NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 I 4.2140 8.0249 118.5519 60.1821 37.3863 174.8461 2 Q 4.9782 8.0374 119.5917 54.3926 32.6288 174.4798 3 R 5.0322 9.3374 120.4142 54.8614 35.4031 173.9262 4 T 5.2944 8.2995 109.9312 58.2352 71.6844 172.1488 5 P 4.4865 0.0000 0.0000 62.7972 32.2704 175.7409 6 K 4.4500 8.8728 125.2577 55.6981 33.7013 175.3260 7 I 5.1219 8.3477 126.9654 59.8522 40.1530 174.9966 8 Q 4.7840 8.9124 123.0996 54.4964 33.5507 173.9540 9 V 5.1177 8.6883 122.7673 61.3677 33.9856 173.9597 10 Y 5.3304 8.6111 124.9989 55.9955 41.5784 173.9398 11 S 4.7088 8.9165 115.6297 57.8064 64.2361 174.1069 12 R 4.2340 10.0879 124.1630 59.3603 30.3075 176.1449 13 H 5.0805 10.0458 114.1055 52.7138 31.9301 171.9084 14 P 4.3734 0.0000 0.0000 62.7656 31.5936 176.4641 15 A 4.6037 8.5240 124.5266 50.4843 19.9402 175.7693 16 E 4.3519 8.5365 122.4620 55.7723 30.4200 176.2507 17 N 4.3089 8.7849 120.8529 55.3914 38.9909 174.0833 18 G 4.0661 8.4038 111.1562 45.4158 0.0000 174.3186 19 K 4.0616 7.8200 119.3529 55.8438 32.5606 176.8817 20 S 4.1240 8.3095 118.2321 59.0002 63.3051 172.2121 21 N 4.7949 8.0716 121.9635 53.1826 42.9643 172.4074 22 F 5.1032 8.8578 118.4651 55.4264 42.6079 174.2658 23 L 4.2229 8.2458 125.1339 53.3695 43.4992 174.7844 24 N 5.2596 9.8253 123.1427 51.4588 42.2705 172.9808 25 C 5.1734 9.3211 122.7125 54.9599 40.2260 172.1965 26 Y 5.0073 9.1024 129.2188 56.9788 39.3792 173.8682 27 V 5.4149 8.4327 127.7510 60.5966 33.7840 174.8597 28 S 5.0246 8.7610 121.6519 57.6218 66.0482 174.0958 29 G 3.9045 8.6823 112.8212 45.0593 0.0000 173.2727 30 F 5.3241 8.2268 115.5751 55.8433 40.6428 174.2223 31 Y 5.2362 8.8903 121.4188 55.2378 42.2723 171.7937 32 P 4.2326 0.0000 0.0000 62.2909 32.8521 178.1057 33 S 4.4966 8.4255 108.8813 57.2687 65.0403 174.2040 34 D 4.3655 7.9076 121.7714 54.8717 40.9959 175.3636 35 I 4.4058 7.8155 120.9313 60.1350 41.1059 172.8713 36 E 4.7625 8.9560 128.6036 54.5322 32.3582 175.2024 37 V 4.5417 8.0682 122.9178 61.2142 34.3915 174.0365 38 D 4.8433 8.9178 126.8142 52.4406 45.2035 174.8608 39 L 4.9239 8.2768 120.9060 53.9809 43.9759 175.5449 40 L 5.8671 9.1321 121.2554 51.9303 45.7908 175.2961 41 K 4.3122 8.5809 124.3406 55.1656 34.2516 176.0100 42 N 4.1758 10.1324 128.1568 54.6768 36.7315 175.0286 43 G 4.0882 8.3685 107.4000 45.5968 0.0000 174.4899 44 E 4.2450 8.3431 120.0592 54.7579 30.4463 175.5804 45 R 4.2249 8.6416 122.6437 56.9368 30.1969 176.1023 46 I 4.0457 8.5083 127.0517 61.4083 37.9315 175.6412 47 E 4.4228 8.6480 122.7672 58.1059 30.8252 177.6371 48 K 4.2435 7.7206 118.6861 55.2590 30.1759 174.1528 49 V 4.3754 7.6325 119.4719 60.9396 33.9951 174.7239 50 E 4.4782 7.9564 127.6340 55.4337 31.9950 174.6736 51 H 4.9727 7.8668 112.0030 55.1272 30.1502 174.5813 52 S 4.5311 9.2022 117.6285 57.8184 64.0006 173.8807 53 D 4.5033 8.5103 120.5149 53.9367 41.2552 176.3463 54 L 4.1974 8.1615 123.7641 55.9400 43.1009 176.3256 55 S 4.5168 8.3566 118.6971 57.0169 67.8588 172.9421 56 F 4.3020 8.5669 126.1124 56.4451 40.1359 175.3610 57 S 4.6469 8.4945 121.9263 56.9872 63.0483 174.2897 58 K 3.9568 8.5612 121.9543 59.6245 31.7308 181.8523 59 D 4.0082 7.7351 117.6878 53.8683 38.2927 177.1986 60 W 4.8152 8.5378 114.6176 58.2044 26.5755 174.0144 61 S 4.5003 5.8100 116.3566 57.7693 64.9191 176.6419 62 F 5.2311 7.8852 120.3436 55.8424 41.3824 174.2109 63 Y 5.4092 7.6229 116.6628 56.2202 40.9636 173.3211 64 L 5.0342 8.9817 120.4367 54.7834 45.0402 173.7842 65 L 5.1948 9.1755 121.0392 53.6175 44.6884 174.6317 66 Y 5.3778 8.6141 123.2859 56.8780 41.7256 174.1784 67 Y 5.3852 7.6886 118.4406 58.1331 42.1759 172.3245 68 T 4.4590 8.0414 110.9897 61.3562 70.5095 