NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 N 4.7989 8.4244 119.4722 53.7880 39.4449 171.5593 3 T 4.6567 8.0872 116.7893 59.1927 70.5914 170.3741 4 L 4.7424 10.1963 133.0506 53.3959 44.8374 174.1571 5 E 5.2179 8.7306 125.0871 54.5539 31.9849 175.0786 6 L 4.8043 9.1339 125.7080 53.5317 46.2722 174.3269 7 S 5.1712 8.6559 119.0767 56.8446 64.6983 172.8409 8 A 4.7178 8.3214 123.5332 51.2841 23.1020 174.0504 9 R 4.7169 8.8034 119.1223 54.5363 33.1244 175.3331 10 V 4.0118 8.6904 126.2182 62.8651 31.6520 175.9908 11 L 3.9640 9.0287 131.4986 56.8011 43.1673 176.2363 12 E 4.7333 7.7487 117.7065 55.0643 33.2532 173.6349 13 C 4.9081 8.5820 125.6848 57.3537 34.0475 173.5438 14 G 3.9477 8.9280 114.4011 45.6864 0.0000 173.6288 15 A 4.5594 8.4741 128.2848 52.2637 18.8921 181.1064 *17 R 4.1900 8.8776 124.7597 58.1607 32.1736 172.7947 18 H 5.4681 8.4053 115.0988 54.5828 32.9043 174.1987 19 T 4.3110 8.8325 112.5329 60.1960 69.8431 173.8927 20 P 4.1284 0.0000 0.0000 65.5972 31.2793 177.4967 21 A 4.2424 8.0065 118.3590 52.1148 18.2464 177.9528 22 G 3.9107 8.3432 105.1421 45.8630 0.0000 173.9195 23 L 4.2980 7.6421 123.3288 53.8885 43.2532 174.6459 24 P 4.7589 0.0000 0.0000 63.0516 32.6468 175.0091 25 A 5.0874 8.6299 123.4043 50.4382 22.3907 175.2695 26 L 4.6751 8.9111 122.9254 53.3384 46.2263 174.3135 27 E 5.0275 8.7853 125.7879 54.4752 32.3689 174.3909 28 L 5.2696 9.4783 125.9520 52.8032 46.7750 174.9517 29 L 4.9188 9.0022 122.7260 53.4690 44.4945 174.9782 30 L 5.3014 8.9564 127.0376 52.8839 44.7041 175.8741 31 V 4.8560 8.6656 122.3357 60.2729 33.9744 173.8112 32 H 5.1584 9.5475 126.0048 54.3784 32.1965 173.0098 33 E 5.0974 7.9136 124.8221 54.8378 32.7536 174.0161 34 S 4.5783 8.6593 119.6869 58.2067 67.2850 174.0011 35 E 5.1680 8.3923 119.0397 54.7842 32.0388 175.8934 36 V 4.8831 8.9860 116.6653 59.5261 36.5312 174.5890 37 V 4.7883 8.3321 122.2376 60.2265 33.3396 174.8474 38 E 4.4379 9.2119 125.5261 55.1390 31.6005 175.2158 39 A 3.8496 9.9497 128.1559 53.1791 16.2747 176.8599 40 G 3.8489 9.0318 103.9551 47.6525 0.0000 173.7348 41 H 5.0694 7.9751 115.0001 52.7019 33.2102 171.5759 42 P 4.8277 0.0000 0.0000 63.3228 32.3767 175.7184 43 R 4.6151 8.6870 121.0183 55.3816 33.9798 174.0239 44 R 5.0409 8.6147 125.5958 55.3603 31.3746 175.9387 45 V 4.3956 9.2565 123.4444 61.0077 34.5700 173.6923 46 E 5.0575 8.9430 128.2579 54.4316 32.0929 174.1970 47 L 4.8194 9.0123 129.5803 53.4947 45.0210 174.9411 48 T 5.0745 8.5609 122.2680 61.8370 70.9345 173.4612 49 I 4.7642 8.9686 126.0524 59.2441 42.1102 173.9615 50 S 4.9784 8.6843 122.9558 57.8882 64.8175 172.7030 51 A 5.0807 9.1892 124.1518 50.1215 22.6519 174.8080 52 V 4.7700 8.6091 120.4821 60.9212 34.6009 174.2585 53 A 5.0665 8.8081 128.8769 50.1268 22.1946 174.8866 54 L 4.8398 8.2722 121.8331 54.1194 45.2485 175.7119 55 G 4.0876 9.5239 113.2614 45.3184 0.0000 175.6795 56 D 4.3900 8.8456 120.4137 57.4601 40.6926 178.3083 57 L 3.9996 7.9334 118.6690 57.3622 41.5986 179.2162 58 A 3.9677 7.9043 120.5489 55.1524 18.1976 179.4825 59 L 3.9174 7.5309 115.8281 57.8020 41.7508 179.2488 60 L 4.0923 7.9069 119.3791 57.9803 42.4509 178.4433 61 L 4.2159 8.4767 117.6060 54.5674 41.9762 176.7184 62 A 4.0748 7.5152 122.0543 54.1238 18.6416 176.7753 63 D 4.4377 8.7831 119.8925 55.2623 38.7393 174.3621 64 T 3.9971 7.5252 114.5652 62.7385 69.2539 173.1741 65 P 4.3541 0.0000 0.0000 62.2646 32.0498 176.0341 66 L 4.2844 8.2371 122.2802 56.3495 42.0649 177.5477 67 G 4.0195 9.3487 111.7906 45.4276 0.0000 174.2533 68 T 3.9451 7.5437 116.8454 64.1554 69.6058 