NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 19 V 4.3458 7.9133 120.6755 62.9108 33.4993 173.6889 20 I 4.8477 8.9336 129.2646 59.0285 39.4318 172.9126 21 S 5.2960 9.6203 122.0842 56.7493 65.8121 171.8479 22 H 5.2764 9.6200 126.5305 54.4828 32.5547 172.2018 23 G 4.5791 9.0198 113.4544 44.5118 0.0000 171.2416 24 T 5.4367 8.7144 113.3953 59.8919 72.5458 172.6691 25 L 5.0036 8.6931 121.2075 56.3081 44.0907 173.4506 26 S 5.2846 8.6314 113.6365 57.3019 66.3060 172.8785 27 A 4.9484 8.7225 121.4377 50.1215 22.4232 176.5035 28 S 4.3071 8.7620 113.9585 57.7217 64.3503 175.2722 29 A 4.0641 8.5972 122.9073 55.3052 17.7274 179.5421 30 E 3.9313 7.5577 117.4307 59.1359 30.0135 177.8497 31 H 4.8544 8.1799 113.5533 55.8027 29.8966 176.4780 32 A 4.1513 7.7549 122.3929 54.9470 18.1968 179.4847 33 A 3.9587 8.0251 118.9122 55.7787 18.5465 179.4156 34 H 4.0611 8.2560 114.2370 58.7653 28.6909 177.6894 35 L 3.8512 7.9725 122.2105 58.0641 41.9308 179.1297 36 R 3.5709 8.1203 118.4245 59.2842 30.0487 178.8305 37 Q 3.9238 8.0199 119.2004 58.9483 28.9726 177.8863 38 L 3.9327 8.0008 121.4080 58.2336 42.0800 179.0278 39 L 3.9860 8.0822 119.0940 57.8413 41.5733 179.6899 40 V 3.5996 7.8940 118.2013 66.0886 31.4393 177.5670 41 H 4.0804 8.2965 117.9401 59.4491 29.7000 177.3520 42 I 3.6555 8.0412 121.5069 64.2175 36.8727 178.3241 43 A 3.5745 8.2041 121.7429 55.0753 18.0257 179.4405 44 Q 3.8305 7.8527 116.7486 59.1515 29.4486 178.1633 45 A 4.0432 7.7771 121.7077 55.5847 18.4047 179.8771 46 T 4.1072 7.8077 115.7972 66.0586 68.1461 177.1731 47 R 3.8039 7.5960 119.2421 58.7439 30.1031 178.1149 48 Q 4.2360 7.5840 115.2792 55.7897 29.0995 175.9969 49 E 4.3293 7.7569 121.0918 55.3923 30.4245 175.9784 50 D 4.5307 8.6425 121.8022 56.2327 41.3859 177.5102 51 G 4.0086 9.0686 111.2871 45.6190 0.0000 172.2579 52 C 3.5886 7.8918 120.6102 58.3696 31.2203 172.7034 53 L 4.3374 8.0803 128.3145 56.4833 42.5173 177.3464 54 L 4.4622 7.2090 118.9545 53.9503 45.7854 174.4502 55 Y 4.7123 8.3935 127.0794 56.8464 40.6422 173.2556 56 L 4.9111 8.9286 127.5584 52.7842 45.0931 176.0679 57 V 5.0645 8.4706 116.0364 59.6605 34.0708 175.0809 58 S 4.8365 9.2605 118.9377 56.8945 67.1308 172.1424 59 E 4.9663 8.5863 121.0995 54.0163 31.8682 174.7938 60 D 4.3738 8.8398 127.4595 54.3941 41.5407 177.1818 61 L 4.0621 8.7166 126.6146 57.5584 41.9254 178.3909 62 S 4.4280 8.3809 113.4834 59.9882 63.3964 175.0022 63 Q 4.4153 7.6787 119.1366 53.0256 30.1620 171.3653 64 P 4.3833 0.0000 0.0000 64.1439 32.2766 177.1999 65 G 3.8924 9.5154 110.7565 45.2923 0.0000 172.2505 66 H 5.0897 7.5791 117.5626 54.0688 30.9708 174.1347 67 F 5.4648 9.3277 121.1132 55.5414 43.0723 173.8403 68 L 5.1767 9.1666 122.7615 53.4014 45.5183 175.2108 69 I 4.7074 8.8976 126.8477 60.0459 39.7192 174.5237 70 T 4.9195 8.7309 125.3293 61.7745 70.7101 173.7422 71 E 5.0048 9.1230 125.4744 54.7271 34.1419 174.4126 72 H 5.4532 8.9112 120.2766 53.8636 31.8967 172.6971 73 W 4.9771 9.0231 123.5654 54.6335 31.0632 175.5917 74 D 4.6985 9.3838 124.6562 57.4030 41.1982 175.7832 75 N 4.9505 7.9493 112.4317 51.3620 40.0425 174.0493 76 L 3.9893 8.6040 120.9941 58.0865 42.5350 178.4563 77 G 3.6326 8.1641 107.0812 48.5321 0.0000 175.5919 78 A 4.3003 8.4436 121.0345 52.8639 17.8868 178.8928 *80 H 4.6827 8.3158 118.3679 57.8012 30.7830 176.0783 81 T 3.7992 7.9302 114.9818 66.8045 68.4802 175.7278 82 H 4.2231 7.7889 119.9534 59.3988 29.6755 177.3740 83 L 3.9351 7.6988 118.1665 57.0475 41.5308 178.2934 84 A 4.2678 7.4291 118.3326 51.7510 19.7015 177.6242 85 L 4.1242 7.1895 118.8622 53.6168 42.5574 176.6588 86 P 4.3842 0.0000 0.0000 