171.4953 69 E 4.5072 8.9511 125.4917 56.1480 30.3231 175.5556 70 F 4.9345 8.6103 116.0100 56.3153 41.9524 173.0047 71 T 4.3564 8.1771 115.6593 60.8957 70.9276 172.4291 72 P 4.8093 0.0000 0.0000 62.9730 33.1612 175.7565 73 T 4.3562 8.7304 106.7173 61.6956 70.9553 173.8862 74 E 3.9481 9.3296 126.8426 59.1531 30.0763 178.6666 75 K 3.4456 8.1689 111.9433 60.8248 31.8471 176.8851 76 D 4.6799 7.8282 122.4039 54.2866 42.4989 175.7015 77 E 4.7992 10.7800 120.6165 55.0529 31.6991 174.5395 78 Y 5.3610 9.0669 121.5629 56.7921 41.3646 174.3621 79 A 5.1196 9.0127 122.7906 51.4061 23.9842 174.1154 80 C 5.1323 9.4338 118.8379 55.0485 46.5237 172.7021 81 R 4.9622 9.0288 128.2604 55.0079 31.3440 174.7446 82 V 4.6554 8.5485 127.2031 61.0895 34.0816 173.8302 83 N 5.2663 9.1142 125.7843 52.2524 42.1462 172.3836 84 H 5.0951 8.3390 123.1151 55.1027 33.1020 174.4965 85 V 3.8008 8.2067 122.3211 63.5429 31.5922 176.8567 86 T 4.2257 7.6487 110.3908 62.1866 69.4272 173.7269 87 L 4.7209 7.4573 123.4542 52.8504 43.3511 176.8048 88 S 4.2894 8.7355 118.5809 61.0208 63.2572 174.1389 89 Q 4.5716 7.5890 115.5757 53.3709 31.1897 171.9370 90 P 4.4185 0.0000 0.0000 63.3996 32.1735 175.4454 91 K 4.5185 8.9756 124.5436 54.9977 34.1756 174.8828 92 I 4.9023 8.3321 127.6277 59.5527 39.4862 175.0224 93 V 4.4251 8.7654 126.5850 60.9357 34.4378 173.8331 94 K 4.8691 8.6801 129.1110 54.3561 33.4421 175.7828 95 W 4.6786 8.9209 135.0000 58.1645 31.5493 174.8650 96 D 4.2306 8.2441 123.4799 52.9381 43.7844 175.2376 97 R 4.0599 7.9818 121.6905 56.1746 29.5334 175.5648 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 4.21 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 1.41 1.21 0.91 0.00 0.00 2 Q 8.04 4.98 0.00 2.07 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.65 6.77 0.00 0.00 0.00 0.00 0.00 2.47 2.56 0.00 3 R 9.34 5.03 0.00 2.08 1.87 0.00 3.16 0.00 0.00 3.33 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.74 0.00 4 T 8.30 5.29 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 1.29 0.00 0.00 5 P 0.00 4.49 0.00 1.87 1.81 0.00 3.66 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 1.85 1.62 0.00 6 K 8.87 4.45 0.00 1.90 1.86 0.00 1.66 0.00 0.00 1.70 0.00 0.00 2.87 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.46 1.49 7.81 7 I 8.35 5.12 1.91 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 1.32 0.77 0.95 0.00 0.00 8 Q 8.91 4.78 0.00 2.32 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.76 0.00 0.00 0.00 0.00 0.00 2.38 2.44 0.00 9 V 8.69 5.12 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 0.94 0.00 0.00 1.09 0.00 0.00 10 Y 8.61 5.33 0.00 3.13 3.06 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 11 S 8.92 4.71 0.00 4.49 4.05 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 12 R 10.09 4.23 0.00 1.82 2.49 0.00 3.30 0.00 0.00 3.16 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.62 0.00 13 H 10.05 5.08 0.00 3.18 3.26 0.00 5.91 0.00 0.00 0.00 0.00 6.84 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 4.37 0.00 2.11 2.06 0.00 3.74 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.15 0.00 15 A 8.52 4.60 1.50 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 0.00 0.00 0.00 16 E 8.54 4.35 0.00 2.08 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 2.38 2.40 0.00 17 N 8.78 4.31 0.00 2.71 2.96 0.00 0.00 7.41 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 8.40 4.07 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 0.00 0.00 0.00 0.00 0.00 0.00 19 K 7.82 4.06 0.00 1.78 1.72 0.00 1.72 0.00 0.00 1.61 0.00 0.00 2.77 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.46 1.88 7.81 20 S 8.31 4.12 0.00 3.79 