NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 S 4.4335 8.1933 115.2902 57.9121 63.8856 174.3171 5 I 3.4940 8.4230 128.9304 64.3040 36.9983 177.2242 6 R 3.8749 8.7947 119.6458 59.3279 30.2887 178.5497 7 E 3.9946 8.1155 117.8860 59.4445 29.4656 178.8687 8 E 3.9511 8.1869 119.2938 58.9495 29.6419 179.0002 9 V 3.5262 7.9255 118.6864 66.5109 31.6423 177.8965 10 H 4.2607 8.3022 115.9803 58.6927 28.4735 177.8806 11 R 3.9331 8.2483 120.8919 59.4168 29.8985 178.0585 12 H 4.1091 8.4383 118.3703 59.3757 29.7155 177.2048 13 L 4.0885 7.9308 119.5091 57.8194 41.2101 179.5123 14 G 3.7379 8.0076 105.2235 47.7496 0.0000 176.1521 15 T 3.8935 8.0112 118.0220 66.6060 68.5488 177.2240 16 V 3.5921 7.8469 113.7169 63.9865 31.5611 178.4050 17 A 4.0342 7.6813 120.2278 54.9949 17.9248 179.5811 18 L 4.0526 8.0582 117.1777 57.4207 41.6655 178.4657 19 M 4.5318 7.3941 116.5312 53.7467 32.1972 175.7342 20 Q 3.9578 7.2938 121.3299 55.5563 29.4075 174.6967 21 P 4.3486 0.0000 0.0000 63.2181 31.9985 175.2441 22 A 4.4112 8.0141 121.6268 51.6525 21.6824 176.4839 23 L 4.3313 8.3230 120.2943 53.6222 41.2351 176.1311 24 H 4.4889 8.5777 124.3741 54.5942 29.6633 174.5432 25 Q 4.4171 8.1736 129.3979 53.9513 28.9788 175.0263 26 Q 4.0503 8.4801 124.9682 55.9492 29.4399 176.0947 27 T 4.5443 8.1829 111.8156 60.4691 70.8087 174.7828 28 H 4.6919 8.1767 121.9792 54.8641 29.5430 173.2375 29 A 3.6622 7.9488 125.0964 52.3640 15.9239 175.5739 30 P 4.3827 0.0000 0.0000 61.5271 32.8497 177.0715 31 A 4.2922 8.2386 122.7580 51.1896 19.4612 176.9796 32 P 4.3586 0.0000 0.0000 65.9359 31.4625 178.6687 33 T 4.1687 7.8857 105.7613 63.1221 68.8999 174.5549 34 E 4.3612 8.3431 121.3375 56.4079 30.1545 175.6891 35 I 4.3294 7.4688 120.9348 59.9940 37.6926 176.3871 36 T 4.4052 8.2288 116.6921 60.8647 71.3517 174.9474 37 H 4.1917 8.6767 120.0754 59.7072 29.8027 177.1566 38 T 3.8152 7.9223 117.0043 66.7547 68.3662 176.4506 39 L 3.9366 8.0287 120.8566 57.4953 41.6239 179.2366 40 F 4.0449 8.6788 121.1130 61.4619 39.1511 177.2237 41 R 3.9854 8.1891 116.8280 59.2177 29.9866 178.0897 42 A 4.0303 7.8558 120.6808 55.4602 18.1969 179.3312 43 Y 4.1388 8.0807 114.5836 60.7088 37.8898 177.6493 44 T 4.3551 7.3563 108.8712 60.5766 69.3427 174.9569 45 R 3.9911 7.0156 118.5230 56.4417 30.3178 176.0898 46 V 4.0157 7.9614 118.0347 60.6815 31.8425 174.2363 47 P 4.0336 0.0000 0.0000 65.9972 31.1339 177.5225 48 H 4.4827 6.9693 110.7678 56.8973 28.6866 175.7902 49 D 4.5613 7.7731 121.3692 53.2344 39.3477 175.6919 50 V 4.7466 7.1615 113.6931 59.5148 33.2184 176.2613 51 G 3.8974 8.0208 109.5493 47.4925 0.0000 173.8246 52 G 3.9966 8.9583 113.3942 45.0987 0.0000 173.4924 53 E 4.0532 8.0886 120.3029 55.7480 30.0396 176.3736 54 A 4.2968 8.3842 126.4089 52.4873 19.0411 176.0532 55 D 4.6593 8.1774 119.9526 53.1726 44.4593 174.6654 56 V 4.1831 7.8964 115.6972 59.2201 33.1819 174.1841 57 P 4.4779 0.0000 0.0000 62.1727 31.8803 176.3008 58 I 4.3793 7.3906 114.5716 58.6480 40.4507 174.8040 59 E 3.9277 8.4622 123.6144 55.5902 28.9123 176.0025 60 Y 4.3649 8.0037 124.7488 58.3190 38.5680 175.4102 61 H 5.0264 8.2089 117.4308 53.8748 31.8859 172.4651 62 E 4.5194 8.4808 119.6248 55.1083 31.0925 175.6594 63 K 4.5815 7.9723 119.9024 54.6421 35.2289 175.6996 64 E 4.0738 8.6106 125.4392 56.1838 30.1134 176.0944 65 E 4.2178 8.3679 123.2232 55.6706 30.7598 176.8223 66 E 4.2129 9.3102 126.0796 55.8175 31.7071 178.2402 67 I 3.7407 8.3310 122.9755 64.3073 37.1974 178.8554 68 W 4.9837 8.2011 118.4470 59.0190 27.9785 178.2598 69 E 2.9249 6.9176 119.1964 58.5975 28.7913 178.6945 70 L 3.7370 7.4308 120.2697 58.2431 42.1320 178.8485 71 N 4.4455 8.2716 116.3982 56.5061 38.3860 177.6236 72 T 4.0344 8.2601 117.4416 66.6178 68.6252 176.4015 73 F 4.2505 8.2259 122.4245 61.3983 39.3106 176.9763 74 A 