NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 H 4.8853 8.4444 117.8490 55.4629 30.1896 172.6638 4 Y 4.1393 8.6103 124.8296 56.8252 39.3255 173.4883 5 K 4.0426 7.2155 125.1613 55.7865 35.9032 174.5069 6 T 4.0793 7.9018 114.4947 62.0938 69.8160 173.7702 7 L 4.2792 7.7366 124.5813 55.4185 42.3820 176.0850 8 R 4.6294 8.7786 125.4145 54.4569 34.0329 174.3985 9 Y 4.8383 7.9797 117.9786 56.5307 40.9340 174.4666 10 Y 5.1447 8.6789 120.0311 56.2284 43.0955 173.7154 11 E 5.2719 9.8090 122.1378 54.8928 33.2586 174.4904 12 T 5.4507 9.6734 123.0381 61.8923 72.2999 173.0871 13 V 5.1982 9.2543 125.6369 61.1982 34.9373 174.2240 14 F 5.6373 8.8954 121.0462 55.3021 42.2034 172.9511 15 A 4.6114 9.3063 121.8502 50.0438 21.4188 175.3410 16 V 4.7664 8.5519 123.5175 60.7983 33.9766 175.4777 17 K 4.0097 8.8199 127.4994 56.2376 33.3056 175.8695 18 P 4.4794 0.0000 0.0000 64.0070 31.5263 176.7637 19 T 4.2811 7.3282 108.3078 62.1713 69.5385 174.9923 20 L 4.3939 7.1214 121.7387 54.2815 42.5040 177.5581 21 S 4.3930 9.2557 117.5223 57.8712 65.1386 174.8595 22 E 3.8999 8.8550 123.1685 60.0840 29.1601 179.2815 23 E 4.0322 8.1303 117.7020 59.3815 29.5832 178.9972 24 E 4.0045 8.2663 118.6989 59.5295 29.5308 179.2553 25 M 4.2036 8.4070 118.9979 58.5666 32.1155 179.0083 26 K 4.1024 8.1723 118.5643 59.1943 32.1261 179.3410 27 K 3.8669 8.0902 119.9180 59.3362 32.1456 178.3683 28 K 3.7863 8.3627 120.4042 59.7501 32.0343 178.0797 29 F 4.4388 8.0355 120.3930 61.6123 39.1980 176.8829 30 E 3.7447 8.1066 118.0258 59.5066 29.2222 179.4490 31 Q 3.9919 8.4406 118.5088 58.7512 28.6302 179.0300 32 V 3.4187 7.9155 119.4146 65.9007 31.5187 178.2343 33 K 3.8296 7.9676 118.2528 59.4371 31.7709 178.9212 34 E 3.8903 8.2410 119.5764 58.7253 29.5915 178.4295 35 F 3.9306 8.2093 120.8755 61.3405 39.4845 177.0798 36 I 3.5267 8.0171 119.4329 64.3892 36.6475 178.5362 37 K 4.3139 7.8283 119.3599 58.7631 31.9894 178.6261 38 Q 4.0443 8.2371 120.2339 59.2747 28.6849 178.2438 39 K 4.3296 7.1397 115.0247 56.3442 31.9679 177.4350 40 G 3.9085 7.9116 107.6958 45.3796 0.0000 173.5770 41 G 4.2741 7.8394 105.7674 44.0360 0.0000 172.7791 42 E 4.9027 9.2143 124.7757 54.0815 31.7594 174.9400 43 I 4.5322 8.5317 128.4541 61.6931 37.0829 175.6736 44 L 4.6574 8.9280 127.6073 56.0786 43.2006 176.1359 45 Y 4.9073 7.9511 117.0072 57.2049 42.0368 172.5161 46 E 5.3306 7.2549 119.9977 55.4396 32.5342 174.1499 47 E 4.6330 9.5798 121.3866 54.6808 34.0549 173.8505 48 D 4.9354 8.6511 123.2500 52.7128 42.3334 175.7541 49 W 4.0953 8.9769 125.4021 55.7046 30.1883 178.3392 50 G 3.7773 8.4299 110.8433 45.3056 0.0000 172.0415 51 M 4.7538 8.4252 118.6079 55.3984 32.7715 176.4695 52 R 4.7571 9.0294 121.7263 54.0921 34.8107 174.5055 53 Q 4.7756 8.5738 123.6578 55.6822 29.7563 175.5638 54 L 4.4121 8.8799 126.4766 54.1861 42.2512 177.1818 55 A 3.8313 8.6550 125.5233 54.8573 18.5905 177.6361 56 Y 5.0164 7.2979 110.2722 55.2339 42.0213 173.4556 57 P 5.2281 0.0000 0.0000 62.6681 32.1336 176.1951 58 I 4.4784 7.8580 119.3612 60.7438 39.9772 175.5164 59 Q 3.5007 9.6961 125.7502 57.0277 26.1624 174.2039 60 K 3.8301 8.2476 111.3070 57.3266 29.6376 175.8457 61 F 5.0598 7.6174 117.0855 56.0546 41.2507 175.8899 62 N 5.0677 8.8515 119.5007 53.3282 40.4577 173.6872 63 N 5.6436 7.9783 114.8709 51.7865 43.6222 172.7182 64 A 4.3812 8.6881 119.7108 