66.0145 31.1742 179.1379 87 G 3.5929 8.0338 105.0702 47.4697 0.0000 175.7868 88 V 3.6256 7.5440 120.0592 66.1080 31.6903 178.0549 89 T 3.8540 7.7391 115.0526 66.8411 68.2661 176.6270 90 Q 4.0078 8.3076 119.7251 58.8111 28.6960 178.6615 91 A 4.0029 8.0641 121.8536 55.1636 18.1918 179.7279 92 I 3.6647 7.7152 117.3660 64.7213 37.4685 178.0842 93 D 4.4944 8.2507 119.4613 57.2601 40.5032 178.6639 94 A 4.0423 8.1412 121.3865 55.2003 18.3598 179.6490 95 L 3.9600 7.9038 117.4737 57.8971 41.7801 179.9032 96 K 3.9639 7.8308 118.0721 59.3635 31.7689 178.1452 97 H 4.6769 7.6708 113.1786 56.1357 28.6886 176.1665 98 L 4.3001 7.5723 120.9815 53.5175 41.5474 176.2826 99 N 4.2493 7.5591 114.2840 54.1291 36.5230 174.2354 100 V 3.9380 7.1760 119.2782 62.5899 31.6795 175.6843 101 T 4.5668 8.5657 115.9441 61.3839 69.3030 173.8347 102 D 4.9034 7.7754 121.2565 52.8829 39.8770 174.8983 103 L 4.5527 8.0093 122.0014 55.9978 42.6901 176.1172 104 K 4.6620 9.1979 126.9419 54.8374 35.7084 174.7237 105 I 5.0546 8.4927 127.1242 59.8829 40.4791 174.8374 106 T 4.6216 9.0748 122.9056 61.5862 71.9484 172.9857 107 A 5.2958 8.3111 126.5325 50.5081 22.4429 175.0051 108 Y 4.8133 9.0247 116.4168 56.3571 42.7931 174.5956 109 E 4.5415 9.0866 123.4453 56.1986 30.3334 176.0613 110 A 4.6688 8.6171 127.3045 50.3502 21.1729 177.6879 111 G 3.9672 8.2510 111.1140 44.5861 0.0000 173.1399 112 E 4.0613 8.5337 116.9272 55.6118 30.2690 176.5137 113 A 3.9334 8.4713 123.8209 52.6650 18.8573 177.2769 114 I 4.3182 8.0267 123.1253 59.1694 38.3348 175.2834 115 N 4.5010 8.6748 123.9179 53.3364 38.8867 175.2847 116 I 4.0158 8.3867 123.7869 62.4821 38.7419 175.9773 *118 G 3.7241 7.9334 112.5476 45.7199 0.0000 172.2725 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 19 V 7.91 4.35 2.25 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 1.18 0.00 0.00 0.98 0.00 0.00 20 I 8.93 4.85 2.03 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 1.05 0.59 1.05 0.00 0.00 21 S 9.62 5.30 0.00 4.02 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 22 H 9.62 5.28 0.00 3.38 3.34 0.00 5.77 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 23 G 9.02 4.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 T 8.71 5.44 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 1.18 0.00 0.00 25 L 8.69 5.00 0.00 1.75 1.80 0.95 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 26 S 8.63 5.28 0.00 3.52 3.46 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 27 A 8.72 4.95 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.76 4.31 0.00 4.05 4.06 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 29 A 8.60 4.06 1.36 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 0.00 0.00 0.00 0.00 0.00 30 E 7.56 3.93 0.00 1.94 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 2.00 2.25 0.00 31 H 8.18 4.85 0.00 3.26 3.30 0.00 5.68 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 A 7.75 4.15 1.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 A 8.03 3.96 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 H 8.26 4.06 0.00 3.42 3.39 0.00 5.82 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 L 7.97 3.85 0.00 1.73 1.65 0.83 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 36 R 8.12 3.57 0.00 1.97 1.93 0.00 3.26 0.00 0.00 3.21 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.86 0.00 37 Q 8.02 3.92 0.00 2.13 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.79 0.00 0.00 0.00 0.00 0.00 2.32 2.39 0.00 38 L 8.00 3.93 0.00 1.86 1.78 0.91 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 39 L 8.08 3.99 0.00 1.73 1.69 0.50 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 