3.9681 8.1806 120.3348 55.3914 18.0639 179.7766 75 T 3.8671 8.2301 114.2720 67.0886 68.5089 176.7044 76 C 4.5774 8.5384 118.7537 63.1609 28.2003 176.1472 77 E 4.1084 8.3708 120.1775 59.5510 29.0046 179.1903 78 C 4.6293 8.5928 117.1667 62.7664 28.0923 176.1055 79 L 3.9224 8.4827 120.8767 57.5379 41.1717 179.3690 80 A 5.2272 8.2165 122.0328 54.3559 18.1968 179.3411 81 W 4.4063 8.6206 126.4948 60.6607 30.8031 177.5246 82 R 4.3317 7.9439 115.4659 55.8305 29.8695 177.4801 83 G 3.9970 7.9142 105.7054 45.9020 0.0000 175.6405 84 V 3.6649 8.0000 121.0076 65.2845 31.7755 175.5506 85 W 4.9871 7.8852 114.5800 55.0792 30.4601 172.8693 86 T 4.8295 8.5621 109.5375 59.9130 71.6271 175.4026 87 A 3.5918 8.2169 123.0271 55.2154 18.3243 179.8950 88 E 3.8104 7.9376 116.7389 59.5270 29.6141 179.2069 89 E 3.9298 7.7762 118.6946 59.0559 29.4040 179.3239 90 R 2.9642 7.0250 118.5966 59.1087 29.9992 178.5545 91 R 3.6134 7.7091 118.1207 59.3345 30.0170 178.9512 92 R 3.7866 7.7704 118.1238 59.3906 29.7376 178.7592 93 K 4.1239 7.8775 118.1258 59.4211 31.9095 179.2419 94 Q 4.2927 8.4176 120.5801 57.8502 29.0817 176.7840 95 N 5.0094 8.5480 115.3111 53.2326 39.2943 175.1429 96 C 4.1294 7.4720 116.0673 61.3494 30.6411 175.9946 97 D 4.4167 8.1450 118.0693 57.3266 40.5194 178.7849 98 V 3.6436 7.1159 111.5066 62.5519 31.8623 177.5968 99 G 4.1039 8.1774 104.8920 45.7792 0.0000 173.9137 100 Q 4.0436 8.8590 121.1036 59.6551 28.7884 179.5215 101 T 3.9044 7.8972 115.7005 66.8833 68.6571 176.7941 102 V 3.6271 7.8104 119.5803 65.9406 31.5229 176.9822 103 Y 4.2020 8.4408 119.8352 60.4020 38.4061 177.6117 104 L 4.4886 7.7035 116.7396 55.0919 42.9063 178.4093 105 G 3.8090 8.2609 105.4455 45.8498 0.0000 173.8631 106 M 4.5858 7.2733 119.3767 52.8398 34.1838 174.0579 107 P 4.5576 0.0000 0.0000 62.3567 32.1179 176.5107 108 Y 4.1815 8.7269 121.0347 62.1647 38.4903 178.5209 109 Y 4.4848 8.2948 116.4978 60.2150 38.1653 178.4068 110 G 3.9090 8.5980 107.6579 47.9024 0.0000 176.1241 111 R 4.1304 8.1814 120.3103 58.6880 30.1187 179.0218 112 W 4.1876 8.4687 118.4403 59.7521 29.1791 178.1122 113 L 4.1971 8.6727 120.1984 58.3380 41.5763 178.8397 114 L 4.0607 8.2154 118.9240 58.4060 41.6198 179.8174 115 T 4.0274 8.3789 115.2489 66.3196 68.1070 176.8068 116 A 3.9363 8.2161 122.8913 55.0394 18.1386 179.5565 117 A 4.0240 8.1255 119.4265 55.0955 18.4280 179.7723 118 R 3.8625 8.1709 117.4675 59.7378 30.2005 178.6637 119 I 3.8395 7.8943 118.3052 63.8933 37.7923 177.7890 120 L 4.0952 7.4830 118.7357 57.6725 41.3596 179.6780 121 V 3.9465 7.4167 119.0729 65.4770 31.4035 177.8178 122 D 4.3712 8.3438 117.6576 56.8135 40.6465 177.9935 123 K 4.2265 7.6851 116.2759 54.9975 32.3408 176.3247 124 Q 3.4445 7.7786 116.6884 56.9311 26.8093 175.2577 125 F 4.4631 8.0449 117.9363 59.6423 39.4965 176.6413 126 V 4.7019 7.3683 112.6557 58.8442 35.6826 174.5960 127 T 4.2905 8.8597 114.0492 60.8600 71.2445 175.8841 128 L 3.8855 8.3037 123.2005 58.5841 41.9793 179.4028 129 T 3.8415 7.7803 115.3220 66.6400 68.4023 176.2312 130 E 3.9646 8.1574 120.4976 59.1469 29.4592 179.2284 131 L 3.9329 7.7928 120.3788 58.5280 42.2641 178.7205 132 H 4.2761 8.4928 116.5418 59.0487 28.6237 177.5725 133 N 4.3550 8.5727 118.6531 56.1020 38.2638 177.3667 134 K 4.0583 8.2702 121.1110 59.5890 32.3237 178.8230 135 I 3.6691 7.8576 120.0606 64.4279 36.9810 178.5148 136 V 3.5939 7.7450 118.8676 66.0172 31.2923 177.8630 137 E 3.9587 8.2467 118.2733 59.7761 29.3421 179.2901 138 M 4.0958 8.3410 118.9153 58.5221 31.9705 179.1095 139 R 3.9539 8.0789 118.1917 59.2499 30.1246 179.0219 140 E 3.9595 8.4265 118.6035 59.2654 29.3160 179.2010 141 R 3.7718 8.4092 119.2898 59.5523 29.8763 178.8077 142 V 3.6256 7.7124 116.8153 65.6342 31.9140 177.7743 143 A 4.1573 8.1492 120.9393 55.0903 18.2250 179.4257 144 S 