NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 I 4.1695 8.0249 114.2697 60.7995 38.7648 177.5118 2 Q 4.8233 8.7954 115.5571 53.4497 31.9868 171.9655 3 R 4.7378 9.2486 120.8561 54.5569 33.9127 174.9205 4 T 5.0241 8.9191 118.7004 60.6800 68.3478 172.0631 5 P 4.8859 0.0000 0.0000 62.7700 32.5119 175.8427 6 K 4.5373 9.2570 122.6256 55.9570 33.9308 175.8712 7 I 5.2492 8.2327 122.8457 59.8099 40.9831 174.7683 8 Q 4.7378 9.2173 124.7361 54.1973 32.6826 174.1496 9 V 5.0721 8.5560 123.8472 61.5262 33.8430 173.9352 10 Y 5.2472 8.3571 124.8437 56.9317 41.7337 172.7519 11 S 5.0416 8.9232 113.6830 56.6315 65.0541 174.5056 12 R 4.1076 8.7897 122.7595 59.4583 30.1442 176.3655 13 H 5.1265 8.2838 112.9495 52.7600 31.6617 172.1625 14 P 4.3901 0.0000 0.0000 62.5319 31.6166 176.5857 15 A 4.1926 8.7852 125.9654 52.4004 18.8965 176.9382 16 E 4.5202 8.5225 121.7941 54.0562 31.5896 174.5292 17 N 4.2980 8.7509 120.3898 55.0764 38.9455 176.0479 18 G 3.9169 9.3326 110.9537 45.1759 0.0000 172.9580 19 K 4.4533 7.9360 121.8607 53.8242 34.1356 175.2663 20 S 4.1146 8.3859 120.2056 58.1337 63.1890 172.6171 21 N 4.9994 8.9116 125.2058 52.8161 42.5595 172.0009 22 F 5.2166 10.0192 116.2128 55.9202 43.3479 173.7542 23 L 4.0274 8.8639 125.6762 53.3193 43.4829 174.7717 24 N 5.3740 8.9355 124.1980 51.4597 42.0790 172.9706 25 C 5.2422 9.2683 122.0451 55.2350 43.6750 171.9517 26 Y 5.4123 9.5309 129.3402 56.3343 40.3953 174.4750 27 V 4.9741 8.5948 121.1411 59.8007 34.1480 175.4734 28 S 5.2141 8.1150 118.9587 55.9727 67.2192 174.2992 29 G 4.5602 8.8150 104.8329 47.2501 0.0000 173.1566 30 F 5.3161 7.3975 113.8058 55.6690 41.2029 173.9518 31 H 5.2435 8.9835 117.2557 54.8033 33.8006 172.1515 32 P 4.8466 0.0000 0.0000 62.5691 32.0416 175.9725 33 S 4.0170 8.4242 113.0731 60.6621 63.2678 174.6391 34 D 4.4190 7.8618 121.0619 54.5885 40.9889 175.1827 35 I 4.5248 7.9191 122.0820 59.8217 41.3294 172.9368 36 E 4.5492 9.0646 129.3399 54.3817 31.7623 174.6294 37 V 4.6072 8.0549 126.4560 61.0063 34.0452 174.2111 38 D 4.9277 8.9892 127.0733 52.4616 44.9956 174.5089 39 L 4.9675 8.3998 121.7684 53.3448 44.1924 175.3838 40 L 5.2600 9.3496 123.0381 52.7618 45.6325 175.5824 41 K 4.3174 9.0750 123.6490 54.4238 34.5188 175.9180 42 N 4.2709 9.3590 128.3817 54.4577 36.3011 176.0674 43 G 3.9537 8.1155 103.4752 45.6841 0.0000 172.9374 44 E 4.5613 7.6594 120.1506 53.9459 31.2487 175.4834 45 R 4.3130 8.4871 123.7855 56.4382 30.5483 176.0509 46 I 3.9671 8.5731 127.5935 61.0536 37.6773 175.6682 47 E 3.9013 8.7145 126.9997 59.1271 29.8092 177.5260 48 K 4.2244 7.7519 124.6321 55.7938 31.3714 176.4208 49 V 4.3878 7.9529 123.0551 61.1418 34.5796 174.1218 50 E 4.7088 8.3163 126.5741 54.9047 32.8465 174.2416 51 H 5.8297 8.0718 114.7981 53.7883 31.6031 173.1555 52 S 4.5569 8.5960 114.8071 58.0308 64.3588 173.0390 53 D 4.5635 8.4388 119.8925 53.2186 41.3794 176.4221 54 L 4.0113 8.4451 125.1853 56.2104 42.5872 175.8819 55 S 4.7308 8.1823 119.9805 57.0783 66.6499 171.9205 56 F 5.2403 7.4586 115.8294 55.3181 41.2610 174.4958 57 S 4.7005 9.0184 116.6911 57.1327 64.3231 175.5651 58 K 3.6367 8.4084 119.9014 59.2346 31.6839 177.7881 59 D 4.4782 7.8468 116.3585 52.6287 39.4651 177.3794 60 W 3.6651 7.6920 119.0767 56.8991 28.1779 174.7022 61 S 4.3425 8.0202 114.1093 58.1399 63.7693 174.0719 62 F 5.0648 8.5049 121.4057 57.3814 40.3251 174.1358 63 Y 5.3135 8.2271 117.6579 56.0343 41.6414 173.8893 64 L 5.2062 9.5117 120.9741 53.2777 47.1001 174.6475 65 L 5.5515 9.0903 124.1631 53.8117 44.5790 174.4790 66 Y 5.1621 9.3612 124.6313 56.5507 40.4929 174.4702 67 Y 5.8037 8.3935 120.7268 55.8958 42.3086 173.7063 68 T 5.0055 8.2624 113.7651 60.5979 70.9111 172.6404 69 E 4.0961 8.8409 126.5633 56.7551 30.5223 175.8003 70 F 4.6809 