NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.6447 8.2516 119.7230 55.7734 31.8319 173.4546 2 S 4.3910 7.9848 116.5999 57.9543 64.8992 172.7916 3 D 4.8579 8.8533 120.2899 55.2803 44.6365 176.1934 4 Q 4.4061 8.0715 113.3782 55.5038 30.6867 175.9617 5 E 4.5740 8.8773 121.3069 56.4872 31.3813 175.7582 6 A 4.7679 7.6577 119.4116 50.1868 22.5685 175.7386 7 K 4.4434 8.5000 119.7904 54.8057 33.7332 176.6070 8 P 4.6449 0.0000 0.0000 62.0531 30.4654 175.4719 9 S 4.6465 7.4520 112.0283 59.0480 64.7412 175.4845 10 T 3.9700 7.9401 115.4246 66.4888 68.3673 174.6050 11 E 4.5223 8.0485 119.3986 56.1904 29.5628 175.2008 12 D 4.6128 7.9079 116.4353 55.3677 43.0214 176.0231 13 L 4.3814 8.1490 117.8312 54.7022 42.2076 174.3298 14 G 3.5792 8.0177 105.8119 45.3940 0.0000 174.2392 15 D 4.6615 7.6862 118.4331 54.4229 43.1077 178.3527 16 K 3.9062 8.3702 119.1759 57.0508 31.8605 177.0923 17 K 4.1431 9.1517 123.8224 56.8810 34.0431 176.7106 18 E 4.3950 9.1689 117.6239 55.5585 30.7848 179.0351 19 G 3.8337 8.0425 121.7151 47.2345 0.0000 173.9433 20 E 4.5255 8.6333 118.8669 54.3487 33.4564 175.0236 21 Y 4.8670 7.4337 120.0148 57.0117 40.3767 174.6056 22 I 4.7071 8.3640 113.4962 59.8256 40.9156 174.4197 23 K 5.6677 8.5521 125.0715 54.2761 34.7767 174.6519 24 L 5.2326 8.6314 125.7912 53.1100 45.3628 175.7561 25 K 5.0292 9.3999 122.2323 55.1764 33.4007 175.8303 26 V 4.5114 9.1731 127.0074 60.6668 33.3589 175.1744 27 I 4.5208 9.0241 127.5469 59.7515 38.5457 175.7527 28 G 4.5841 9.0150 115.2314 44.2255 0.0000 174.4228 29 Q 4.1147 8.5927 118.6236 57.9903 28.7576 177.0592 30 D 4.5877 8.1299 117.0628 53.9255 41.0053 177.6754 31 S 4.0721 8.2204 113.1095 58.1875 62.3376 170.0810 32 S 4.3039 7.7308 116.2976 59.7102 63.5431 172.9021 33 E 5.9098 8.8146 124.3004 54.0773 31.5461 175.4451 34 I 4.5908 8.6416 124.7953 59.7664 41.0101 174.1845 35 H 5.5174 8.6761 122.8563 54.7021 30.1026 174.3030 36 F 4.7332 9.3719 122.8756 55.6963 41.5551 175.1796 37 K 5.0386 8.9494 123.9451 55.4776 31.9462 176.1730 38 V 4.4883 8.6548 118.5818 58.9691 35.1671 175.7547 39 K 4.3902 8.2528 121.2923 56.3866 33.0033 178.0469 40 M 3.9509 8.8752 122.6813 58.3847 32.0911 178.1235 41 T 5.2159 7.4605 106.7097 60.5186 69.2206 174.0233 42 T 4.2657 7.8455 118.9447 63.5068 69.9424 174.3116 43 H 4.1809 8.9086 122.6936 56.5299 29.0445 176.1099 44 L 4.1425 9.1479 125.2771 56.0421 41.3282 179.1622 45 K 3.7891 7.7247 121.0900 59.3148 32.1309 178.5754 46 K 3.9683 7.8653 118.6163 59.3953 32.0413 178.7739 47 L 3.5639 7.7457 119.9039 58.0736 41.8811 179.0991 48 K 2.0000 7.3424 117.9467 58.7520 31.7704 179.2930 49 E 3.9343 8.5210 119.2303 59.2006 29.4565 179.1600 50 S 4.2251 8.5709 113.5713 61.7278 62.6091 175.3643 51 Y 4.2382 7.9199 121.4257 61.2281 38.5026 178.0394 52 C 4.4220 8.6363 117.2218 62.9072 28.5080 175.8119 53 Q 4.0515 8.8457 122.1657 59.4247 28.4880 178.7431 54 R 4.0353 7.7232 114.8968 58.5754 29.7463 177.3858 55 Q 4.2216 7.7500 117.5772 55.1319 29.7126 174.8052 56 G 3.7233 7.9261 105.4123 47.7676 0.0000 173.9541 57 V 4.5034 8.3045 117.9326 59.7850 34.6042 172.8833 58 P 4.5767 0.0000 0.0000 62.2024 32.4137 177.0327 59 M 4.0765 8.7236 121.3766 58.1513 32.2316 177.0769 60 N 4.5707 8.1739 114.6286 54.0102 38.4644 175.6782 61 S 4.4219 8.2844 113.9054 58.4897 63.9408 173.0123 62 L 5.3811 7.7571 120.3358 53.5065 45.0586 175.5454 63 R 4.9128 9.4827 122.2167 54.4847 32.4724 174.2444 64 F 5.1435 9.0787 120.7646 55.8778 41.5775 174.6408 65 L 5.2822 9.1131 122.6143 53.1708 46.5710 175.6867 66 F 5.2176 9.2366 124.9572 56.0948 40.2185 175.3999 67 E 3.7416 9.8956 127.1815 57.3234 26.6669 175.9841 68 G 3.8408 8.6895 104.9751 45.3878 0.0000 173.6976 69 Q 4.2817 7.8265 121.8489 53.8225 29.3848 174.4908 70 R 4.2551 