4.3447 8.5793 110.1065 58.8367 63.0207 174.6407 145 G 3.9514 7.9192 110.4186 47.0686 0.0000 174.7669 146 Q 4.2970 7.8955 115.8522 55.6658 28.2531 177.1321 147 G 3.9009 9.0443 106.9880 45.3412 0.0000 174.1880 148 L 4.5270 9.1831 113.3874 55.6669 45.0210 174.7089 149 G 3.6082 7.9019 116.0293 46.9043 0.0000 171.9252 150 E 4.2963 8.3352 122.2422 56.4910 30.1875 176.6989 151 Y 4.5949 7.6459 118.3877 59.3402 39.0093 175.2176 152 L 4.5343 7.3515 117.6612 53.4706 44.6831 171.8732 153 P 4.6853 0.0000 0.0000 61.6227 32.3354 174.6393 154 P 4.5329 0.0000 0.0000 63.1248 31.1800 176.4550 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 4 S 8.19 4.43 0.00 3.87 4.04 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 0.00 0.00 0.00 5 I 8.42 3.49 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 1.63 0.14 0.89 0.00 0.00 6 R 8.79 3.87 0.00 1.84 2.03 0.00 3.27 0.00 0.00 3.33 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.69 0.00 7 E 8.12 3.99 0.00 2.17 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 2.42 2.38 0.00 8 E 8.19 3.95 0.00 2.17 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 0.00 2.30 2.32 0.00 9 V 7.93 3.53 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 0.84 0.00 0.00 0.90 0.00 0.00 10 H 8.30 4.26 0.00 3.22 3.33 0.00 5.67 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 R 8.25 3.93 0.00 1.99 2.11 0.00 3.11 0.00 0.00 3.10 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.64 0.00 12 H 8.44 4.11 0.00 3.37 3.51 0.00 5.84 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 13 L 7.93 4.09 0.00 1.83 1.74 0.94 0.85 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 14 G 8.01 3.74 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 0.00 0.00 0.00 15 T 8.01 3.89 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 1.19 0.00 0.00 16 V 7.85 3.59 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 0.61 0.00 0.00 0.92 0.00 0.00 17 A 7.68 4.03 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.06 4.05 0.00 1.68 1.74 0.91 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 19 M 7.39 4.53 0.00 1.99 2.15 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.51 0.00 20 Q 7.29 3.96 0.00 2.02 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.58 6.85 0.00 0.00 0.00 0.00 0.00 2.37 2.39 0.00 21 P 0.00 4.35 0.00 2.08 1.98 0.00 3.77 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 2.03 2.09 0.00 22 A 8.01 4.41 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 23 L 8.32 4.33 0.00 1.65 1.67 0.93 1.04 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 24 H 8.58 4.49 0.00 3.07 3.26 0.00 5.89 0.00 0.00 0.00 0.00 6.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 Q 8.17 4.42 0.00 2.02 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.74 6.71 0.00 0.00 0.00 0.00 0.00 2.25 2.35 0.00 26 Q 8.48 4.05 0.00 2.10 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.48 0.00 0.00 0.00 0.00 0.00 2.40 2.41 0.00 27 T 8.18 4.54 4.22 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 1.32 0.00 0.00 28 H 8.18 4.69 0.00 3.12 3.22 0.00 5.85 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 A 7.95 3.66 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 30 P 0.00 4.38 0.00 2.05 2.01 0.00 3.60 0.00 0.00 3.60 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 31 A 8.24 4.29 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 32 P 0.00 4.36 0.00 2.20 2.16 0.00 3.61 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 2.13 2.11 0.00 33 T 7.89 4.17 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 34 E 8.34 4.36 0.00 2.09 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 0.00 2.29 2.42 0.00 35 I 7.47 4.33 2.10 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.87 1.15 0.00 0.00 36 T 8.23 4.41 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 