8.6582 114.4516 56.5131 41.5511 173.1340 71 T 4.5519 7.9118 116.8266 60.0896 70.6087 172.0681 72 P 4.6337 0.0000 0.0000 63.4911 32.8353 175.3694 73 T 4.8542 8.2932 110.2691 60.9708 71.2143 173.2909 74 E 4.1441 8.8849 122.2756 58.7100 30.1240 177.9037 75 K 4.1815 8.1158 117.1556 58.8413 32.6946 177.1305 76 D 4.4894 7.8248 117.4187 55.0156 41.3379 175.8782 77 E 4.8904 8.9625 121.4744 54.9211 32.4796 174.5419 78 Y 5.4193 8.3640 117.6407 56.8459 42.8352 173.7988 79 A 4.8905 8.3944 120.9307 51.8714 23.7964 174.1819 80 C 5.2598 9.3073 119.4484 54.8018 45.7753 172.5220 81 R 4.9822 9.3088 127.1527 54.5934 32.0522 174.4883 82 V 4.7905 8.9806 126.7168 60.9979 34.5803 173.6368 83 N 5.2832 9.1171 125.8702 52.2259 42.3226 172.3913 84 H 5.1755 8.4806 123.5137 54.5212 33.4498 174.3407 85 V 3.6138 8.0849 121.4725 64.7148 31.4897 177.2944 86 T 4.1796 8.0654 108.7824 62.2564 69.1721 173.3943 87 L 4.9496 7.6323 123.6083 52.9286 43.3413 176.9153 88 S 4.2967 8.6963 118.5921 60.4793 63.5439 174.1568 89 Q 4.5258 7.5779 119.8465 53.1178 31.9880 172.1963 90 P 4.4512 0.0000 0.0000 63.0927 32.3053 175.3336 91 K 4.5084 9.2724 125.3106 55.0569 34.0433 174.9156 92 I 4.9592 8.3281 127.5551 59.5703 39.7721 175.1390 93 V 4.4293 8.6744 125.8225 61.0465 34.3168 174.8665 94 K 4.7625 8.8070 127.3327 55.7641 33.2082 176.4705 95 W 4.6163 9.2142 134.4984 57.2570 31.6281 175.0586 96 D 4.4160 8.5393 126.1775 51.9296 42.2382 176.1947 97 R 3.9492 7.7043 123.1420 57.9400 29.3524 176.7074 98 D 4.9275 8.2612 117.9583 54.2913 41.2721 176.2031 99 M 4.3974 8.2100 125.4088 55.6551 32.9675 175.1257 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 1 I 8.02 4.17 1.89 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 1.43 1.15 0.92 0.00 0.00 2 Q 8.80 4.82 0.00 2.06 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.57 6.67 0.00 0.00 0.00 0.00 0.00 2.31 2.50 0.00 3 R 9.25 4.74 0.00 1.78 2.04 0.00 3.17 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 1.58 1.58 0.00 4 T 8.92 5.02 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 1.25 0.00 0.00 5 P 0.00 4.89 0.00 1.93 1.63 0.00 3.74 0.00 0.00 3.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.74 0.00 6 K 9.26 4.54 0.00 1.75 1.82 0.00 1.67 0.00 0.00 1.70 0.00 0.00 2.85 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.48 1.48 7.81 7 I 8.23 5.25 1.91 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 1.31 0.59 0.95 0.00 0.00 8 Q 9.22 4.74 0.00 2.29 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.77 0.00 0.00 0.00 0.00 0.00 2.37 2.43 0.00 9 V 8.56 5.07 2.32 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 0.96 0.00 0.00 1.10 0.00 0.00 10 Y 8.36 5.25 0.00 3.22 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 11 S 8.92 5.04 0.00 4.28 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 12 R 8.79 4.11 0.00 1.80 2.14 0.00 2.93 0.00 0.00 2.94 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 1.44 0.00 13 H 8.28 5.13 0.00 3.25 3.21 0.00 5.76 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 14 P 0.00 4.39 0.00 2.11 2.07 0.00 3.77 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.17 0.00 15 A 8.79 4.19 1.64 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 16 E 8.52 4.52 0.00 1.98 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 2.31 2.33 0.00 17 N 8.75 4.30 0.00 2.73 2.84 0.00 0.00 7.24 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 18 G 9.33 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 0.00 0.00 0.00 19 K 7.94 4.45 0.00 1.72 1.76 0.00 1.63 0.00 0.00 1.56 0.00 0.00 2.87 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.28 1.30 7.81 20 S 8.39 4.11 0.00 3.77 3.67 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 21 N 8.91 5.00 0.00 2.50 2.37 0.00 0.00 6.66 