51.2433 23.6012 175.3657 65 R 4.5045 8.5113 120.7839 55.4857 31.5321 174.7070 66 Y 4.7049 8.3330 124.7459 56.3980 40.1066 175.0086 67 F 5.1414 8.1413 122.0379 55.4267 43.2299 173.9579 68 L 5.5578 9.0181 122.4186 53.5642 45.7700 175.5160 69 V 5.3040 9.5016 125.0011 60.3253 35.0249 174.2463 70 Q 5.5601 9.4843 122.9134 54.6233 31.8200 174.4975 71 F 5.6578 8.9967 116.3383 55.8671 41.9723 172.9015 72 K 4.9530 8.9684 118.6340 55.7566 35.7034 174.8423 73 T 4.7763 8.5736 114.4382 61.7811 70.9779 173.7399 74 E 4.5732 8.8456 124.1870 55.8819 30.4411 176.0800 75 N 4.5976 8.3029 119.7040 51.9755 38.1841 173.6369 76 P 4.4869 0.0000 0.0000 65.0255 31.9483 177.2470 77 Q 4.3098 8.0631 117.1479 56.2665 29.3896 177.3484 78 L 3.9397 7.9896 121.1330 57.8273 42.0820 177.0130 79 P 4.2692 0.0000 0.0000 65.4058 31.2456 178.1011 80 N 4.3190 8.0978 115.4613 56.6213 38.9145 176.2597 81 E 4.0406 8.5112 121.0615 59.3980 29.7013 178.6319 82 L 3.8064 8.4020 120.6701 58.0383 42.0865 178.2411 83 D 4.3682 8.1401 118.0688 57.3178 41.0966 178.1073 84 F 4.0384 8.3122 120.9960 61.3200 39.4615 176.6911 85 Q 3.5705 8.1750 119.4316 59.2562 28.4552 178.5235 86 L 3.5256 7.4361 118.9732 56.9584 41.6377 178.7924 87 K 2.0000 6.6813 119.3504 59.0973 32.1069 178.6356 88 I 3.6996 6.9383 112.0236 62.1427 37.7479 175.5083 89 D 4.1552 7.2058 121.1298 54.2300 41.0306 176.7451 90 E 4.0622 8.5923 126.8965 59.1364 29.9668 178.1549 91 D 4.3367 8.5316 118.6869 56.0134 41.1325 175.5967 92 V 4.7874 7.3516 119.5207 61.5858 31.7870 175.6180 93 I 4.6108 8.9169 121.8648 61.0130 38.7239 175.6698 94 R 4.6535 7.9124 122.5973 55.2849 33.3735 173.2897 95 W 5.9252 7.9404 121.9778 55.2605 31.5471 174.1596 96 L 4.8000 9.5541 122.2569 53.5058 45.7998 174.6251 97 N 5.6623 9.0681 120.6692 51.5623 41.6484 173.9172 98 I 4.7219 9.1018 123.9486 59.4901 41.1072 174.3772 99 Q 4.7098 8.9550 128.4072 55.5891 29.8314 174.5532 100 I 4.7649 8.2094 118.8853 58.7692 41.2422 175.1324 101 K 4.2459 9.4058 122.2255 55.3565 32.9232 178.2396 102 E 2.9620 8.2986 121.2969 58.9205 29.5560 178.7658 103 S 4.2203 7.6954 111.2145 59.7977 63.4435 174.3287 104 E 4.2233 7.5317 119.5990 56.5217 29.7201 176.6169 105 V 3.8046 7.2164 120.1359 62.5839 31.9560 175.5770 106 K 4.3096 8.2241 126.7503 54.8168 34.1155 174.9551 107 K 4.7678 7.6617 117.6531 56.0469 35.1577 175.6135 108 N 4.1769 9.1531 115.8980 52.5783 36.6275 174.3752 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 3 H 8.44 4.89 0.00 3.17 3.31 0.00 5.69 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 Y 8.61 4.14 0.00 2.98 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 5 K 7.22 4.04 0.00 1.61 1.50 0.00 1.83 0.00 0.00 1.80 0.00 0.00 3.03 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.42 1.30 7.81 6 T 7.90 4.08 4.20 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 1.06 0.00 0.00 7 L 7.74 4.28 0.00 1.60 1.56 0.56 0.70 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 8 R 8.78 4.63 0.00 1.77 1.13 0.00 3.14 0.00 0.00 3.19 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.48 0.00 9 Y 7.98 4.84 0.00 2.94 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 10 Y 8.68 5.14 0.00 1.43 2.45 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 11 E 9.81 5.27 0.00 2.06 1.85 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 2.35 2.46 0.00 12 T 9.67 5.45 