1.25 0.00 0.00 37 H 8.68 4.19 0.00 3.27 3.38 0.00 5.87 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 T 7.92 3.82 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 1.19 0.00 0.00 39 L 8.03 3.94 0.00 1.97 1.90 1.02 0.93 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 F 8.68 4.04 0.00 3.30 3.23 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 41 R 8.19 3.99 0.00 1.82 2.05 0.00 3.35 0.00 0.00 3.23 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.68 0.00 42 A 7.86 4.03 1.17 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 0.00 0.00 43 Y 8.08 4.14 0.00 2.84 2.81 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 44 T 7.36 4.36 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 0.61 0.00 0.00 45 R 7.02 3.99 0.00 1.85 2.14 0.00 3.06 0.00 0.00 3.11 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.50 0.00 46 V 7.96 4.02 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 0.77 0.00 0.00 0.89 0.00 0.00 47 P 0.00 4.03 0.00 1.59 1.75 0.00 3.50 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 2.04 1.99 0.00 48 H 6.97 4.48 0.00 3.13 3.38 0.00 5.57 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 D 7.77 4.56 0.00 2.67 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 50 V 7.16 4.75 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 1.19 0.00 0.00 1.00 0.00 0.00 51 G 8.02 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 52 G 8.96 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 E 8.09 4.05 0.00 2.18 1.90 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 2.34 2.34 0.00 54 A 8.38 4.30 1.24 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 0.00 0.00 0.00 55 D 8.18 4.66 0.00 2.61 2.52 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 56 V 7.90 4.18 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 0.77 0.00 0.00 0.90 0.00 0.00 57 P 0.00 4.48 0.00 1.98 1.91 0.00 3.58 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.04 0.00 58 I 7.39 4.38 1.71 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 0.89 -0.15 0.83 0.00 0.00 59 E 8.46 3.93 0.00 1.87 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 2.28 2.30 0.00 60 Y 8.00 4.36 0.00 3.01 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 61 H 8.21 5.03 0.00 3.17 3.26 0.00 5.71 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 E 8.48 4.52 0.00 1.97 1.90 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 2.25 2.21 0.00 63 K 7.97 4.58 0.00 1.68 1.58 0.00 1.80 0.00 0.00 1.72 0.00 0.00 3.03 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.29 1.44 7.81 64 E 8.61 4.07 0.00 1.97 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 2.29 2.28 0.00 65 E 8.37 4.22 0.00 1.81 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 2.05 2.06 0.00 66 E 9.31 4.21 0.00 1.16 1.57 0.00 0.00 0.00 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 2.30 0.00 67 I 8.33 3.74 2.12 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.96 0.89 0.00 0.00 68 W 8.20 4.98 0.00 3.51 3.22 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 69 E 6.92 2.92 0.00 1.45 1.12 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 0.00 1.47 1.47 0.00 70 L 7.43 3.74 0.00 1.60 1.74 0.90 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 71 N 8.27 4.45 0.00 3.12 2.99 0.00 0.00 7.07 6.35 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 72 T 8.26 4.03 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 1.63 0.00 0.00 73 F 8.23 4.25 0.00 2.78 3.10 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 0.00 0.00 0.00 0.00 74 A 8.18 3.97 1.45 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 0.00 0.00 75 T 8.23 3.87 4.55 0.00 0.00 0.00 0.00 0.00 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 76 C 8.54 4.58 0.00 3.55 3.44 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 