7.90 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 22 F 10.02 5.22 0.00 2.88 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 23 L 8.86 4.03 0.00 0.27 0.82 -0.24 -0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 24 N 8.94 5.37 0.00 1.44 2.04 0.00 0.00 5.98 5.12 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 25 C 9.27 5.24 0.00 2.91 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 26 Y 9.53 5.41 0.00 3.39 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 27 V 8.59 4.97 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 0.55 0.00 0.00 1.15 0.00 0.00 28 S 8.11 5.21 0.00 3.87 3.47 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.81 4.56 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 0.00 0.00 0.00 30 F 7.40 5.32 0.00 3.13 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 31 H 8.98 5.24 0.00 3.28 3.22 0.00 5.59 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 32 P 0.00 4.85 0.00 2.14 2.17 0.00 3.93 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.99 0.00 33 S 8.42 4.02 0.00 3.31 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 34 D 7.86 4.42 0.00 2.65 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 35 I 7.92 4.52 1.61 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.49 0.83 0.00 0.00 36 E 9.06 4.55 0.00 1.97 1.68 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 2.11 2.15 0.00 37 V 8.05 4.61 0.67 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 0.30 0.00 0.00 0.38 0.00 0.00 38 D 8.99 4.93 0.00 2.49 2.44 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 39 L 8.40 4.97 0.00 1.56 1.52 0.84 0.50 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 40 L 9.35 5.26 0.00 1.54 1.53 0.92 0.60 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 41 K 9.08 4.32 0.00 1.88 1.66 0.00 2.00 0.00 0.00 1.70 0.00 0.00 2.85 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.17 0.93 7.81 42 N 9.36 4.27 0.00 2.82 2.80 0.00 0.00 7.07 8.14 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 43 G 8.12 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 44 E 7.66 4.56 0.00 2.19 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 2.23 2.20 0.00 45 R 8.49 4.31 0.00 1.76 1.85 0.00 3.22 0.00 0.00 3.21 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.65 0.00 46 I 8.57 3.97 1.95 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.83 0.92 0.00 0.00 47 E 8.71 3.90 0.00 1.93 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 2.29 2.33 0.00 48 K 7.75 4.22 0.00 1.78 1.77 0.00 1.76 0.00 0.00 1.63 0.00 0.00 2.92 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.44 1.36 7.81 49 V 7.95 4.39 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 0.85 0.00 0.00 0.95 0.00 0.00 50 E 8.32 4.71 0.00 1.16 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 2.09 2.02 0.00 51 H 8.07 5.83 0.00 2.23 1.84 0.00 5.13 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 S 8.60 4.56 0.00 3.99 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 53 D 8.44 4.56 0.00 2.69 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 54 L 8.45 4.01 0.00 1.63 1.62 0.80 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 55 S 8.18 4.73 0.00 3.82 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 56 F 7.46 5.24 0.00 2.85 2.46 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 57 S 9.02 4.70 0.00 4.12 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 58 K 8.41 3.64 0.00 1.62 1.69 0.00 1.64 0.00 0.00 1.68 0.00 0.00 2.99 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.30 1.33 7.81 59 D 7.85 4.48 0.00 2.77 2.72 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 60 W 7.69 3.67 0.00 3.33 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 61 S 8.02 4.34 0.00 3.96 3.99 