NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 7 T 4.2519 8.1744 110.9426 61.1920 70.1476 173.0407 8 D 4.2891 8.5121 125.6280 51.5078 41.3977 174.4693 9 P 4.4137 0.0000 0.0000 65.3944 32.5262 177.0770 10 R 4.1462 8.8272 116.9343 57.1917 30.4474 176.7572 11 A 4.2336 7.5926 120.7241 51.0355 19.0041 177.1716 12 K 3.9348 8.5465 120.9045 56.3277 32.6165 176.6055 13 W 4.2412 8.9082 135.0000 57.3441 31.1987 175.1508 14 V 4.0962 7.6273 125.1584 60.0377 32.2854 173.2501 15 P 4.0202 0.0000 0.0000 62.2371 32.1684 175.4114 16 Q 4.6677 8.5502 117.0049 54.6927 31.8814 174.1840 17 D 5.4749 8.5202 115.7509 54.2186 41.5094 175.3917 18 N 4.9979 9.5294 113.4481 52.0605 38.8233 174.1189 19 D 4.3600 8.0797 119.7557 53.3051 42.6493 175.2306 20 I 3.0088 7.9619 120.6478 62.3640 37.9229 176.5825 21 Q 4.2697 8.4011 119.3003 55.9629 29.2885 175.2053 22 A 4.7828 7.4621 121.7143 50.5271 20.6468 177.8209 23 C 4.7039 8.9136 118.3476 59.0881 41.3573 174.2898 24 D 5.0217 8.1266 118.8454 52.9406 39.5517 175.2926 25 Y 4.7749 8.1460 122.2995 57.4289 39.6595 176.6655 26 W 4.5491 8.6857 124.8225 59.9235 28.0329 178.2133 27 R 3.4409 5.8400 115.1708 57.6956 29.8633 176.3137 28 H 5.1750 8.3422 115.9906 55.8033 28.9128 174.6967 29 C 3.1320 7.8863 116.2855 57.7154 41.3788 174.2458 30 S 4.8877 7.6596 115.1105 56.7891 62.5505 173.6772 31 I 3.4707 7.4205 118.1277 60.0941 39.1487 174.2449 32 D 4.7509 8.8899 126.8159 54.7596 44.2962 172.2177 33 G 4.1329 7.8451 118.0210 44.2497 0.0000 175.5014 34 N 5.3978 9.0835 122.1529 50.9536 42.5661 173.4186 35 I 4.2830 8.2146 122.6813 60.9032 37.5707 176.5832 36 C 4.1914 8.6239 124.4514 59.9901 34.9254 175.8606 37 D 4.1745 8.0970 118.2968 56.7888 40.8839 177.6533 38 C 4.7822 8.0937 114.8332 57.3970 40.3901 173.7766 39 S 4.6243 8.3449 114.0229 58.2696 63.1375 175.0536 40 G 4.0352 8.7837 108.6829 46.0105 0.0000 175.2260 41 G 4.0778 7.5321 110.6004 44.8123 0.0000 171.2627 42 S 5.0009 8.1465 114.8850 56.0935 66.3015 173.2104 43 L 4.0405 8.6739 120.7370 58.0640 41.6898 178.5221 44 T 4.7228 7.8086 104.2057 60.9648 69.6365 172.9301 45 N 5.0691 7.9054 118.9380 51.7234 41.9357 173.3338 46 C 4.7312 8.4081 118.0329 55.7182 36.5645 172.1829 47 P 4.6519 0.0000 0.0000 61.4315 31.7064 174.4441 48 P 4.2185 0.0000 0.0000 64.1854 31.6601 177.0884 49 G 4.0310 8.8635 110.4355 45.4382 0.0000 173.6189 50 T 4.3340 6.7571 109.2617 60.7412 70.7796 174.2138 51 K 4.5868 8.9036 121.3941 54.4209 34.9576 175.4413 52 L 4.5199 8.4153 126.8070 54.2862 43.1397 175.9402 53 A 4.6351 8.5309 128.5183 52.4160 18.9958 176.8146 54 T 4.4154 8.8710 109.0762 62.4530 71.1460 174.8860 55 A 4.9236 7.9495 123.4043 51.1015 21.5778 176.5582 56 S 3.5544 7.1987 118.4727 58.0851 67.6732 177.4682 *58 V 4.4661 8.6301 113.6277 61.6819 32.6468 173.0011 59 A 4.7668 8.2259 120.1337 51.3193 22.5186 175.5039 60 S 5.0665 8.8011 116.0274 57.6093 63.2308 173.8405 61 C 5.2724 9.4542 125.9916 55.3664 42.7668 172.6900 62 Y 4.6597 9.0416 124.9653 57.3944 39.6013 173.9569 63 N 3.5270 8.4795 126.7759 50.7950 39.2534 173.8746 64 P 3.9689 0.0000 0.0000 65.4966 31.8787 178.2253 65 T 3.8535 7.8956 116.2498 66.2235 68.2584 175.0755 66 D 4.5871 7.5862 116.3636 52.2118 40.0101 176.5328 67 G 3.7641 7.7004 107.1834 46.4642 0.0000 173.5024 68 Q 4.5772 8.1081 118.5872 54.1081 31.8011 174.5517 69 S 5.3116 8.1888 116.7211 57.2385 65.4260 172.9019 70 Y 5.1328 9.2823 122.0477 56.0092 41.6765 174.4828 71 L 4.8940 9.3372 125.0418 54.5673 43.6907 175.2628 72 I 4.6480 8.8954 127.7511 59.5639 39.4932 174.6601 73 A 4.3703 8.1150 129.3314 50.5233 19.5101 177.0271 74 Y 4.6116 8.1603 121.6934 58.1794 36.3355 174.8912 75 R 4.3920 7.9387 121.2063 55.7777 32.3817 175.7268 