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 8.07 4.79 0.00 2.64 2.60 0.00 0.00 6.98 7.59 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 22 F 8.86 5.10 0.00 3.07 2.96 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 23 L 8.25 4.22 0.00 0.27 0.39 -0.27 -0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 24 N 9.83 5.26 0.00 1.44 2.09 0.00 0.00 6.00 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 25 C 9.32 5.17 0.00 2.85 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 9.10 5.01 0.00 3.45 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 27 V 8.43 5.41 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 0.85 0.00 0.00 0.96 0.00 0.00 28 S 8.76 5.02 0.00 3.70 3.31 0.00 0.00 0.00 0.00 0.00 0.00 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 8.68 3.90 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 0.00 0.00 0.00 30 F 8.23 5.32 0.00 2.86 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 31 Y 8.89 5.24 0.00 3.36 2.96 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 32 P 0.00 4.23 0.00 1.82 1.36 0.00 3.80 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.91 0.00 33 S 8.43 4.50 0.00 2.72 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 34 D 7.91 4.37 0.00 2.65 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 35 I 7.82 4.41 1.47 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.43 0.94 0.00 0.00 36 E 8.96 4.76 0.00 1.85 1.73 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 2.18 2.17 0.00 37 V 8.07 4.54 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 -0.42 0.00 0.00 0.65 0.00 0.00 38 D 8.92 4.84 0.00 2.57 2.41 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 39 L 8.28 4.92 0.00 1.54 1.50 0.84 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 40 L 9.13 5.87 0.00 1.51 1.50 0.91 0.95 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 41 K 8.58 4.31 0.00 1.82 1.63 0.00 1.51 0.00 0.00 1.89 0.00 0.00 2.83 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.30 1.09 7.81 42 N 10.13 4.18 0.00 2.67 2.83 0.00 0.00 7.32 7.53 0.00 0.00 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 8.37 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 44 E 8.34 4.24 0.00 2.13 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 2.28 2.22 0.00 45 R 8.64 4.22 0.00 1.74 1.88 0.00 3.22 0.00 0.00 3.20 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.65 0.00 46 I 8.51 4.05 1.86 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 1.30 0.66 0.92 0.00 0.00 47 E 8.65 4.42 0.00 1.94 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 2.22 2.30 0.00 48 K 7.72 4.24 0.00 1.74 1.76 0.00 1.69 0.00 0.00 1.63 0.00 0.00 2.98 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.44 1.42 7.81 49 V 7.63 4.38 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 0.90 0.00 0.00 0.91 0.00 0.00 50 E 7.96 4.48 0.00 1.16 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.12 0.00 51 H 7.87 4.97 0.00 2.52 3.05 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 52 S 9.20 4.53 0.00 3.92 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 53 D 8.51 4.50 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 54 L 8.16 4.20 0.00 1.64 1.60 0.96 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 55 S 8.36 4.52 0.00 2.72 3.17 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 56 F 8.57 4.30 0.00 2.85 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 57 S 8.49 4.65 0.00 3.91 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 58 K 8.56 3.96 0.00 1.68 1.59 0.00 1.63 0.00 0.00 1.80 0.00 0.00 2.89 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.45 1.39 7.81 59 D 7.74 4.01 0.00 2.66 2.60 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 