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 1.57 0.00 0.00 13 V 9.25 5.20 2.20 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 1.25 0.00 0.00 1.01 0.00 0.00 14 F 8.90 5.64 0.00 3.39 3.22 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 15 A 9.31 4.61 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.55 4.77 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 1.22 0.00 0.00 17 K 8.82 4.01 0.00 0.80 1.56 0.00 1.34 0.00 0.00 1.62 0.00 0.00 3.04 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.46 1.19 7.81 18 P 0.00 4.48 0.00 2.16 2.11 0.00 2.28 0.00 0.00 3.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 2.04 0.00 19 T 7.33 4.28 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 1.38 0.00 0.00 20 L 7.12 4.39 0.00 1.68 1.65 0.94 0.86 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 21 S 9.26 4.39 0.00 4.01 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 22 E 8.86 3.90 0.00 2.11 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 0.00 2.41 2.54 0.00 23 E 8.13 4.03 0.00 2.11 2.00 0.00 0.00 0.00 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 24 E 8.27 4.00 0.00 2.28 2.02 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 2.34 2.36 0.00 25 M 8.41 4.20 0.00 2.32 2.37 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.66 0.00 26 K 8.17 4.10 0.00 1.86 1.93 0.00 1.85 0.00 0.00 1.86 0.00 0.00 3.02 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.71 1.69 7.81 27 K 8.09 3.87 0.00 2.01 2.01 0.00 1.54 0.00 0.00 1.57 0.00 0.00 2.97 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.44 1.49 7.81 28 K 8.36 3.79 0.00 2.04 2.14 0.00 1.62 0.00 0.00 1.60 0.00 0.00 2.95 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.67 1.56 7.81 29 F 8.04 4.44 0.00 1.68 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 30 E 8.11 3.74 0.00 2.13 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 2.46 2.44 0.00 31 Q 8.44 3.99 0.00 2.25 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.82 0.00 0.00 0.00 0.00 0.00 2.35 2.43 0.00 32 V 7.92 3.42 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 0.90 0.00 0.00 0.45 0.00 0.00 33 K 7.97 3.83 0.00 1.81 1.68 0.00 1.00 0.00 0.00 0.61 0.00 0.00 2.54 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.29 1.28 7.81 34 E 8.24 3.89 0.00 2.25 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 0.00 2.26 2.31 0.00 35 F 8.21 3.93 0.00 3.21 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 36 I 8.02 3.53 1.81 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.96 0.22 0.00 0.00 37 K 7.83 4.31 0.00 1.86 1.81 0.00 1.63 0.00 0.00 1.62 0.00 0.00 3.06 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.44 1.26 7.81 38 Q 8.24 4.04 0.00 2.08 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 7.00 0.00 0.00 0.00 0.00 0.00 2.16 2.29 0.00 39 K 7.14 4.33 0.00 1.55 1.63 0.00 1.50 0.00 0.00 1.43 0.00 0.00 2.57 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.91 0.82 7.81 40 G 7.91 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 41 G 7.84 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 0.00 0.00 0.00 0.00 42 E 9.21 4.90 0.00 2.05 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 2.28 2.30 0.00 43 I 8.53 4.53 1.90 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.89 0.98 0.00 0.00 44 L 8.93 4.66 0.00 1.73 1.88 1.20 1.19 