76 D 5.2221 8.7571 123.2625 53.7329 43.6082 174.5712 77 C 5.1906 8.9756 118.9497 55.8199 37.6742 172.5756 78 C 5.8247 8.9342 120.6199 54.3825 44.3266 174.8089 79 G 4.0960 9.2062 105.1447 46.0630 0.0000 172.8586 80 Y 4.7323 7.4105 114.5553 55.6664 42.0101 174.5553 81 N 4.6214 8.4823 120.2109 52.7771 39.8298 175.1569 82 V 3.9994 8.6367 121.6740 61.2466 31.7551 176.3908 83 S 4.1389 8.3584 118.6955 60.2271 62.7608 175.9290 84 G 3.9774 7.7972 107.3363 44.9635 0.0000 172.9965 85 R 4.5307 7.6972 118.1123 55.5776 33.2876 175.3078 86 C 4.2901 8.6997 117.5132 57.5638 37.5818 171.1160 87 P 5.1073 0.0000 0.0000 63.2421 32.5624 178.2369 88 C 4.9837 9.1925 118.4722 55.9458 45.4598 173.4075 89 L 4.8057 8.3563 123.6948 54.3644 43.5851 174.4211 90 N 5.0690 9.0120 124.0960 50.8822 42.8549 174.7112 91 T 4.7111 7.5041 109.4539 60.9622 68.9213 174.0648 92 E 3.8826 8.2442 122.5711 58.5930 29.5496 177.8574 93 G 3.7464 8.8113 111.7977 45.4637 0.0000 172.2046 94 E 4.2999 7.8261 121.4309 56.0775 29.8926 176.3329 95 L 4.7237 8.1271 126.4032 52.1556 44.6688 174.2667 96 P 4.5045 0.0000 0.0000 62.2708 32.0992 178.1015 97 V 3.6605 8.4935 120.4098 64.8772 31.1450 176.7246 98 Y 4.4905 7.7819 115.9986 57.7397 38.8406 175.6378 99 R 4.7202 7.7394 119.2112 53.8327 30.8511 174.1078 100 P 4.4711 0.0000 0.0000 65.8551 31.7367 179.0042 101 E 3.7079 8.2033 115.6227 58.3760 29.3421 177.5013 102 F 5.1218 8.3550 115.9344 56.8686 39.9585 173.8430 103 A 5.0342 8.1933 124.9606 51.2296 19.5652 177.5731 104 N 5.0938 9.3113 119.8505 52.8127 37.5736 175.4624 105 D 4.7465 7.8511 118.2459 55.1705 41.6213 177.0922 106 I 3.4756 7.2442 119.9385 60.8225 37.4759 175.9389 107 I 3.8533 7.6327 125.5060 60.5041 36.7460 176.8735 108 W 4.7698 8.6932 130.6101 55.7763 27.5448 176.7238 109 C 4.9192 7.3177 114.6901 56.1799 41.4986 174.4369 110 F 4.5583 7.5956 119.9084 59.3721 38.9062 176.2534 111 G 4.6063 9.4116 112.4137 46.4604 0.0000 173.7454 112 A 4.6223 7.7063 122.4605 51.1419 19.2579 176.8229 113 E 4.0618 8.5992 121.4100 57.5496 30.2789 176.7045 114 D 4.5455 9.1280 121.5399 54.8796 38.3625 173.3607 115 D 4.4065 7.8541 114.2838 54.8737 39.0428 173.9582 116 A 4.1079 7.7398 121.1484 53.0108 18.5840 178.3331 117 M 4.6811 8.4693 120.1582 54.6534 34.3692 175.7012 118 T 4.3288 7.6283 110.1720 61.3652 70.9326 172.9183 119 Y 4.4746 8.5541 125.0239 57.5744 40.1098 173.7427 120 H 4.7842 7.8811 124.9127 57.0665 32.4268 171.1074 121 C 4.9775 6.6421 109.6442 55.1008 39.6407 171.8054 122 T 5.3569 9.0854 115.3983 61.8147 71.8161 173.9168 123 I 4.5212 8.3275 118.5256 59.0229 39.9985 175.7958 124 S 4.5684 8.2677 117.4080 56.5266 63.0714 172.6603 125 P 4.4653 0.0000 0.0000 62.0203 32.8612 176.1781 126 I 4.4979 8.0012 121.2158 60.9998 37.8703 176.2936 127 V 4.2491 9.5793 117.3550 60.2141 32.7720 175.7155 128 G 4.1827 7.3760 109.6752 44.9693 0.0000 171.3410 129 K 4.4050 8.0930 118.6559 55.8956 32.7348 177.7091 130 A 4.9324 8.4584 126.1951 51.6948 22.0727 176.8945 131 S 4.4060 8.6521 110.3946 59.2854 62.9380 174.6959 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 7 T 8.17 4.25 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 1.22 0.00 0.00 8 D 8.51 4.29 0.00 2.83 2.62 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.41 0.00 2.24 2.20 0.00 3.83 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.01 0.00 10 R 8.83 4.15 0.00 2.00 2.04 0.00 3.17 0.00 0.00 3.24 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.59 0.00 11 A 7.59 4.23 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 12 K 8.55 3.93 0.00 1.76 1.79 0.00 1.80 0.00 0.00 1.65 0.00 0.00 2.93 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.51 1.51 7.81 13 W 8.91 4.24 