NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 11 K 4.4491 8.3144 120.1550 56.0162 34.3823 175.5690 12 R 4.2372 7.9012 118.2523 54.8672 31.1451 173.4065 13 Q 5.2549 9.1479 123.3901 54.3993 30.9627 175.2160 14 V 4.4968 8.2432 115.8279 59.6127 35.7764 176.1436 15 A 4.3161 8.8242 126.8140 54.5688 19.5428 177.5562 16 S 4.5955 8.0863 110.2224 58.4957 63.2702 173.7531 17 G 4.2915 8.7699 113.3066 45.4809 0.0000 170.6563 18 R 5.0794 8.5043 117.8777 55.1170 34.0804 173.7903 19 A 5.0392 8.8064 128.8721 50.5376 21.3135 174.6563 20 Y 5.0483 9.1881 121.2392 57.0778 40.2777 175.0798 21 I 4.9697 8.7304 123.7837 59.8621 41.1324 174.0782 22 H 5.1220 9.7114 126.7800 54.2595 31.3834 171.6229 23 A 4.7078 8.7613 127.2085 50.3735 18.4723 176.1329 24 S 4.6599 8.3770 119.7943 57.9708 64.7761 173.2669 25 Y 4.5001 8.7432 114.2455 58.7875 39.5816 176.2768 26 N 4.6800 8.0826 114.4476 53.1388 39.5737 173.5063 27 N 4.3563 7.5338 115.5769 54.1312 41.7366 172.4635 28 T 5.1760 7.7022 114.9251 62.4996 73.0008 173.3714 29 I 4.8261 8.7746 119.7719 59.4519 41.2154 174.8779 30 V 5.1220 9.1428 115.4761 60.3488 36.5149 174.1904 31 T 5.1875 9.2953 118.6463 60.7174 71.0492 172.8720 32 I 4.8424 9.1348 129.3948 61.1948 39.4827 174.5899 33 T 5.0637 8.6107 117.8330 60.9804 71.4962 172.9023 34 D 4.9523 8.5683 126.2960 52.2687 40.1766 175.5627 35 P 4.3993 0.0000 0.0000 65.4426 31.4205 178.1501 36 D 4.4458 7.7767 116.8543 56.7483 40.8024 177.6614 37 G 4.5084 7.7995 117.7223 46.1677 0.0000 172.5054 38 N 4.5257 7.7924 120.0343 52.0113 39.1811 173.2292 39 P 4.9840 0.0000 0.0000 63.2012 32.2162 175.8044 40 I 4.3943 8.2740 117.7758 63.1596 40.5961 176.1305 41 T 4.6301 7.4999 115.0479 62.4480 72.7991 172.5674 42 W 5.6525 7.7284 120.2479 55.5591 32.1571 173.1224 43 S 4.6276 9.2119 113.6093 58.5856 66.4557 174.3820 44 S 4.9188 7.3780 114.9522 57.4534 65.4312 176.5837 45 G 3.8473 8.6934 106.3195 48.4331 0.0000 176.2026 46 G 3.7459 8.1428 106.7206 47.0497 0.0000 175.3908 47 V 3.7693 7.0939 119.9105 66.0298 31.5920 177.9506 48 I 3.8463 7.3954 117.6842 64.3969 38.4191 175.0714 49 G 3.0137 6.0147 109.7015 44.9389 0.0000 170.6942 50 Y 5.1518 7.0691 119.9436 56.9817 43.0220 174.7992 51 K 4.6473 8.2847 118.5990 55.8969 37.3780 177.4626 52 G 4.0040 9.3903 113.8201 46.6297 0.0000 176.0211 53 S 4.1561 9.1867 121.6031 61.2797 63.2816 175.7722 54 R 3.7086 8.0329 121.7942 58.9550 29.4489 179.1268 55 K 4.2318 7.7664 118.0498 59.2722 32.2009 179.2483 56 G 3.7574 7.6570 104.2500 45.7467 0.0000 174.1181 57 T 4.0045 7.1242 119.7394 62.9809 69.1281 173.6780 58 P 4.3226 0.0000 0.0000 66.0303 31.2490 178.2810 59 Y 4.1128 8.0631 118.8779 60.4060 38.8151 177.4267 60 A 3.8901 8.0705 121.1132 55.1609 18.5049 179.2741 61 A 4.0732 8.0767 119.2690 55.0943 18.4947 179.6125 62 Q 3.8603 8.1471 118.3481 59.3926 29.0933 178.6535 63 L 3.8386 7.7716 119.7711 57.7325 41.5649 179.3619 64 A 3.9412 8.4921 120.8155 55.0576 18.3870 179.5023 65 A 3.9382 8.2831 119.5697 55.3878 18.4697 179.9399 66 L 3.9699 7.8078 117.0955 57.8278 41.7034 179.2370 67 D 4.2777 8.4962 118.3141 57.2394 40.9596 178.1647 68 A 3.9687 8.3989 121.4468 54.9111 18.2391 179.3800 69 A 4.0012 7.8398 118.9687 54.5708 18.3731 179.5365 70 K 3.7824 8.1540 117.9704 59.9790 32.0942 178.8958 71 K 4.1943 8.0641 117.8823 58.7197 32.1084 179.4385 72 A 4.0428 7.6213 121.3935 55.5327 18.4007 179.6295 73 M 4.2353 8.3971 116.7232 57.8990 31.6679 178.8787 74 A 4.0448 7.4047 119.7957 55.1963 18.8631 178.0567 75 Y 4.1192 8.2115 113.4169 58.0738 37.7522 176.0232 76 G 3.8924 7.8601 106.2467 46.7840 0.0000 173.9078 77 M 