173.8075 69 E 4.8703 8.6027 126.0542 54.6942 32.4028 174.6285 *71 Q 4.4287 8.3475 122.5418 56.1957 30.3878 174.1399 72 V 5.2410 8.8306 119.4504 59.8379 36.3924 174.4777 73 Q 5.4720 7.8049 118.1597 55.6597 32.3291 174.9159 74 G 4.1360 7.7609 107.1032 46.7471 0.0000 171.4321 75 F 5.3759 7.2812 113.5144 54.9984 40.9063 174.8627 76 L 4.9640 8.8408 120.2338 54.3148 42.7383 176.0885 77 A 4.9589 8.7192 123.2993 49.4109 23.1330 173.8205 78 P 4.7163 0.0000 0.0000 62.8778 31.6941 176.4518 79 A 4.2266 8.9930 124.9380 54.6897 18.8853 177.9089 80 R 4.5900 7.7304 113.2498 53.6278 33.6090 173.8319 81 K 3.8792 8.6991 122.1699 58.5172 32.2483 175.8367 82 D 4.4492 8.8165 123.3559 55.1803 38.5214 173.5015 83 S 4.4358 8.3617 113.7032 57.9948 62.9196 174.7124 84 V 3.9657 8.1732 118.5214 62.4753 32.2392 176.7504 85 K 4.3842 8.2052 120.7164 56.2190 33.2075 176.4905 86 V 4.9855 8.2586 115.1797 59.4930 35.4279 174.8937 87 K 4.7102 8.8519 124.1115 54.4694 35.8508 174.5942 88 L 4.5544 8.6690 129.1499 54.7233 43.6475 175.0843 89 H 4.7037 8.9329 124.9359 54.0462 29.5808 174.7741 90 L 4.2989 8.5353 125.0911 55.1206 41.0948 177.4797 91 Q 4.7005 9.3196 120.8085 56.1812 32.3554 175.4553 92 Q 4.7495 7.8798 116.1849 54.5645 33.4112 173.6569 93 A 5.2550 8.3672 122.5049 51.1160 22.2425 175.8007 94 R 4.5670 8.4390 116.3515 54.6689 32.8441 174.7237 95 R 4.3353 8.5908 123.5094 55.2366 30.5242 175.6720 96 I 4.0977 8.3600 128.2749 60.9152 38.1309 175.8493 97 A 4.5692 8.4686 129.1444 50.0371 20.2327 176.6658 98 G 3.7456 8.6533 110.7095 46.3607 0.0000 172.7881 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 N 8.42 4.80 0.00 2.77 2.85 0.00 0.00 6.69 6.82 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 3 T 8.09 4.66 4.29 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 0.00 0.00 0.00 1.23 0.00 0.00 4 L 10.20 4.74 0.00 1.75 1.49 0.90 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 5 E 8.73 5.22 0.00 1.86 1.82 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 2.21 2.27 0.00 6 L 9.13 4.80 0.00 1.65 1.41 0.72 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 7 S 8.66 5.17 0.00 3.91 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 8 A 8.32 4.72 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 9 R 8.80 4.72 0.00 2.09 1.75 0.00 3.08 0.00 0.00 3.09 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.71 0.00 10 V 8.69 4.01 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 0.83 0.00 0.00 0.97 0.00 0.00 11 L 9.03 3.96 0.00 1.62 1.82 0.92 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 12 E 7.75 4.73 0.00 2.04 1.70 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 2.27 2.29 0.00 13 C 8.58 4.91 0.00 2.95 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 14 G 8.93 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 15 A 8.47 4.56 0.98 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 0.00 0.00 *17 R 8.88 4.19 0.00 1.77 1.94 0.00 3.07 0.00 0.00 3.32 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.84 0.00 18 H 8.41 5.47 0.00 2.95 3.16 0.00 5.89 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 19 T 8.83 4.31 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 20 P 0.00 4.13 0.00 2.07 2.17 0.00 3.68 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 2.10 0.00 21 A 8.01 4.24 1.28 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 0.00 0.00 0.00 22 G 8.34 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 23 L 7.64 4.30 0.00 1.78 1.57 0.96 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 24 P 0.00 4.76 0.00 2.12 2.13 0.00 3.72 