NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 P 4.4598 0.0000 0.0000 62.2845 32.9354 176.5084 6 T 4.0218 9.5015 112.9320 60.8960 70.7131 174.4726 7 I 3.6494 8.3300 122.6094 64.6403 37.6744 179.1482 8 N 4.2247 8.2528 117.3442 56.9978 38.5669 176.5671 9 Q 3.9878 8.6116 119.3874 58.8962 28.8104 178.5468 10 L 3.9470 7.9972 120.0145 58.0844 41.5180 179.6573 11 V 3.6188 7.7244 116.5157 66.2906 31.3866 178.0848 12 R 4.0336 7.8569 116.5337 58.9392 30.1476 178.3397 13 K 4.3231 8.6936 116.7923 55.0912 33.2585 177.8821 14 G 3.9559 7.9468 109.2306 44.2167 0.0000 173.1551 15 R 4.1579 8.1945 117.2839 55.5400 30.8397 176.0251 16 E 4.5341 8.3245 120.8493 53.9834 30.7684 176.0089 17 K 4.0955 8.4897 126.3600 56.2166 32.7936 177.1652 18 V 3.7093 8.2210 122.9421 62.7738 32.1505 175.3727 19 R 4.5086 8.2876 125.4711 54.2800 31.0580 176.3576 20 K 4.1941 8.4868 122.9426 55.9015 32.8882 176.6944 21 K 4.4858 8.2681 121.4825 54.1693 34.0044 176.2065 22 S 4.1340 8.7071 118.5923 59.0930 62.6107 173.8436 23 K 4.5771 8.4329 124.3028 55.9995 32.4979 177.7158 24 V 4.3505 7.3565 119.2097 61.4875 32.7093 173.1986 25 P 4.5113 0.0000 0.0000 61.7875 29.3223 176.3824 26 A 3.9857 7.7364 117.6947 53.8679 19.3425 177.9917 27 L 2.8172 8.1377 120.3811 59.4163 43.0614 175.1393 28 K 4.3744 9.3323 117.1086 59.5213 29.2581 175.1186 29 G 3.8245 8.2413 108.6744 46.2611 0.0000 175.0027 30 A 4.2740 7.0938 123.2275 50.8763 19.2923 176.9475 31 P 4.1645 0.0000 0.0000 64.9324 31.7322 176.7711 32 F 5.1743 7.5141 113.7531 56.4214 43.4570 174.0375 33 R 4.8233 8.9630 120.2299 55.1294 33.8651 173.9004 34 R 5.0490 8.8327 122.4986 55.4435 32.4064 175.8322 35 G 4.3948 8.8556 106.9614 45.7953 0.0000 171.1778 36 V 5.0153 8.4751 118.9271 60.9863 34.9256 176.0398 37 C 4.7582 8.4496 124.7087 60.6537 28.2171 173.3410 38 T 4.4527 8.8846 119.5854 64.9449 70.0116 175.4843 39 V 4.3605 7.5026 119.6282 60.7629 35.0924 174.7353 40 V 4.8061 7.7689 127.0263 61.1989 29.4425 175.7604 41 R 4.4304 7.4173 127.7698 56.7873 33.0851 175.5244 42 T 4.9872 8.2363 112.4031 62.5763 72.9209 173.4396 43 V 4.6764 8.8617 124.4038 61.2648 35.5044 174.3695 44 T 4.8922 8.3122 115.1210 59.4798 70.3033 172.8824 45 P 4.4522 0.0000 0.0000 63.0639 32.5319 174.3259 46 K 4.5588 8.0238 119.6063 57.6419 33.7525 177.9458 47 K 4.6517 7.1583 114.1181 58.1287 32.7699 174.4586 48 P 4.9415 0.0000 0.0000 62.1858 31.9347 173.6671 49 N 5.1021 8.2635 115.4556 51.9407 41.1960 174.0005 50 S 4.5609 9.0677 113.2823 55.5597 65.7124 173.2989 51 A 4.6969 7.4444 128.8923 52.1806 20.1437 175.7964 52 L 5.0964 7.5696 119.6930 52.4438 41.2629 176.1223 53 R 4.1308 8.6147 120.7258 56.3970 31.8730 175.8278 54 K 4.4246 8.5173 123.0351 55.9873 33.2693 176.1749 55 V 4.7875 7.8852 123.2196 61.3840 36.0823 173.7585 56 A 5.5376 8.1907 121.0544 51.6632 22.9325 176.0884 57 K 4.5619 8.7090 122.6311 56.2376 33.8346 176.2600 58 V 4.8133 9.1891 124.0259 61.1278 35.2174 174.2889 59 R 4.5926 9.2417 128.8993 55.1355 30.8264 175.6544 60 L 4.7046 9.3065 128.3957 54.4767 42.7741 178.6356 61 T 4.1155 8.4064 111.0428 63.6877 69.0725 175.7502 62 S 4.3591 7.9722 115.5400 58.8803 63.5319 173.2620 63 G 4.1964 8.0776 109.5411 46.0172 0.0000 174.0609 64 Y 4.2569 7.9187 114.9785 57.9504 39.4805 175.6678 65 E 5.4027 8.6500 119.4516 54.1333 32.2741 175.2180 66 V 4.5888 8.2118 116.9638 59.5544 36.2879 174.6375 67 T 4.9139 8.4555 117.7930 62.5749 70.0708 174.1148 68 A 5.1198 8.9860 128.4396 50.2058 22.5948 174.5258 69 Y 4.4428 9.1341 121.9670 57.0741 40.7298 174.7326 70 I 4.3425 6.6614 126.7340 58.6641 38.0447 173.9886 71 P 4.7582 0.0000 0.0000 63.4090 32.1358 176.0720 72 G 3.9426 9.0399 106.2853 44.4829 0.0000 174.0134 73 E 4.0498 8.6102 118.9433 58.6977 29.5638 178.4847 74 G 4.0016 7.6079 104.7515 44.8107 0.0000 172.6465 75 H 4.8277 8.6906 121.1607 54.4778 30.5028 174.0172 76 N 5.0031 8.2486 