0.00 3.29 3.25 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 14 V 7.63 4.10 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 0.83 0.00 0.00 0.95 0.00 0.00 15 P 0.00 4.02 0.00 2.22 1.76 0.00 3.67 0.00 0.00 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.17 0.00 16 Q 8.55 4.67 0.00 2.29 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.90 7.00 0.00 0.00 0.00 0.00 0.00 2.27 2.43 0.00 17 D 8.52 5.47 0.00 2.58 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 18 N 9.53 5.00 0.00 2.77 2.89 0.00 0.00 6.51 8.06 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 19 D 8.08 4.36 0.00 2.66 2.57 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 20 I 7.96 3.01 1.34 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.54 0.01 0.00 0.00 21 Q 8.40 4.27 0.00 2.16 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.70 0.00 0.00 0.00 0.00 0.00 2.32 2.24 0.00 22 A 7.46 4.78 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 C 8.91 4.70 0.00 3.13 3.35 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 0.00 0.00 0.00 0.00 24 D 8.13 5.02 0.00 2.62 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 25 Y 8.15 4.77 0.00 3.30 2.89 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 26 W 8.69 4.55 0.00 3.72 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 27 R 5.84 3.44 0.00 1.38 1.53 0.00 2.99 0.00 0.00 2.82 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.50 0.00 28 H 8.34 5.18 0.00 3.55 3.36 0.00 5.63 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 C 7.89 3.13 0.00 2.75 3.57 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 30 S 7.66 4.89 0.00 3.78 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 I 7.42 3.47 1.87 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 1.09 1.24 0.85 0.00 0.00 32 D 8.89 4.75 0.00 2.79 2.38 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 33 G 7.85 4.13 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 N 9.08 5.40 0.00 2.70 2.83 0.00 0.00 7.38 7.60 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 35 I 8.21 4.28 1.86 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 1.12 0.84 0.96 0.00 0.00 36 C 8.62 4.19 0.00 2.91 3.11 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 0.00 0.00 0.00 37 D 8.10 4.17 0.00 2.71 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 38 C 8.09 4.78 0.00 3.11 3.09 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 39 S 8.34 4.62 0.00 3.98 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 40 G 8.78 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 41 G 7.53 4.08 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 0.00 0.00 0.00 0.00 0.00 0.00 42 S 8.15 5.00 0.00 3.89 3.80 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 43 L 8.67 4.04 0.00 1.66 1.67 0.91 0.59 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 44 T 7.81 4.72 4.21 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 0.00 0.00 1.17 0.00 0.00 45 N 7.91 5.07 0.00 2.73 2.67 0.00 0.00 7.01 8.18 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 46 C 8.41 4.73 0.00 2.90 2.91 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 47 P 0.00 4.65 0.00 1.94 2.06 0.00 3.46 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 2.07 2.12 0.00 48 P 0.00 4.22 0.00 2.00 1.96 0.00 3.62 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.05 0.00 49 G 8.86 4.03 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 0.00 0.00 0.00 0.00 0.00 0.00 50 T 6.76 4.33 4.10 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 0.31 0.00 0.00 51 K 8.90 4.59 0.00 1.62 1.73 0.00 1.68 0.00 0.00 1.57 0.00 0.00 2.80 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.37 1.65 7.81 52 L 8.42 4.52 