4.6159 7.6512 115.7247 54.0363 34.2912 173.5607 78 Q 4.5698 8.5362 121.3914 56.8828 34.5497 175.3292 79 S 5.5202 8.5563 119.8108 57.7716 63.1612 174.6220 80 V 4.2020 7.8834 121.4447 61.8327 33.6901 174.7707 81 D 4.7592 8.7945 124.6925 52.6537 42.1470 175.9246 82 V 4.1616 8.2121 124.8521 62.7561 33.2331 175.3292 83 I 4.9880 9.1464 128.6807 60.2885 40.9752 175.0322 84 V 4.6880 9.0930 121.3868 60.7104 33.9756 175.4900 85 R 4.7898 8.9564 119.8120 55.9964 34.8990 172.4043 86 G 4.0479 8.4646 116.1250 45.5252 0.0000 174.3654 87 T 4.2151 8.3362 119.8351 61.8282 67.6391 174.2291 88 G 3.7887 8.0523 113.6860 41.9697 0.0000 171.0122 89 A 4.5442 8.0789 122.2147 50.6635 17.4833 178.2881 90 G 3.9963 7.4926 107.2905 44.6559 0.0000 174.5687 91 R 3.7939 7.3307 120.6709 59.9880 29.8130 178.0838 92 E 3.9852 8.0082 116.5510 59.6018 29.7909 179.1473 93 Q 3.9934 7.9189 118.6880 58.6579 28.5128 178.4374 94 A 4.0355 7.8594 121.1608 54.9979 18.7344 179.6084 95 I 3.8090 7.4617 118.4420 64.6310 37.4019 178.7436 96 R 3.9136 8.6132 118.9805 59.3972 29.9442 178.9930 97 A 4.0546 8.1114 120.3090 55.1879 17.8166 179.7131 98 L 4.1351 7.6645 118.4495 57.2455 41.7108 179.7145 99 Q 3.8286 7.9220 117.4909 59.0317 28.6044 178.4451 100 A 4.1488 7.7519 119.9647 54.6249 18.5872 179.4565 101 S 4.2176 8.0847 113.3594 59.7167 63.2173 175.1192 102 G 4.0121 8.2158 109.4822 45.9626 0.0000 173.6286 103 L 4.6014 7.1980 117.1708 52.2980 45.0980 177.2296 104 Q 4.0822 8.1794 124.8894 56.1141 28.9120 174.8534 105 V 4.1669 8.2124 118.8761 61.1066 30.8180 175.4844 106 K 4.0529 8.5557 128.9918 59.4510 32.7692 176.6097 107 S 4.6479 7.2741 111.1581 57.8787 65.6835 175.7693 108 I 4.7470 8.4947 121.4796 59.7704 39.2043 175.1801 109 V 4.4872 8.7988 127.4658 60.9632 34.8170 173.6595 110 D 5.2996 8.5751 123.8749 51.9536 43.5441 174.9919 111 D 5.0115 8.9111 128.1717 53.6934 41.3294 175.9946 112 T 4.0389 8.1083 114.4871 62.8886 69.2043 173.4028 113 P 4.2219 0.0000 0.0000 62.8171 31.5773 176.2128 114 V 4.2871 8.0791 122.4669 58.9168 33.2677 173.3132 115 P 4.3739 0.0000 0.0000 62.6027 32.2422 175.9934 116 H 4.5289 8.2533 117.1267 56.3008 28.5266 174.9594 117 N 4.0968 8.2323 120.0314 53.8969 36.1484 172.0225 118 G 3.9525 7.8535 107.9613 46.2044 0.0000 169.7613 119 C 4.2283 7.7623 121.1427 57.6510 32.5337 173.2302 120 R 4.1957 8.3103 126.7865 54.4701 29.4525 174.2773 121 P 4.4613 0.0000 0.0000 61.7886 31.0070 176.0953 122 K 4.2438 8.2652 118.0763 56.3183 32.4643 178.3892 123 K 4.1496 8.5096 121.3257 59.3727 32.3975 178.3756 124 K 4.0335 7.8242 117.9940 59.5714 32.1229 178.5090 125 F 4.1022 8.2850 113.7174 58.5536 38.8032 176.0847 126 R 4.2126 7.4332 121.5715 56.0523 28.2200 175.1694 127 K 4.3855 8.2728 123.0025 56.6259 34.7342 177.4401 128 A 4.0705 7.9239 121.5336 52.4866 18.7724 177.0481 129 S 4.1840 8.4329 116.5085 58.9171 62.2640 174.4329 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 11 K 8.31 4.45 0.00 1.82 2.01 0.00 1.74 0.00 0.00 1.74 0.00 0.00 2.93 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.42 1.50 7.81 12 R 7.90 4.24 0.00 1.89 1.86 0.00 3.25 0.00 0.00 3.26 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.74 0.00 13 Q 9.15 5.25 0.00 1.97 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.47 0.00 0.00 0.00 0.00 0.00 2.28 2.32 0.00 14 V 8.24 4.50 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 0.95 0.00 0.00 1.03 0.00 0.00 15 A 8.82 4.32 1.29 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 0.00 0.00 16 S 8.09 4.60 0.00 3.90 3.79 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 17 G 8.77 