8.6265 126.6087 56.9830 30.5835 175.8670 71 I 4.1626 8.7205 128.5526 61.1940 37.9648 176.0884 72 A 4.5187 8.5649 128.2903 50.4844 21.0471 177.6159 73 D 4.1919 8.7341 118.4407 57.1458 41.4129 177.2885 74 N 4.4302 7.9258 113.3569 52.6401 37.8180 173.8466 75 H 5.7333 7.9162 115.7317 54.5602 30.5824 174.3213 76 T 5.0714 8.3528 113.9059 57.4040 73.1734 173.0670 77 P 4.0600 0.0000 0.0000 66.0646 31.0352 178.2807 78 K 3.8215 8.1409 119.1509 59.4811 32.0345 178.6712 79 E 4.0889 8.0349 118.2187 59.2086 29.3301 178.7196 80 L 4.1682 7.7894 117.2890 55.4099 41.8673 177.6923 81 G 3.8107 7.6327 105.5698 46.0727 0.0000 173.2829 82 M 4.2785 7.8029 118.9897 53.4043 33.8390 174.5761 83 E 4.6012 9.5301 118.5453 54.8965 33.3659 174.6640 84 E 3.8974 8.6005 119.5993 58.6319 29.9148 177.1740 85 E 3.9023 9.4666 124.1145 56.9969 27.6397 174.3505 86 D 4.9113 7.6487 119.2919 54.1329 42.1295 175.3780 87 V 4.9610 8.5347 119.0007 60.1732 34.5181 174.5936 88 I 5.1902 9.2096 124.0908 59.9211 40.8029 174.2799 89 E 4.5608 9.3835 126.6311 54.7087 31.9948 174.9605 90 V 4.0467 7.5496 122.9393 61.3969 32.9427 174.5281 91 Y 4.9403 8.6115 124.4113 56.0796 42.9206 173.8411 92 Q 4.5968 8.6663 122.0166 56.0695 29.4069 175.2147 93 E 4.1759 9.3497 127.7061 59.4586 29.7250 176.5282 94 Q 4.6261 7.2868 116.5544 54.7116 32.5033 174.6666 95 T 3.8852 8.8398 114.3600 62.8394 67.8743 175.1002 96 G 4.2124 8.6338 115.9290 45.7945 0.0000 173.6781 97 G 3.7350 8.4038 107.7150 45.4857 0.0000 172.9323 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 M 8.25 4.64 0.00 2.03 2.13 0.00 0.00 0.00 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.50 0.00 2 S 7.98 4.39 0.00 3.90 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 3 D 8.85 4.86 0.00 2.67 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 4 Q 8.07 4.41 0.00 2.06 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.18 7.05 0.00 0.00 0.00 0.00 0.00 2.33 2.33 0.00 5 E 8.88 4.57 0.00 1.92 1.92 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 2.20 2.21 0.00 6 A 7.66 4.77 1.21 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 0.00 0.00 0.00 7 K 8.50 4.44 0.00 1.73 1.75 0.00 1.63 0.00 0.00 1.83 0.00 0.00 3.00 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.39 1.48 7.81 8 P 0.00 4.64 0.00 2.17 2.08 0.00 3.70 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 2.04 0.00 9 S 7.45 4.65 0.00 3.83 3.82 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 10 T 7.94 3.97 4.23 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 1.20 0.00 0.00 11 E 8.05 4.52 0.00 1.94 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 2.26 2.28 0.00 12 D 7.91 4.61 0.00 2.57 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 13 L 8.15 4.38 0.00 1.76 1.63 0.88 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 14 G 8.02 3.58 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 15 D 7.69 4.66 0.00 2.62 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 16 K 8.37 3.91 0.00 1.51 1.54 0.00 1.68 0.00 0.00 1.55 0.00 0.00 2.94 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.39 1.33 7.81 17 K 9.15 4.14 0.00 1.80 1.73 0.00 1.82 0.00 0.00 1.83 0.00 0.00 3.26 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.38 1.44 7.81 18 E 9.17 4.40 0.00 2.17 2.03 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 2.43 2.60 0.00 19 G 8.04 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 E 8.63 4.53 0.00 1.80 1.70 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 2.03 2.15 0.00 21 Y 7.43 4.87 0.00 3.02 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 22 I 8.36 4.71 1.96 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 1.13 0.99 0.94 0.00 0.00 23 K 8.55 5.67 0.00 1.87 1.71 0.00 1.83 0.00 0.00 1.76 0.00 0.00 2.69 