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 45 Y 7.95 4.91 0.00 3.22 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 46 E 7.25 5.33 0.00 2.37 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 2.12 2.41 0.00 47 E 9.58 4.63 0.00 2.14 1.80 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 2.14 2.15 0.00 48 D 8.65 4.94 0.00 2.79 2.51 0.00 0.00 0.00 0.00 0.00 0.00 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 W 8.98 4.10 0.00 3.29 3.20 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 50 G 8.43 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 0.00 0.00 0.00 51 M 8.43 4.75 0.00 1.91 2.00 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.48 0.00 52 R 9.03 4.76 0.00 1.87 1.70 0.00 3.01 0.00 0.00 2.47 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.60 0.00 53 Q 8.57 4.78 0.00 2.05 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.67 6.97 0.00 0.00 0.00 0.00 0.00 2.43 2.42 0.00 54 L 8.88 4.41 0.00 1.64 1.76 1.03 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 55 A 8.65 3.83 0.95 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 56 Y 7.30 5.02 0.00 2.96 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 57 P 0.00 5.23 0.00 2.21 2.27 0.00 3.53 0.00 0.00 4.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.01 0.00 58 I 7.86 4.48 2.00 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 1.47 1.58 1.07 0.00 0.00 59 Q 9.70 3.50 0.00 2.42 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.65 6.65 0.00 0.00 0.00 0.00 0.00 2.35 2.50 0.00 60 K 8.25 3.83 0.00 1.52 1.71 0.00 1.63 0.00 0.00 1.58 0.00 0.00 2.90 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.23 1.32 7.81 61 F 7.62 5.06 0.00 3.21 3.02 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 62 N 8.85 5.07 0.00 2.68 2.86 0.00 0.00 6.84 6.92 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 63 N 7.98 5.64 0.00 2.61 2.67 0.00 0.00 6.82 7.54 0.00 0.00 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 A 8.69 4.38 1.03 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 65 R 8.51 4.50 0.00 1.79 1.65 0.00 2.74 0.00 0.00 2.94 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.78 0.00 66 Y 8.33 4.70 0.00 2.90 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 67 F 8.14 5.14 0.00 1.63 1.65 0.00 0.00 0.00 0.00 0.00 0.00 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 9.02 5.56 0.00 1.87 1.76 1.13 1.39 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 69 V 9.50 5.30 2.58 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 1.15 0.00 0.00 1.20 0.00 0.00 70 Q 9.48 5.56 0.00 2.28 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.64 0.00 0.00 0.00 0.00 0.00 2.57 2.65 0.00 71 F 9.00 5.66 0.00 3.25 3.18 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 72 K 8.97 4.95 0.00 1.23 1.49 0.00 1.23 0.00 0.00 1.66 0.00 0.00 2.97 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.35 1.30 7.81 73 T 8.57 4.78 4.50 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 1.56 0.00 0.00 74 E 8.85 4.57 0.00 1.99 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 2.22 2.22 0.00 75 N 8.30 4.60 0.00 2.73 2.75 0.00 0.00 6.86 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 76 P 0.00 4.49 0.00 2.27 2.23 0.00 3.83 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.02 0.00 77 Q 8.06 4.31 0.00 2.20 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.86 6.84 0.00 0.00 0.00 0.00 0.00 2.35 2.43 0.00 78 L 7.99 3.94 0.00 1.93 1.70 0.96 0.89 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 79 P 0.00 4.27 0.00 2.16 1.96 0.00 3.61 0.00 0.00 3.