0.00 1.75 1.53 0.92 1.14 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 53 A 8.53 4.64 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 54 T 8.87 4.42 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 55 A 7.95 4.92 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 56 S 7.20 3.55 0.00 3.97 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 *58 V 8.63 4.47 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 0.91 0.00 0.00 0.97 0.00 0.00 59 A 8.23 4.77 1.45 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 0.00 0.00 0.00 0.00 0.00 0.00 60 S 8.80 5.07 0.00 3.96 3.84 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 61 C 9.45 5.27 0.00 3.28 3.55 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 62 Y 9.04 4.66 0.00 3.01 3.04 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 63 N 8.48 3.53 0.00 1.44 2.28 0.00 0.00 6.56 7.73 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 64 P 0.00 3.97 0.00 2.12 2.13 0.00 3.10 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.88 0.00 65 T 7.90 3.85 4.13 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 0.00 0.00 0.00 1.12 0.00 0.00 66 D 7.59 4.59 0.00 2.68 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 G 7.70 3.76 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 0.00 0.00 0.00 0.00 0.00 0.00 68 Q 8.11 4.58 0.00 1.84 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.34 6.73 0.00 0.00 0.00 0.00 0.00 2.39 2.35 0.00 69 S 8.19 5.31 0.00 3.76 3.84 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 70 Y 9.28 5.13 0.00 3.28 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 71 L 9.34 4.89 0.00 1.80 1.60 1.10 1.11 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 72 I 8.90 4.65 1.45 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 1.03 0.19 0.00 0.00 73 A 8.12 4.37 1.12 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 0.00 0.00 0.00 0.00 0.00 0.00 74 Y 8.16 4.61 0.00 2.96 3.01 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 75 R 7.94 4.39 0.00 1.79 1.88 0.00 3.08 0.00 0.00 3.31 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.77 0.00 76 D 8.76 5.22 0.00 2.81 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 77 C 8.98 5.19 0.00 2.70 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 78 C 8.93 5.82 0.00 2.78 3.09 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 79 G 9.21 4.10 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 0.00 0.00 0.00 80 Y 7.41 4.73 0.00 2.63 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 81 N 8.48 4.62 0.00 2.64 2.74 0.00 0.00 7.01 7.71 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 82 V 8.64 4.00 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 1.01 0.00 0.00 1.10 0.00 0.00 83 S 8.36 4.14 0.00 3.98 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 84 G 7.80 3.98 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 0.00 85 R 7.70 4.53 0.00 1.79 1.83 0.00 3.33 0.00 0.00 3.46 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.71 0.00 86 C 8.70 4.29 0.00 3.10 3.09 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 87 P 0.00 5.11 0.00 2.08 2.06 0.00 3.78 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 2.00 2.01 0.00 88 C 9.19 4.98 0.00 2.84 2.98 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 89 L 8.36 4.81 0.00 1.52 1.48 0.89 0.85 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 90 N 9.01 5.07 0.00 2.34 1.99 0.00 0.00 6.19 6.57 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 91 T 7.50 4.71 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 1.17 0.00 0.00 92 E 8.24 3.88 0.00 1.91 1.94 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 1.95 2.25 0.00 93 G 8.81 