114.7190 52.4781 37.4780 174.0771 77 L 4.5560 8.2004 118.9277 55.1288 43.6743 176.3312 78 Q 4.7348 7.7945 121.9799 56.2045 29.7958 175.1347 79 E 3.9471 9.0808 127.2948 58.9658 27.6185 178.3843 80 H 4.3802 8.8335 116.9917 56.8778 29.2014 174.9783 81 S 4.6252 9.6688 116.3081 57.8590 64.0634 173.6625 82 V 4.1191 9.5702 126.9221 62.8848 32.4920 175.1805 83 V 5.0688 9.1768 126.2709 60.3795 35.8302 173.3158 84 L 5.0429 8.4994 122.6459 53.4104 44.2943 175.3445 85 I 4.7453 8.8164 128.4164 61.0851 38.4399 176.6436 86 R 4.8363 8.9119 120.0088 54.8986 31.0154 171.3777 87 G 3.8748 8.8514 117.7421 44.4998 0.0000 173.6219 88 G 4.5216 8.4231 122.2214 45.3627 0.0000 172.7076 89 R 4.2050 8.0794 124.5618 55.5178 31.1704 176.9288 90 V 4.1111 7.9339 117.7893 61.6714 32.0865 174.7074 91 K 4.0235 8.3536 129.0018 59.2027 32.9551 176.9587 92 D 4.5365 8.0528 117.4087 55.0084 41.1667 175.3025 93 L 4.7940 8.0124 120.4609 51.6193 41.5850 173.9573 94 P 4.2910 0.0000 0.0000 63.7558 31.9797 177.2277 95 G 3.8317 9.0287 107.6489 45.8618 0.0000 173.8082 96 V 4.5915 7.4491 117.3975 60.0832 32.5356 175.7575 97 R 4.3893 8.5860 124.8815 55.9270 31.2880 175.4382 98 Y 5.2468 7.7017 115.0065 56.6977 42.7590 174.0164 99 H 5.3801 9.0456 118.0430 54.6299 32.3255 173.4641 100 I 4.7843 8.0939 120.9261 59.3475 38.5528 176.3276 101 V 3.6200 8.6688 128.4567 63.4134 32.2458 175.3985 102 R 4.4249 8.4464 126.8390 55.5266 31.2821 176.5437 103 G 4.0833 8.5499 110.6513 45.2041 0.0000 173.5757 104 V 4.1505 7.3613 119.6062 61.8924 34.9073 174.6814 105 Y 3.7240 8.0812 122.8909 59.7542 35.9722 171.4810 106 D 4.4460 9.3759 126.3776 56.4196 41.0898 176.6162 107 A 4.3072 7.8980 123.5778 50.3587 17.5402 176.6768 108 A 4.3297 8.8855 124.8124 52.7054 19.0897 177.8839 109 G 4.4022 8.2585 108.0990 45.1315 0.0000 173.4038 110 V 3.8968 7.9671 121.1959 62.6897 31.7548 176.0984 111 K 4.1741 8.6959 127.4083 56.4761 33.1342 176.2240 112 D 4.3717 8.4579 120.2473 55.7016 38.1179 174.0306 113 R 4.6389 7.8805 116.1894 54.7634 32.0597 176.9112 114 K 4.7313 8.3829 117.7548 55.6780 35.4574 176.6780 115 K 4.5968 7.6472 116.3310 56.2117 30.6596 180.0181 116 S 4.7231 9.0509 125.5882 58.5106 61.8003 176.1073 117 R 4.0113 9.5886 122.4687 59.7721 30.4176 179.3634 118 S 4.0453 8.2349 111.7796 61.3203 62.4900 175.2343 119 K 4.2665 8.1635 117.4445 56.7836 31.3846 177.1958 120 Y 4.5883 8.4028 114.8252 57.8710 40.9049 175.7534 121 G 4.4674 7.9864 107.0917 45.9939 0.0000 173.8778 122 T 4.6983 7.3094 107.3414 59.3958 71.4401 174.9691 123 K 3.9520 8.6930 125.7592 55.7621 32.6432 176.1594 124 K 3.9697 8.3734 121.4865 55.4632 32.0797 174.3902 125 P 4.2190 0.0000 0.0000 62.3913 30.8446 175.8903 126 K 3.9756 8.5539 124.3535 56.9138 31.0799 175.1399 127 E 4.1276 8.4826 123.5629 56.0328 30.6134 177.1647 128 A 4.3122 8.5337 125.3043 52.1357 19.3285 176.0714 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 5 P 0.00 4.46 0.00 2.06 2.05 0.00 3.64 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 2.08 0.00 6 T 9.50 4.02 4.24 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 0.00 0.00 0.00 1.29 0.00 0.00 7 I 8.33 3.65 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 1.52 0.87 0.91 0.00 0.00 8 N 8.25 4.22 0.00 2.82 2.83 0.00 0.00 7.14 7.08 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 9 Q 8.61 3.99 0.00 2.33 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.53 0.00 0.00 0.00 0.00 0.00 2.38 2.40 0.00 10 L 8.00 3.95 0.00 1.88 1.73 0.92 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 11 V 7.72 3.62 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 0.83 0.00 0.00 0.98 0.00 0.00 12 R 7.86 4.03 0.00 2.00 1.97 0.00 3.20 0.00 0.00 3.22 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.88 0.00 13 K 8.69 4.32 0.00 1.67 1.85 0.00 1.83 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.40 1.43 7.81 14 G 7.95 