40 V 7.89 3.60 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 1.00 0.00 0.00 0.94 0.00 0.00 41 H 8.30 4.08 0.00 3.31 3.44 0.00 5.64 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 42 I 8.04 3.66 1.93 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.73 0.89 0.00 0.00 43 A 8.20 3.57 1.55 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 0.00 0.00 44 Q 7.85 3.83 0.00 2.39 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.91 0.00 0.00 0.00 0.00 0.00 2.37 2.25 0.00 45 A 7.78 4.04 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 46 T 7.81 4.11 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 1.11 0.00 0.00 47 R 7.60 3.80 0.00 1.73 1.94 0.00 3.12 0.00 0.00 3.20 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.79 0.00 48 Q 7.58 4.24 0.00 2.11 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.91 0.00 0.00 0.00 0.00 0.00 2.34 2.49 0.00 49 E 7.76 4.33 0.00 2.34 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 2.41 2.48 0.00 50 D 8.64 4.53 0.00 2.76 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 G 9.07 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 52 C 7.89 3.59 0.00 2.26 2.69 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 0.00 0.00 0.00 0.00 53 L 8.08 4.34 0.00 1.58 1.65 0.93 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 54 L 7.21 4.46 0.00 1.58 1.19 0.85 0.46 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 55 Y 8.39 4.71 0.00 2.80 2.67 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 0.00 0.00 0.00 56 L 8.93 4.91 0.00 1.50 1.49 0.88 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 57 V 8.47 5.06 2.14 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 0.90 0.00 0.00 1.00 0.00 0.00 58 S 9.26 4.84 0.00 3.87 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 59 E 8.59 4.97 0.00 2.17 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 2.01 1.85 0.00 60 D 8.84 4.37 0.00 2.67 2.63 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 61 L 8.72 4.06 0.00 1.66 1.70 0.91 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 62 S 8.38 4.43 0.00 3.91 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 63 Q 7.68 4.42 0.00 1.81 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.92 6.91 0.00 0.00 0.00 0.00 0.00 2.17 2.29 0.00 64 P 0.00 4.38 0.00 2.01 1.98 0.00 3.64 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.07 0.00 65 G 9.52 3.89 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 0.00 0.00 0.00 0.00 0.00 0.00 66 H 7.58 5.09 0.00 3.10 3.12 0.00 5.56 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 F 9.33 5.46 0.00 2.92 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 68 L 9.17 5.18 0.00 1.72 1.49 0.98 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 69 I 8.90 4.71 1.81 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.57 0.61 0.00 0.00 70 T 8.73 4.92 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 1.15 0.00 0.00 71 E 9.12 5.00 0.00 2.08 1.76 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 1.49 2.08 0.00 72 H 8.91 5.45 0.00 2.91 3.09 0.00 5.58 0.00 0.00 0.00 0.00 6.