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 1.99 0.00 25 A 8.63 5.09 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 26 L 8.91 4.68 0.00 1.70 1.41 0.93 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 27 E 8.79 5.03 0.00 2.07 1.72 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 2.24 2.33 0.00 28 L 9.48 5.27 0.00 1.55 1.57 0.89 -0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 29 L 9.00 4.92 0.00 1.67 1.57 0.95 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 30 L 8.96 5.30 0.00 1.59 1.53 0.90 0.62 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 31 V 8.67 4.86 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 0.85 0.00 0.00 0.93 0.00 0.00 32 H 9.55 5.16 0.00 3.16 3.18 0.00 5.54 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 E 7.91 5.10 0.00 1.90 1.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.26 0.00 34 S 8.66 4.58 0.00 3.88 3.83 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 0.00 0.00 0.00 35 E 8.39 5.17 0.00 1.89 1.87 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 2.29 2.24 0.00 36 V 8.99 4.88 2.09 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 0.84 0.00 0.00 0.99 0.00 0.00 37 V 8.33 4.79 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 0.68 0.00 0.00 1.00 0.00 0.00 38 E 9.21 4.44 0.00 1.93 1.82 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 2.20 2.22 0.00 39 A 9.95 3.85 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 40 G 9.03 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 41 H 7.98 5.07 0.00 3.17 3.14 0.00 5.62 0.00 0.00 0.00 0.00 6.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 P 0.00 4.83 0.00 2.08 2.06 0.00 3.83 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.98 0.00 43 R 8.69 4.62 0.00 1.90 1.90 0.00 3.18 0.00 0.00 3.18 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.62 0.00 44 R 8.61 5.04 0.00 1.74 1.87 0.00 3.25 0.00 0.00 4.01 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.47 0.00 45 V 9.26 4.40 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 0.99 0.00 0.00 0.95 0.00 0.00 46 E 8.94 5.06 0.00 1.96 1.79 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 2.17 2.26 0.00 47 L 9.01 4.82 0.00 1.79 1.51 0.92 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 48 T 8.56 5.07 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 49 I 8.97 4.76 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 1.26 1.55 0.90 0.00 0.00 50 S 8.68 4.98 0.00 4.15 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 51 A 9.19 5.08 1.14 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 0.00 0.00 52 V 8.61 4.77 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 0.93 0.00 0.00 0.82 0.00 0.00 53 A 8.81 5.07 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.27 4.84 0.00 1.58 1.51 0.97 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 55 G 9.52 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 0.00 0.00 0.00 56 D 8.85 4.39 0.00 2.74 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 57 L 7.93 4.00 0.00 1.68 1.70 0.92 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 58 A 7.90 3.97 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.53 3.92 0.00 1.83 1.75 0.93 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 60 L 7.91 4.09 0.00 1.72 1.84 0.92 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 61 L 8.48 4.22 0.00 1.73 1.67 0.90 0.95 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 62 A 7.52 4.07 1.29 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 0.00 0.00 0.00 0.00 0.00 0.00 63 D 8.78 4.44 0.00 2.80 2.73 