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 0.00 0.00 0.00 15 R 8.19 4.16 0.00 1.81 1.87 0.00 3.33 0.00 0.00 3.15 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.55 0.00 16 E 8.32 4.53 0.00 1.90 1.83 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 2.19 2.29 0.00 17 K 8.49 4.10 0.00 1.78 1.73 0.00 1.81 0.00 0.00 1.63 0.00 0.00 2.96 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.44 1.37 7.81 18 V 8.22 3.71 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 0.79 0.00 0.00 0.93 0.00 0.00 19 R 8.29 4.51 0.00 1.82 1.85 0.00 3.26 0.00 0.00 3.23 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.62 0.00 20 K 8.49 4.19 0.00 1.73 1.72 0.00 1.68 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.43 1.45 7.81 21 K 8.27 4.49 0.00 1.70 1.71 0.00 1.77 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.33 1.37 7.81 22 S 8.71 4.13 0.00 3.81 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 23 K 8.43 4.58 0.00 1.68 1.69 0.00 1.75 0.00 0.00 1.59 0.00 0.00 2.93 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.30 1.47 7.81 24 V 7.36 4.35 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 0.92 0.00 0.00 0.72 0.00 0.00 25 P 0.00 4.51 0.00 2.00 1.90 0.00 3.83 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.09 0.00 26 A 7.74 3.99 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 0.00 0.00 0.00 0.00 0.00 27 L 8.14 2.82 0.00 1.48 1.62 1.12 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 28 K 9.33 4.37 0.00 1.86 2.21 0.00 1.89 0.00 0.00 1.72 0.00 0.00 3.05 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.41 1.46 7.81 29 G 8.24 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 0.00 0.00 0.00 30 A 7.09 4.27 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 31 P 0.00 4.16 0.00 1.66 1.77 0.00 3.67 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 1.99 2.00 0.00 32 F 7.51 5.17 0.00 2.94 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 33 R 8.96 4.82 0.00 1.93 1.69 0.00 3.27 0.00 0.00 3.20 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.64 0.00 34 R 8.83 5.05 0.00 2.19 2.33 0.00 2.75 0.00 0.00 2.88 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.61 0.00 35 G 8.86 4.39 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 0.00 36 V 8.48 5.02 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 0.99 0.00 0.00 0.90 0.00 0.00 37 C 8.45 4.76 0.00 3.13 2.84 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 38 T 8.88 4.45 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 39 V 7.50 4.36 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 0.93 0.00 0.00 0.94 0.00 0.00 40 V 7.77 4.81 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 1.04 0.00 0.00 0.98 0.00 0.00 41 R 7.42 4.43 0.00 1.94 1.74 0.00 3.26 0.00 0.00 3.35 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.67 0.00 42 T 8.24 4.99 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 1.29 0.00 0.00 43 V 8.86 4.68 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 1.03 0.00 0.00 0.96 0.00 0.00 44 T 8.31 4.89 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 1.23 0.00 0.00 45 P 0.00 4.45 0.00 2.14 2.09 0.00 3.67 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 2.03 2.12 0.00 46 K 8.02 4.56 0.00 2.03 1.70 0.00 1.65 0.00 0.00 1.64 0.00 0.00 2.90 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.36 1.39 7.81 47 K 7.16 4.65 0.00 1.82 1.85 0.00 1.74 0.00 0.00 1.75 0.00 0.00 3.08 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.43 1.48 7.81 48 P 0.00 4.94 0.00 2.12 2.07 0.00 3.71 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.93 0.00 49 N 8.26 5.10 0.00 2.70 2.75 0.00 0.00 6.55 7.52 0.00 0.00 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 S 9.07 4.56 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 51 A 7.44 4.70 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 52 L 7.57 5.10 