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 0.00 0.00 0.00 0.00 18 R 8.50 5.08 0.00 1.80 1.89 0.00 2.77 0.00 0.00 3.05 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 1.53 0.00 19 A 8.81 5.04 1.19 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 0.00 0.00 20 Y 9.19 5.05 0.00 3.08 2.86 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 21 I 8.73 4.97 1.90 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 0.65 0.93 0.00 0.00 22 H 9.71 5.12 0.00 3.17 3.18 0.00 5.77 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 A 8.76 4.71 1.22 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 0.00 0.00 24 S 8.38 4.66 0.00 3.92 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 25 Y 8.74 4.50 0.00 2.97 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 26 N 8.08 4.68 0.00 2.77 2.92 0.00 0.00 6.71 8.00 0.00 0.00 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 N 7.53 4.36 0.00 2.81 2.70 0.00 0.00 6.98 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 28 T 7.70 5.18 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 1.25 0.00 0.00 29 I 8.77 4.83 1.96 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.90 0.96 0.00 0.00 30 V 9.14 5.12 2.14 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 0.73 0.00 0.00 1.02 0.00 0.00 31 T 9.30 5.19 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 1.33 0.00 0.00 32 I 9.13 4.84 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 1.27 1.00 0.91 0.00 0.00 33 T 8.61 5.06 4.36 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 34 D 8.57 4.95 0.00 2.95 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 35 P 0.00 4.40 0.00 2.07 2.17 0.00 3.69 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.12 0.00 36 D 7.78 4.45 0.00 3.03 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 37 G 7.80 4.51 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 0.00 38 N 7.79 4.53 0.00 2.81 2.76 0.00 0.00 7.14 8.03 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 39 P 0.00 4.98 0.00 2.07 2.04 0.00 3.62 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.09 0.00 40 I 8.27 4.39 1.71 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 1.19 0.81 0.34 0.00 0.00 41 T 7.50 4.63 4.14 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 1.04 0.00 0.00 42 W 7.73 5.65 0.00 3.46 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 43 S 9.21 4.63 0.00 3.74 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 44 S 7.38 4.92 0.00 4.18 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 45 G 8.69 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 0.00 0.00 0.00 46 G 8.14 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 47 V 7.09 3.77 2.39 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 0.66 0.00 0.00 1.07 0.00 0.00 48 I 7.40 3.85 1.85 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.86 0.70 0.00 0.00 49 G 6.01 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 0.00 0.00 0.00 50 Y 7.07 5.15 0.00 2.97 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 51 K 8.28 4.65 0.00 1.82 1.70 0.00 1.87 0.00 0.00 1.88 0.00 0.00 2.96 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.48 1.51 7.81 52 G 9.39 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 0.00 0.00 0.00 53 S 9.19 4.16 0.00 4.06 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 0.00 54 R 8.03 3.71 0.00 1.89 1.39 0.00 3.18 0.00 0.00 3.05 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.85 0.00 55 K 7.77 4.23 0.00 2.12 2.19 0.00 1.96 0.00 0.00 1.83 0.00 0.00 3.28 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.58 1.57 7.81 56 G 7.66 