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 64 T 7.53 4.00 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 65 P 0.00 4.35 0.00 2.17 1.96 0.00 3.60 0.00 0.00 3.91 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 66 L 8.24 4.28 0.00 1.63 1.60 0.92 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 67 G 9.35 4.02 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 0.00 0.00 0.00 68 T 7.54 3.95 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 69 E 8.60 4.87 0.00 2.09 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 2.34 2.20 0.00 *71 Q 8.35 4.43 0.00 2.21 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.49 0.00 0.00 0.00 0.00 0.00 2.33 2.41 0.00 72 V 8.83 5.24 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 0.71 0.00 0.00 0.97 0.00 0.00 73 Q 7.80 5.47 0.00 2.24 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.69 0.00 0.00 0.00 0.00 0.00 2.42 2.22 0.00 74 G 7.76 4.14 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 0.00 0.00 0.00 75 F 7.28 5.38 0.00 3.34 3.26 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 76 L 8.84 4.96 0.00 1.63 1.66 0.94 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 77 A 8.72 4.96 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 78 P 0.00 4.72 0.00 2.33 2.09 0.00 3.82 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.00 0.00 79 A 8.99 4.23 1.28 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 0.00 0.00 0.00 80 R 7.73 4.59 0.00 1.80 1.72 0.00 3.22 0.00 0.00 3.27 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.59 0.00 81 K 8.70 3.88 0.00 1.76 1.75 0.00 1.99 0.00 0.00 1.71 0.00 0.00 2.83 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.44 1.51 7.81 82 D 8.82 4.45 0.00 2.87 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 83 S 8.36 4.44 0.00 3.81 3.83 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 0.00 0.00 0.00 84 V 8.17 3.97 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 0.77 0.00 0.00 0.93 0.00 0.00 85 K 8.21 4.38 0.00 1.70 1.72 0.00 1.60 0.00 0.00 1.65 0.00 0.00 2.80 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.46 1.42 7.81 86 V 8.26 4.99 2.09 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 0.74 0.00 0.00 0.93 0.00 0.00 87 K 8.85 4.71 0.00 1.78 1.59 0.00 1.56 0.00 0.00 1.50 0.00 0.00 2.78 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.21 1.34 7.81 88 L 8.67 4.55 0.00 1.75 1.45 0.88 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 89 H 8.93 4.70 0.00 1.40 2.48 0.00 5.69 0.00 0.00 0.00 0.00 6.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 L 8.54 4.30 0.00 1.53 1.57 0.88 0.93 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 91 Q 9.32 4.70 0.00 2.01 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.73 0.00 0.00 0.00 0.00 0.00 2.45 2.61 0.00 92 Q 7.88 4.75 0.00 1.96 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.76 0.00 0.00 0.00 0.00 0.00 2.36 2.39 0.00 93 A 8.37 5.26 1.17 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 0.00 0.00 0.00 0.00 0.00 94 R 8.44 4.57 0.00 1.79 1.86 0.00 3.11 0.00 0.00 3.15 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.84 0.00 95 R 8.59 4.34 0.00 1.84 1.90 0.00 3.23 0.00 0.00 3.22 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.65 0.00 96 I 8.36 4.10 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 1.16 0.65 0.91 0.00 0.00 97 A 8.47 4.57 1.22 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 0.00 0.00 0.00 98 G 8.65 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 * Residues marked with a * may have inaccurate shift predictions.