60 W 8.54 4.82 0.00 3.69 3.42 0.00 0.00 0.00 0.00 0.00 0.00 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 5.81 4.50 0.00 3.75 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 62 F 7.89 5.23 0.00 1.51 2.29 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 63 Y 7.62 5.41 0.00 2.68 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 64 L 8.98 5.03 0.00 1.66 1.75 0.79 0.52 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 65 L 9.18 5.19 0.00 2.00 1.64 1.18 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 66 Y 8.61 5.38 0.00 2.89 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 67 Y 7.69 5.39 0.00 3.21 3.06 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 68 T 8.04 4.46 4.15 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 1.00 0.00 0.00 69 E 8.95 4.51 0.00 1.77 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 2.25 2.26 0.00 70 F 8.61 4.93 0.00 2.95 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 71 T 8.18 4.36 4.17 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 1.16 0.00 0.00 72 P 0.00 4.81 0.00 2.07 2.22 0.00 3.39 0.00 0.00 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.96 0.00 73 T 8.73 4.36 4.31 0.00 0.00 0.00 0.00 0.00 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 74 E 9.33 3.95 0.00 1.99 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 2.37 2.36 0.00 75 K 8.17 3.45 0.00 1.75 1.69 0.00 1.76 0.00 0.00 1.71 0.00 0.00 3.07 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.47 1.46 7.81 76 D 7.83 4.68 0.00 2.46 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 77 E 10.78 4.80 0.00 2.07 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 2.36 2.24 0.00 78 Y 9.07 5.36 0.00 3.08 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 79 A 9.01 5.12 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 9.43 5.13 0.00 2.91 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 9.03 4.96 0.00 1.85 1.72 0.00 3.05 0.00 0.00 3.05 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.52 0.00 82 V 8.55 4.66 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 0.77 0.00 0.00 0.81 0.00 0.00 83 N 9.11 5.27 0.00 2.69 2.53 0.00 0.00 6.40 7.88 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 84 H 8.34 5.10 0.00 3.03 2.98 0.00 5.92 0.00 0.00 0.00 0.00 6.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 V 8.21 3.80 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 0.67 0.00 0.00 0.90 0.00 0.00 86 T 7.65 4.23 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 87 L 7.46 4.72 0.00 1.81 1.78 0.89 0.90 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 8.74 4.29 0.00 3.97 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 7.59 4.57 0.00 2.12 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.51 6.89 0.00 0.00 0.00 0.00 0.00 2.22 2.37 0.00 90 P 0.00 4.42 0.00 1.93 2.02 0.00 3.64 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.08 0.00 91 K 8.98 4.52 0.00 1.79 1.63 0.00 1.59 0.00 0.00 1.64 0.00 0.00 2.86 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.36 1.40 7.81 92 I 8.33 4.90 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 1.23 0.77 0.92 0.00 0.00 93 V 8.77 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 1.04 0.00 0.00 0.96 0.00 0.00 94 K 8.68 4.87 0.00 1.85 1.73 0.00 1.86 0.00 0.00 1.66 0.00 0.00 2.81 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.42 1.51 7.81 95 W 8.92 4.68 0.00 3.34 3.37 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 96 D 8.24 4.23 0.00 2.55 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 7.98 4.06 0.00 1.75 1.57 0.00 2.92 0.00 0.00 3.10 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.98 0.00