0.00 1.52 1.61 0.93 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 0.00 0.00 0.00 0.00 0.00 0.00 53 R 8.61 4.13 0.00 2.09 2.13 0.00 3.25 0.00 0.00 3.24 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.96 0.00 54 K 8.52 4.42 0.00 1.50 1.50 0.00 1.64 0.00 0.00 1.73 0.00 0.00 2.89 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.57 1.53 7.81 55 V 7.89 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 1.04 0.00 0.00 1.04 0.00 0.00 56 A 8.19 5.54 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 57 K 8.71 4.56 0.00 1.70 1.75 0.00 1.65 0.00 0.00 1.77 0.00 0.00 2.83 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.54 1.39 7.81 58 V 9.19 4.81 2.12 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 1.08 0.00 0.00 1.00 0.00 0.00 59 R 9.24 4.59 0.00 1.93 1.90 0.00 3.19 0.00 0.00 3.17 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.65 0.00 60 L 9.31 4.70 0.00 1.85 1.67 0.87 -0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 61 T 8.41 4.12 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 1.26 0.00 0.00 62 S 7.97 4.36 0.00 4.02 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 63 G 8.08 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 0.00 0.00 0.00 0.00 64 Y 7.92 4.26 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 65 E 8.65 5.40 0.00 1.79 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 2.20 2.22 0.00 66 V 8.21 4.59 2.18 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 0.99 0.00 0.00 0.55 0.00 0.00 67 T 8.46 4.91 4.62 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 1.28 0.00 0.00 68 A 8.99 5.12 1.28 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 0.00 0.00 0.00 69 Y 9.13 4.44 0.00 3.04 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 70 I 6.66 4.34 1.45 0.00 0.00 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 1.11 0.60 0.75 0.00 0.00 71 P 0.00 4.76 0.00 2.57 2.41 0.00 3.77 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.19 0.00 72 G 9.04 3.94 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 0.00 0.00 0.00 0.00 0.00 0.00 73 E 8.61 4.05 0.00 1.89 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 2.19 2.18 0.00 74 G 7.61 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 75 H 8.69 4.83 0.00 3.27 3.30 0.00 5.47 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 N 8.25 5.00 0.00 2.78 2.85 0.00 0.00 5.95 7.79 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 77 L 8.20 4.56 0.00 1.80 1.68 0.88 0.97 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 78 Q 7.79 4.73 0.00 2.04 1.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.51 6.91 0.00 0.00 0.00 0.00 0.00 2.28 2.28 0.00 79 E 9.08 3.95 0.00 1.75 1.23 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 2.28 2.23 0.00 80 H 8.83 4.38 0.00 3.15 3.32 0.00 5.69 0.00 0.00 0.00 0.00 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 S 9.67 4.63 0.00 3.93 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 82 V 9.57 4.12 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 0.65 0.00 0.00 0.84 0.00 0.00 83 V 9.18 5.07 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 0.82 0.00 0.00 0.99 0.00 0.00 84 L 8.50 5.04 0.00 1.63 1.39 1.13 0.40 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 85 I 8.82 4.75 1.99 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.98 0.82 0.00 0.00 86 R 8.91 4.84 0.00 2.31 2.29 0.00 3.34 0.00 0.00 3.41 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.70 0.00 87 G 8.85 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 0.00 0.00 0.00 88 G 8.42 4.