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 0.00 0.00 0.00 62 F 8.50 5.06 0.00 1.72 2.54 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 0.00 0.00 0.00 0.00 63 Y 8.23 5.31 0.00 2.94 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 64 L 9.51 5.21 0.00 1.97 1.75 1.22 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 65 L 9.09 5.55 0.00 2.11 1.73 1.20 0.65 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 66 Y 9.36 5.16 0.00 2.98 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 67 Y 8.39 5.80 0.00 3.01 3.15 0.00 0.00 0.00 0.00 0.00 0.00 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 8.26 5.01 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 1.07 0.00 0.00 69 E 8.84 4.10 0.00 1.46 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 2.19 2.22 0.00 70 F 8.66 4.68 0.00 2.77 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 71 T 7.91 4.55 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 1.15 0.00 0.00 72 P 0.00 4.63 0.00 2.09 2.30 0.00 3.39 0.00 0.00 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.61 0.00 73 T 8.29 4.85 4.30 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 1.38 0.00 0.00 74 E 8.88 4.14 0.00 1.96 2.04 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 2.30 2.40 0.00 75 K 8.12 4.18 0.00 1.80 1.84 0.00 1.84 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.42 1.47 7.81 76 D 7.82 4.49 0.00 2.78 2.37 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.96 4.89 0.00 2.04 2.04 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 2.38 2.24 0.00 78 Y 8.36 5.42 0.00 3.29 2.82 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 79 A 8.39 4.89 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 80 C 9.31 5.26 0.00 2.93 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 81 R 9.31 4.98 0.00 1.84 1.70 0.00 3.05 0.00 0.00 3.07 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.50 0.00 82 V 8.98 4.79 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 0.70 0.00 0.00 0.80 0.00 0.00 83 N 9.12 5.28 0.00 2.70 2.52 0.00 0.00 6.31 7.44 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 84 H 8.48 5.18 0.00 3.05 3.01 0.00 5.73 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 85 V 8.08 3.61 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 0.72 0.00 0.00 0.91 0.00 0.00 86 T 8.07 4.18 4.32 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 1.33 0.00 0.00 87 L 7.63 4.95 0.00 1.76 1.81 0.92 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 88 S 8.70 4.30 0.00 3.98 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 89 Q 7.58 4.53 0.00 1.94 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.92 0.00 0.00 0.00 0.00 0.00 2.22 2.42 0.00 90 P 0.00 4.45 0.00 1.95 1.95 0.00 3.70 0.00 0.00 3.57 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 91 K 9.27 4.51 0.00 1.76 1.63 0.00 1.58 0.00 0.00 1.65 0.00 0.00 2.84 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.36 1.40 7.81 92 I 8.33 4.96 1.88 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 1.22 1.03 0.93 0.00 0.00 93 V 8.67 4.43 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 0.92 0.00 0.00 0.96 0.00 0.00 94 K 8.81 4.76 0.00 1.74 1.80 0.00 1.82 0.00 0.00 1.66 0.00 0.00 2.75 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.49 1.48 7.81 95 W 9.21 4.62 0.00 3.26 3.45 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 96 D 8.54 4.42 0.00 2.61 2.43 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 97 R 7.70 3.95 0.00 1.89 1.33 0.00 2.95 0.00 0.00 3.17 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 1.50 0.00 98 D 8.26 4.93 0.00 2.75 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 99 M 8.21 4.40 0.00 1.99 2.03 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.58 0.00