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.87 0.00 80 N 8.10 4.32 0.00 2.86 2.96 0.00 0.00 6.84 7.65 0.00 0.00 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 E 8.51 4.04 0.00 2.36 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 0.00 2.34 2.67 0.00 82 L 8.40 3.81 0.00 2.03 1.71 0.71 1.21 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 83 D 8.14 4.37 0.00 3.15 2.97 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 84 F 8.31 4.04 0.00 3.13 3.18 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 85 Q 8.18 3.57 0.00 1.83 1.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.60 0.00 0.00 0.00 0.00 0.00 1.16 1.87 0.00 86 L 7.44 3.53 0.00 0.94 1.28 0.90 0.10 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 87 K 6.68 2.00 0.00 1.37 1.48 0.00 1.79 0.00 0.00 1.90 0.00 0.00 3.25 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.26 1.63 7.81 88 I 6.94 3.70 1.53 0.00 0.00 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.35 0.05 0.00 0.00 89 D 7.21 4.16 0.00 2.58 2.33 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 90 E 8.59 4.06 0.00 1.96 1.99 0.00 0.00 0.00 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 2.28 0.00 91 D 8.53 4.34 0.00 2.83 2.70 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 0.00 0.00 0.00 92 V 7.35 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 0.98 0.00 0.00 0.90 0.00 0.00 93 I 8.92 4.61 1.99 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 1.20 0.79 0.96 0.00 0.00 94 R 7.91 4.65 0.00 1.85 1.70 0.00 3.17 0.00 0.00 3.46 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.46 0.00 95 W 7.94 5.93 0.00 3.34 3.14 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 96 L 9.55 4.80 0.00 1.65 1.60 0.96 0.38 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 97 N 9.07 5.66 0.00 2.71 2.86 0.00 0.00 6.88 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 98 I 9.10 4.72 2.08 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 1.03 0.96 0.00 0.00 99 Q 8.96 4.71 0.00 2.18 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.80 0.00 0.00 0.00 0.00 0.00 2.13 1.78 0.00 100 I 8.21 4.76 1.94 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 1.21 0.84 0.93 0.00 0.00 101 K 9.41 4.25 0.00 1.78 1.65 0.00 1.62 0.00 0.00 1.52 0.00 0.00 2.85 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.39 1.32 7.81 102 E 8.30 2.96 0.00 1.37 1.63 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 2.01 1.47 0.00 103 S 7.70 4.22 0.00 3.94 3.88 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 0.00 104 E 7.53 4.22 0.00 2.10 1.98 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 2.25 2.16 0.00 105 V 7.22 3.80 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 0.85 0.00 0.00 0.89 0.00 0.00 106 K 8.22 4.31 0.00 0.79 1.06 0.00 1.58 0.00 0.00 1.60 0.00 0.00 2.97 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.18 1.27 7.81 107 K 7.66 4.77 0.00 1.91 1.76 0.00 1.60 0.00 0.00 1.79 0.00 0.00 3.14 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.33 1.48 7.81 108 N 9.15 4.18 0.00 2.99 3.14 0.00 0.00 5.89 7.56 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