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.08 4.20 0.00 1.75 1.86 0.00 3.34 0.00 0.00 2.65 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.44 0.00 90 V 7.93 4.11 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 0.71 0.00 0.00 0.71 0.00 0.00 91 K 8.35 4.02 0.00 1.70 1.81 0.00 1.68 0.00 0.00 1.68 0.00 0.00 2.85 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.41 1.56 7.81 92 D 8.05 4.54 0.00 2.72 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 93 L 8.01 4.79 0.00 1.69 1.65 1.16 0.82 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 94 P 0.00 4.29 0.00 2.19 2.06 0.00 3.83 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.97 0.00 95 G 9.03 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 96 V 7.45 4.59 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 1.44 0.00 0.00 1.06 0.00 0.00 97 R 8.59 4.39 0.00 0.95 1.22 0.00 3.13 0.00 0.00 3.35 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.57 0.00 98 Y 7.70 5.25 0.00 2.93 2.99 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 99 H 9.05 5.38 0.00 3.21 3.35 0.00 5.78 0.00 0.00 0.00 0.00 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 I 8.09 4.78 1.89 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 1.16 0.76 0.94 0.00 0.00 101 V 8.67 3.62 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 0.53 0.00 0.00 0.78 0.00 0.00 102 R 8.45 4.42 0.00 1.99 1.90 0.00 3.33 0.00 0.00 3.58 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.78 0.00 103 G 8.55 4.08 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 V 7.36 4.15 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 -0.18 0.00 0.00 0.60 0.00 0.00 105 Y 8.08 3.72 0.00 3.18 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 0.00 106 D 9.38 4.45 0.00 2.88 2.75 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 0.00 107 A 7.90 4.31 1.38 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 0.00 0.00 108 A 8.89 4.33 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 0.00 109 G 8.26 4.40 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 0.00 110 V 7.97 3.90 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 0.65 0.00 0.00 0.93 0.00 0.00 111 K 8.70 4.17 0.00 1.67 1.71 0.00 1.94 0.00 0.00 1.70 0.00 0.00 2.89 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.44 1.46 7.81 112 D 8.46 4.37 0.00 2.80 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 0.00 113 R 7.88 4.64 0.00 1.94 1.86 0.00 3.35 0.00 0.00 3.17 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.50 0.00 114 K 8.38 4.73 0.00 1.68 1.78 0.00 1.73 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.33 1.42 7.81 115 K 7.65 4.60 0.00 1.81 0.95 0.00 1.70 0.00 0.00 1.83 0.00 0.00 2.92 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.47 1.40 7.81 116 S 9.05 4.72 0.00 4.11 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 0.00 117 R 9.59 4.01 0.00 1.92 2.26 0.00 3.31 0.00 0.00 3.11 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.89 0.00 118 S 8.23 4.05 0.00 3.85 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 0.00 119 K 8.16 4.27 0.00 1.50 1.30 0.00 1.67 0.00 0.00 1.59 0.00 0.00 2.93 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.35 1.32 7.81 120 Y 8.40 4.59 0.00 3.19 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 0.00 121 G 7.99 4.47 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 0.00 0.00 0.00 122 T 7.31 4.70 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 1.37 0.00 0.00 123 K 8.69 3.95 0.00 1.77 1.83 0.00 1.76 0.00 0.00 1.63 0.00 0.00 2.82 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.45 1.39 7.81 124 K 8.37 3.97 0.00 1.70 1.74 0.00 1.68 0.00 0.00 1.76 0.00 0.00 3.14 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.42 1.49 7.81 125 P 0.00 4.22 0.00 2.22 2.09 0.00 3.84 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 1.96 0.00 126 K 8.55 3.98 0.00 1.86 1.93 0.00 1.46 0.00 0.00 1.76 0.00 0.00 3.11 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.41 1.51 7.81 127 E 8.48 4.13 0.00 2.10 2.01 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 2.27 2.30 0.00 128 A 8.53 4.31 1.23 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 0.00 0.00 0.00