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 W 9.02 4.98 0.00 3.17 3.27 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 74 D 9.38 4.70 0.00 2.69 2.81 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 75 N 7.95 4.95 0.00 2.83 2.78 0.00 0.00 5.96 7.79 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 76 L 8.60 3.99 0.00 1.56 1.66 0.82 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 77 G 8.16 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 0.00 0.00 0.00 78 A 8.44 4.30 1.60 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 *80 H 8.32 4.68 0.00 3.30 3.31 0.00 5.65 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 T 7.93 3.80 4.34 0.00 0.00 0.00 0.00 0.00 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 82 H 7.79 4.22 0.00 2.93 2.62 0.00 5.79 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 83 L 7.70 3.94 0.00 1.71 1.65 0.87 0.76 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 84 A 7.43 4.27 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 85 L 7.19 4.12 0.00 1.75 1.58 0.98 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 86 P 0.00 4.38 0.00 2.25 2.30 0.00 3.69 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.02 0.00 87 G 8.03 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 V 7.54 3.63 2.14 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 1.07 0.00 0.00 0.85 0.00 0.00 89 T 7.74 3.85 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 1.20 0.00 0.00 90 Q 8.31 4.01 0.00 2.24 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.81 0.00 0.00 0.00 0.00 0.00 2.37 2.47 0.00 91 A 8.06 4.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 I 7.72 3.66 2.02 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 1.53 0.71 0.91 0.00 0.00 93 D 8.25 4.49 0.00 2.84 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 94 A 8.14 4.04 1.39 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 95 L 7.90 3.96 0.00 1.88 1.73 0.94 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 96 K 7.83 3.96 0.00 1.90 1.68 0.00 1.63 0.00 0.00 1.60 0.00 0.00 2.92 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.41 1.63 7.81 97 H 7.67 4.68 0.00 3.08 3.31 0.00 5.63 0.00 0.00 0.00 0.00 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 L 7.57 4.30 0.00 1.79 1.60 0.92 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 99 N 7.56 4.25 0.00 2.83 2.90 0.00 0.00 6.82 7.01 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 0.00 100 V 7.18 3.94 2.22 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 0.88 0.00 0.00 1.06 0.00 0.00 101 T 8.57 4.57 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 1.20 0.00 0.00 102 D 7.78 4.90 0.00 2.82 2.87 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 0.00 103 L 8.01 4.55 0.00 1.68 1.64 1.02 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 104 K 9.20 4.66 0.00 1.83 1.59 0.00 1.65 0.00 0.00 1.68 0.00 0.00 2.86 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.35 1.41 7.81 105 I 8.49 5.05 1.88 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.81 0.94 0.00 0.00 106 T 9.07 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 0.84 0.00 0.00 107 A 8.31 5.30 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 0.00 108 Y 9.02 4.81 0.00 2.87 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 E 9.09 4.54 0.00 1.90 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 2.35 2.35 0.00 110 A 8.62 4.67 1.23 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 0.00 0.00 0.00 111 G 8.25 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 0.00 112 E 8.53 4.06 0.00 2.09 1.97 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 2.27 2.30 0.00 113 A 8.47 3.93 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 0.00 114 I 8.03 4.32 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 1.40 0.87 0.90 0.00 0.00 115 N 8.67 4.50 0.00 2.71 2.76 0.00 0.00 7.10 7.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 I 8.39 4.02 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 1.50 0.80 0.90 0.00 0.00 *118 G 7.93 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 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.