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 57 T 7.12 4.00 4.26 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 1.29 0.00 0.00 58 P 0.00 4.32 0.00 2.30 2.47 0.00 3.72 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.04 0.00 59 Y 8.06 4.11 0.00 3.08 3.03 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 60 A 8.07 3.89 1.51 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 61 A 8.08 4.07 1.41 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 0.00 0.00 62 Q 8.15 3.86 0.00 2.31 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.76 0.00 0.00 0.00 0.00 0.00 2.30 2.42 0.00 63 L 7.77 3.84 0.00 1.69 1.55 0.71 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 64 A 8.49 3.94 1.35 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 0.00 0.00 65 A 8.28 3.94 1.41 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 0.00 0.00 66 L 7.81 3.97 0.00 1.85 1.71 0.91 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 67 D 8.50 4.28 0.00 2.70 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 68 A 8.40 3.97 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.84 4.00 1.41 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 0.00 0.00 70 K 8.15 3.78 0.00 1.80 1.99 0.00 1.68 0.00 0.00 1.69 0.00 0.00 3.10 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.43 1.53 7.81 71 K 8.06 4.19 0.00 1.84 1.87 0.00 1.57 0.00 0.00 1.54 0.00 0.00 2.87 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.43 1.54 7.81 72 A 7.62 4.04 1.42 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 0.00 0.00 73 M 8.40 4.24 0.00 2.08 2.15 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 2.73 2.74 0.00 74 A 7.40 4.04 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 8.21 4.12 0.00 3.25 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 76 G 7.86 3.89 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 0.00 0.00 0.00 77 M 7.65 4.62 0.00 1.99 2.12 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.58 0.00 78 Q 8.54 4.57 0.00 2.16 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.84 0.00 0.00 0.00 0.00 0.00 2.28 2.31 0.00 79 S 8.56 5.52 0.00 3.89 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 80 V 7.88 4.20 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 0.69 0.00 0.00 0.91 0.00 0.00 81 D 8.79 4.76 0.00 2.47 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 82 V 8.21 4.16 2.16 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 0.90 0.00 0.00 0.90 0.00 0.00 83 I 9.15 4.99 1.43 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 1.13 0.52 0.97 0.00 0.00 84 V 9.09 4.69 2.09 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 0.74 0.00 0.00 0.98 0.00 0.00 85 R 8.96 4.79 0.00 1.93 1.80 0.00 3.30 0.00 0.00 3.21 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.69 0.00 86 G 8.46 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 0.00 0.00 0.00 87 T 8.34 4.22 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 1.21 0.00 0.00 88 G 8.05 3.79 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 0.00 0.00 0.00 89 A 8.08 4.54 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 90 G 7.49 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 0.00 0.00 0.00 91 R 7.33 3.79 0.00 1.81 1.86 0.00 3.09 0.00 0.00 3.21 7.