77 E 8.37 4.11 0.00 1.79 1.93 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 1.71 1.83 0.00 78 C 8.59 4.63 0.00 3.26 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 79 L 8.48 3.92 0.00 1.87 1.23 0.48 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 80 A 8.22 5.23 1.60 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 0.00 0.00 81 W 8.62 4.41 0.00 3.33 3.43 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 82 R 7.94 4.33 0.00 1.72 1.71 0.00 3.02 0.00 0.00 2.37 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.39 0.00 83 G 7.91 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 84 V 8.00 3.66 1.93 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 0.47 0.00 0.00 0.45 0.00 0.00 85 W 7.89 4.99 0.00 3.64 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 86 T 8.56 4.83 4.22 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 1.26 0.00 0.00 87 A 8.22 3.59 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 88 E 7.94 3.81 0.00 1.92 1.95 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 2.35 2.30 0.00 89 E 7.78 3.93 0.00 2.12 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 2.35 2.31 0.00 90 R 7.02 2.96 0.00 0.67 1.25 0.00 2.45 0.00 0.00 2.64 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.77 0.00 91 R 7.71 3.61 0.00 1.85 1.86 0.00 3.32 0.00 0.00 3.03 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.67 0.00 92 R 7.77 3.79 0.00 1.78 1.99 0.00 3.29 0.00 0.00 3.24 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.77 0.00 93 K 7.88 4.12 0.00 2.04 1.90 0.00 1.88 0.00 0.00 1.87 0.00 0.00 3.10 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.51 1.62 7.81 94 Q 8.42 4.29 0.00 1.81 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.74 0.00 0.00 0.00 0.00 0.00 2.15 2.12 0.00 95 N 8.55 5.01 0.00 2.72 2.89 0.00 0.00 6.78 7.70 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 96 C 7.47 4.13 0.00 3.00 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 97 D 8.15 4.42 0.00 2.75 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 98 V 7.12 3.64 2.17 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 0.81 0.00 0.00 1.15 0.00 0.00 99 G 8.18 4.10 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 Q 8.86 4.04 0.00 2.21 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.86 0.00 0.00 0.00 0.00 0.00 2.48 2.61 0.00 101 T 7.90 3.90 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 1.25 0.00 0.00 102 V 7.81 3.63 2.34 0.00 0.00 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 0.00 0.00 0.98 0.00 0.00 103 Y 8.44 4.20 0.00 3.25 3.20 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 0.00 104 L 7.70 4.49 0.00 1.63 1.69 1.01 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 105 G 8.26 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 0.00 106 M 7.27 4.59 0.00 2.11 2.21 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.68 0.00 107 P 0.00 4.56 0.00 2.48 2.16 0.00 3.77 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.19 0.00 108 Y 8.73 4.18 0.00 2.98 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 0.00 109 Y 8.29 4.48 0.00 2.98 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 0.00 110 G 8.60 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 0.00 0.00 0.00 111 R 8.18 4.13 0.00 2.08 2.06 0.00 3.29 0.00 0.00 3.46 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.94 0.00 112 W 8.47 4.19 0.00 3.86 3.60 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 0.00 113 L 8.67 4.20 0.00 2.16 2.05 1.06 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 114 L 8.22 4.06 0.00 1.98 1.78 0.98 0.62 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 0.00 115 T 8.38 4.03 4.54 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 1.43 0.00 0.00 116 A 8.22 3.94 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 