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.68 1.30 7.81 24 L 8.63 5.23 0.00 1.66 1.59 0.92 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 25 K 9.40 5.03 0.00 1.85 1.83 0.00 1.81 0.00 0.00 1.82 0.00 0.00 2.95 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.39 1.54 7.81 26 V 9.17 4.51 2.24 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 1.57 0.00 0.00 0.94 0.00 0.00 27 I 9.02 4.52 1.68 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 1.29 0.94 0.84 0.00 0.00 28 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 29 Q 8.59 4.11 0.00 2.05 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 7.14 0.00 0.00 0.00 0.00 0.00 2.30 2.31 0.00 30 D 8.13 4.59 0.00 2.84 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 31 S 8.22 4.07 0.00 4.02 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 32 S 7.73 4.30 0.00 3.98 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 33 E 8.81 5.91 0.00 1.88 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 2.24 2.37 0.00 34 I 8.64 4.59 2.33 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.61 0.51 0.00 0.00 35 H 8.68 5.52 0.00 3.00 3.26 0.00 5.67 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 F 9.37 4.73 0.00 3.00 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 37 K 8.95 5.04 0.00 1.77 2.08 0.00 2.04 0.00 0.00 1.86 0.00 0.00 3.00 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.47 1.47 7.81 38 V 8.65 4.49 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 0.75 0.00 0.00 0.94 0.00 0.00 39 K 8.25 4.39 0.00 1.52 1.66 0.00 1.74 0.00 0.00 1.93 0.00 0.00 2.97 0.00 0.00 3.27 0.00 0.00 0.00 0.00 1.13 1.27 7.81 40 M 8.88 3.95 0.00 2.03 2.16 0.00 0.00 0.00 0.00 0.00 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.54 0.00 41 T 7.46 5.22 4.23 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 1.20 0.00 0.00 42 T 7.85 4.27 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 1.18 0.00 0.00 43 H 8.91 4.18 0.00 3.14 3.34 0.00 5.64 0.00 0.00 0.00 0.00 6.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 L 9.15 4.14 0.00 1.98 1.64 0.90 0.48 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 45 K 7.72 3.79 0.00 1.90 1.78 0.00 1.44 0.00 0.00 1.61 0.00 0.00 2.95 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.50 1.56 7.81 46 K 7.87 3.97 0.00 1.85 1.82 0.00 1.70 0.00 0.00 1.50 0.00 0.00 2.86 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.63 1.56 7.81 47 L 7.75 3.56 0.00 1.48 1.56 0.74 0.18 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 48 K 7.34 2.00 0.00 1.50 0.80 0.00 1.62 0.00 0.00 1.48 0.00 0.00 2.90 0.00 0.00 3.13 0.00 0.00 0.00 0.00 0.71 1.32 7.81 49 E 8.52 3.93 0.00 2.03 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 2.43 0.00 50 S 8.57 4.23 0.00 4.10 4.37 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 51 Y 7.92 4.24 0.00 3.40 3.48 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 52 C 8.64 4.42 0.00 3.17 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 53 Q 8.85 4.05 0.00 2.07 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.84 0.00 0.00 0.00 0.00 0.00 2.37 2.54 0.00 54 R 7.72 4.04 0.00 2.00 2.05 0.00 3.08 0.00 0.00 3.04 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.91 0.00 55 Q 7.75 4.22 0.00 1.83 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.78 5.95 0.00 0.00 0.00 0.00 0.00 2.22 2.23 0.00 56 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 57 V 8.30 4.50 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 1.06 0.00 0.00 1.12 0.00 0.00 58 P 0.00 4.58 0.00 2.51 2.19 0.00 3.81 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 2.11 1.98 0.00 59 M 8.72 4.08 0.00 2.06 2.13 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.48 0.00 60 N 8.17 4.57 0.00 3.09 3.07 0.00 