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.64 0.00 92 E 8.01 3.99 0.00 2.28 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 0.00 2.36 2.46 0.00 93 Q 7.92 3.99 0.00 2.08 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.84 0.00 0.00 0.00 0.00 0.00 2.40 2.56 0.00 94 A 7.86 4.04 1.37 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 0.00 0.00 95 I 7.46 3.81 2.01 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 1.51 1.14 0.90 0.00 0.00 96 R 8.61 3.91 0.00 1.78 1.99 0.00 3.30 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.81 0.00 97 A 8.11 4.05 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 98 L 7.66 4.14 0.00 1.90 1.72 0.91 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 99 Q 7.92 3.83 0.00 2.17 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.92 0.00 0.00 0.00 0.00 0.00 2.69 2.37 0.00 100 A 7.75 4.15 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 0.00 101 S 8.08 4.22 0.00 4.07 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 0.00 102 G 8.22 4.01 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 0.00 0.00 0.00 103 L 7.20 4.60 0.00 1.49 1.68 0.97 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 104 Q 8.18 4.08 0.00 2.24 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 6.98 0.00 0.00 0.00 0.00 0.00 2.35 2.34 0.00 105 V 8.21 4.17 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 0.69 0.00 0.00 0.96 0.00 0.00 106 K 8.56 4.05 0.00 1.77 1.99 0.00 1.84 0.00 0.00 2.05 0.00 0.00 2.94 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.44 1.41 7.81 107 S 7.27 4.65 0.00 3.86 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 0.00 108 I 8.49 4.75 1.86 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 1.21 0.67 0.90 0.00 0.00 109 V 8.80 4.49 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 0.94 0.00 0.00 0.94 0.00 0.00 110 D 8.58 5.30 0.00 2.66 2.50 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 0.00 111 D 8.91 5.01 0.00 2.70 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 0.00 112 T 8.11 4.04 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 1.25 0.00 0.00 113 P 0.00 4.22 0.00 2.16 2.07 0.00 3.72 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 1.99 1.97 0.00 114 V 8.08 4.29 2.09 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 0.87 0.00 0.00 0.94 0.00 0.00 115 P 0.00 4.37 0.00 2.17 2.04 0.00 3.74 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.95 0.00 116 H 8.25 4.53 0.00 3.18 3.32 0.00 5.85 0.00 0.00 0.00 0.00 8.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 N 8.23 4.10 0.00 2.86 2.85 0.00 0.00 6.95 7.98 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 0.00 118 G 7.85 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 0.00 119 C 7.76 4.23 0.00 2.92 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 0.00 120 R 8.31 4.20 0.00 1.80 1.84 0.00 3.30 0.00 0.00 3.23 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.65 0.00 121 P 0.00 4.46 0.00 2.11 1.93 0.00 3.74 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.07 0.00 122 K 8.27 4.24 0.00 2.03 1.84 0.00 1.83 0.00 0.00 1.83 0.00 0.00 2.86 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.55 1.42 7.81 123 K 8.51 4.15 0.00 1.73 1.86 0.00 1.79 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.43 1.38 7.81 124 K 7.82 4.03 0.00 1.77 1.80 0.00 1.13 0.00 0.00 1.32 0.00 0.00 2.77 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.30 1.46 7.81 125 F 8.28 4.10 0.00 2.99 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 0.00 126 R 7.43 4.21 0.00 2.00 1.98 0.00 3.22 0.00 0.00 3.23 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.62 0.00 127 K 8.27 4.39 0.00 1.76 1.80 0.00 1.80 0.00 0.00 1.69 0.00 0.00 2.91 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.30 1.31 7.81 128 A 7.92 4.07 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 0.00 129 S 8.43 4.18 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