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 94 E 7.83 4.30 0.00 1.95 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 2.60 2.58 0.00 95 L 8.13 4.72 0.00 1.58 1.47 0.84 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 96 P 0.00 4.50 0.00 1.40 2.00 0.00 3.25 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.05 0.00 97 V 8.49 3.66 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 0.83 0.00 0.00 0.95 0.00 0.00 98 Y 7.78 4.49 0.00 3.10 3.12 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 0.00 0.00 0.00 0.00 99 R 7.74 4.72 0.00 1.81 1.91 0.00 3.40 0.00 0.00 3.35 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 1.56 0.00 100 P 0.00 4.47 0.00 2.50 2.49 0.00 3.82 0.00 0.00 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.07 0.00 101 E 8.20 3.71 0.00 1.50 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 1.47 1.47 0.00 102 F 8.35 5.12 0.00 3.10 2.95 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 0.00 103 A 8.19 5.03 1.48 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 0.00 0.00 104 N 9.31 5.09 0.00 2.78 2.90 0.00 0.00 7.01 8.57 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 0.00 105 D 7.85 4.75 0.00 2.62 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 0.00 106 I 7.24 3.48 0.93 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 1.16 0.29 -0.40 0.00 0.00 107 I 7.63 3.85 1.63 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 1.24 0.65 0.95 0.00 0.00 108 W 8.69 4.77 0.00 3.60 3.33 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 0.00 109 C 7.32 4.92 0.00 2.75 3.19 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 0.00 110 F 7.60 4.56 0.00 3.30 3.05 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 0.00 111 G 9.41 4.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.71 4.62 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 0.00 113 E 8.60 4.06 0.00 2.02 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 2.39 2.35 0.00 114 D 9.13 4.55 0.00 2.88 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 0.00 115 D 7.85 4.41 0.00 2.86 2.76 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 0.00 0.00 0.00 116 A 7.74 4.11 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 0.00 117 M 8.47 4.68 0.00 1.87 2.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.58 0.00 118 T 7.63 4.33 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 1.22 0.00 0.00 119 Y 8.55 4.47 0.00 3.14 2.90 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 0.00 0.00 0.00 120 H 7.88 4.78 0.00 3.24 3.22 0.00 5.87 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 C 6.64 4.98 0.00 3.12 2.88 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 0.00 0.00 0.00 122 T 9.09 5.36 4.41 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 1.56 0.00 0.00 123 I 8.33 4.52 1.97 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 1.43 0.61 0.87 0.00 0.00 124 S 8.27 4.57 0.00 3.85 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 0.00 125 P 0.00 4.47 0.00 2.15 2.11 0.00 3.78 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.91 0.00 126 I 8.00 4.50 1.85 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.43 1.07 0.00 0.00 127 V 9.58 4.25 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 0.63 0.00 0.00 1.00 0.00 0.00 128 G 7.38 4.18 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 0.00 129 K 8.09 4.40 0.00 1.62 1.65 0.00 1.64 0.00 0.00 1.57 0.00 0.00 2.80 0.00 0.00 2.87 0.00 0.00 0.00 0.00 0.93 1.32 7.81 130 A 8.46 4.93 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 0.00 131 S 8.65 4.41 0.00 3.75 3.76 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 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.