0.99 0.00 0.00 54 N 8.95 4.48 0.00 2.84 2.71 0.00 0.00 7.11 7.22 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 55 P 0.00 4.61 0.00 2.25 2.13 0.00 3.95 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.09 0.00 56 I 8.08 4.10 1.92 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.60 0.94 0.00 0.00 57 S 8.83 4.24 0.00 3.98 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 58 G 8.41 3.52 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 0.00 0.00 0.00 0.00 0.00 0.00 59 Q 7.86 4.33 0.00 2.22 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.84 0.00 0.00 0.00 0.00 0.00 2.36 2.36 0.00 60 L 8.74 4.92 0.00 1.80 1.64 0.98 0.47 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 61 S 9.37 5.43 0.00 3.78 3.82 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 62 V 8.97 4.34 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 1.08 0.00 0.00 0.50 0.00 0.00 63 T 8.17 4.42 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 1.17 0.00 0.00 64 K 7.01 3.22 0.00 1.48 1.43 0.00 1.42 0.00 0.00 1.56 0.00 0.00 2.88 0.00 0.00 2.89 0.00 0.00 0.00 0.00 0.99 1.19 7.81 65 P 0.00 4.57 0.00 1.93 2.10 0.00 3.35 0.00 0.00 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.33 0.00 66 L 8.37 4.96 0.00 1.60 1.61 1.09 1.04 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 67 D 8.35 4.91 0.00 2.77 2.48 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 68 R 9.44 4.08 0.00 1.82 2.05 0.00 3.49 0.00 0.00 3.24 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.63 0.00 69 E 7.77 4.10 0.00 2.28 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 2.35 2.34 0.00 70 L 7.86 4.26 0.00 1.81 1.71 0.93 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 71 I 7.40 4.40 1.80 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 0.57 0.18 0.00 0.00 72 A 8.52 4.49 1.26 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 0.00 0.00 0.00 73 R 7.49 5.03 0.00 2.08 1.83 0.00 3.01 0.00 0.00 3.43 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.61 0.00 74 F 9.01 4.87 0.00 2.98 2.94 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 75 H 8.85 5.26 0.00 3.08 3.20 0.00 5.72 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 L 8.55 4.88 0.00 1.57 1.71 0.62 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 77 R 8.40 5.02 0.00 1.73 1.63 0.00 3.10 0.00 0.00 3.13 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.49 0.00 78 A 8.95 5.12 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 79 H 9.51 5.35 0.00 3.08 3.19 0.00 5.76 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 A 8.37 4.98 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 81 V 8.26 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 0.99 0.00 0.00 82 D 9.06 4.94 0.00 2.78 2.77 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 83 I 7.72 3.70 1.85 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 1.28 0.67 0.90 0.00 0.00 84 N 8.70 4.65 0.00 2.86 2.81 0.00 0.00 7.15 8.08 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 85 G 8.72 3.95 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 0.00 0.00 0.00 86 N 7.97 4.53 0.00 3.03 2.73 0.00 0.00 6.74 7.74 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 87 Q 8.56 4.49 0.00 2.01 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.84 0.00 0.00 0.00 0.00 0.00 2.51 2.40 0.00 88 V 8.20 4.20 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 0.75 0.00 0.00 0.96 0.00 0.00 89 E 7.89 4.64 0.00 1.97 1.90 0.00 0.00 0.00 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 2.28 0.00 90 N 8.32 4.81 0.00 2.68 2.71 0.00 0.00 6.98 7.69 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 91 P 0.00 4.91 0.00 2.00 1.92 0.00 3.39 0.00 0.00 5.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.82 0.00 92 I 8.20 4.56 1.87 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 1.36 0.69 0.94 0.00 0.00 93 D 8.61 5.02 0.00 2.61 2.68 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 94 I 8.67 4.61 1.78 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.96 0.81 0.00 0.00 95 V 8.40 5.00 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 1.10 0.00 0.00 0.97 0.00 0.00 96 I 8.68 5.13 1.93 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.32 1.09 0.00 0.00 97 N 9.38 5.43 0.00 2.82 2.72 0.00 0.00 6.21 7.28 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 98 V 8.90 4.81 2.16 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 0.92 0.00 0.00 1.21 0.00 0.00 99 I 8.78 4.20 1.90 0.00 0.00 0.89 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 0.85 0.94 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.