0.00 6.14 7.66 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 61 S 8.28 4.42 0.00 3.95 4.02 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 L 7.76 5.38 0.00 1.89 1.68 0.98 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 63 R 9.48 4.91 0.00 1.94 2.06 0.00 3.04 0.00 0.00 3.34 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.70 0.00 64 F 9.08 5.14 0.00 2.87 2.92 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 65 L 9.11 5.28 0.00 1.68 1.62 1.17 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 66 F 9.24 5.22 0.00 3.05 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 67 E 9.90 3.74 0.00 1.29 1.66 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 1.76 1.47 0.00 68 G 8.69 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 0.00 0.00 0.00 69 Q 7.83 4.28 0.00 2.06 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.02 6.94 0.00 0.00 0.00 0.00 0.00 2.33 2.48 0.00 70 R 8.63 4.26 0.00 1.88 1.90 0.00 3.41 0.00 0.00 3.28 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.79 0.00 71 I 8.72 4.16 2.15 0.00 0.00 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 1.22 0.94 0.91 0.00 0.00 72 A 8.56 4.52 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 73 D 8.73 4.19 0.00 2.75 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 74 N 7.93 4.43 0.00 2.67 2.79 0.00 0.00 5.80 7.68 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 75 H 7.92 5.73 0.00 3.42 3.19 0.00 5.56 0.00 0.00 0.00 0.00 6.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 T 8.35 5.07 4.38 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 1.25 0.00 0.00 77 P 0.00 4.06 0.00 2.19 2.26 0.00 3.78 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.00 0.00 78 K 8.14 3.82 0.00 1.87 1.81 0.00 1.63 0.00 0.00 1.64 0.00 0.00 2.95 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.42 1.62 7.81 79 E 8.03 4.09 0.00 2.04 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 2.40 2.60 0.00 80 L 7.79 4.17 0.00 1.47 1.94 0.96 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 81 G 7.63 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 0.00 0.00 0.00 82 M 7.80 4.28 0.00 1.19 1.67 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 1.39 0.00 83 E 9.53 4.60 0.00 1.88 1.81 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 2.19 2.19 0.00 84 E 8.60 3.90 0.00 1.93 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 0.00 2.31 2.46 0.00 85 E 9.47 3.90 0.00 2.16 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 0.00 2.22 2.41 0.00 86 D 7.65 4.91 0.00 2.70 2.53 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 0.00 0.00 0.00 0.00 87 V 8.53 4.96 2.15 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 1.06 0.00 0.00 1.06 0.00 0.00 88 I 9.21 5.19 1.93 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 1.36 1.01 1.05 0.00 0.00 89 E 9.38 4.56 0.00 1.52 1.14 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 2.22 2.18 0.00 90 V 7.55 4.05 1.58 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 0.24 0.00 0.00 -1.01 0.00 0.00 91 Y 8.61 4.94 0.00 2.82 2.68 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 0.00 0.00 0.00 92 Q 8.67 4.60 0.00 2.08 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.69 7.13 0.00 0.00 0.00 0.00 0.00 2.50 2.76 0.00 93 E 9.35 4.18 0.00 2.00 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 2.41 2.49 0.00 94 Q 7.29 4.63 0.00 1.98 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.75 6.83 0.00 0.00 0.00 0.00 0.00 2.29 2.44 0.00 95 T 8.84 3.89 4.25 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 1.22 0.00 0.00 96 G 8.63 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 0.00 0.00 0.00 0.00 97 G 8.40 3.73 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 0.00 0.00 0.00