0.00 117 A 8.13 4.02 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 0.00 118 R 8.17 3.86 0.00 2.13 2.15 0.00 3.18 0.00 0.00 3.13 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.96 0.00 119 I 7.89 3.84 1.63 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.98 0.24 0.00 0.00 120 L 7.48 4.10 0.00 1.93 1.73 0.89 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 121 V 7.42 3.95 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 1.38 0.00 0.00 0.92 0.00 0.00 122 D 8.34 4.37 0.00 2.73 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 0.00 123 K 7.69 4.23 0.00 1.84 1.28 0.00 2.12 0.00 0.00 1.84 0.00 0.00 3.09 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.37 1.48 7.81 124 Q 7.78 3.44 0.00 1.95 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.42 7.03 0.00 0.00 0.00 0.00 0.00 2.22 2.20 0.00 125 F 8.04 4.46 0.00 3.16 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 0.00 126 V 7.37 4.70 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 0.85 0.00 0.00 0.97 0.00 0.00 127 T 8.86 4.29 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 1.19 0.00 0.00 128 L 8.30 3.89 0.00 1.71 1.62 0.84 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 129 T 7.78 3.84 4.22 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 1.21 0.00 0.00 130 E 8.16 3.96 0.00 2.19 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 0.00 2.33 2.31 0.00 131 L 7.79 3.93 0.00 1.76 1.80 0.93 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 132 H 8.49 4.28 0.00 3.33 3.30 0.00 5.69 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 0.00 133 N 8.57 4.36 0.00 2.90 2.87 0.00 0.00 6.68 7.39 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 0.00 134 K 8.27 4.06 0.00 2.00 1.98 0.00 1.66 0.00 0.00 1.65 0.00 0.00 3.04 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.44 1.53 7.81 135 I 7.86 3.67 2.04 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 1.40 0.88 0.89 0.00 0.00 136 V 7.75 3.59 2.27 0.00 0.00 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 1.00 0.00 0.00 137 E 8.25 3.96 0.00 2.29 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 0.00 2.33 2.53 0.00 138 M 8.34 4.10 0.00 2.01 2.21 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.96 0.00 139 R 8.08 3.95 0.00 2.01 1.96 0.00 3.10 0.00 0.00 3.14 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.78 0.00 140 E 8.43 3.96 0.00 2.15 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 0.00 2.33 2.56 0.00 141 R 8.41 3.77 0.00 1.99 2.15 0.00 3.12 0.00 0.00 3.12 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.66 0.00 142 V 7.71 3.63 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 0.87 0.00 0.00 1.00 0.00 0.00 143 A 8.15 4.16 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 0.00 144 S 8.58 4.34 0.00 3.99 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 0.00 145 G 7.92 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 0.00 146 Q 7.90 4.30 0.00 2.14 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.47 0.00 0.00 0.00 0.00 0.00 2.40 2.31 0.00 147 G 9.04 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 0.00 148 L 9.18 4.53 0.00 1.59 1.59 1.16 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 149 G 7.90 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 150 E 8.34 4.30 0.00 1.92 1.91 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 1.81 1.61 0.00 151 Y 7.65 4.59 0.00 3.25 2.98 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 0.00 152 L 7.35 4.53 0.00 1.74 1.52 0.96 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 0.00 153 P 0.00 4.69 0.00 2.26 2.16 0.00 3.78 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 2.08 2.00 0.00 154 P 0.00 4.53 0.00 2.07 2.02 0.00 3.71 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.09 0.00