NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 P 4.3777 0.0000 0.0000 61.7238 33.5065 176.3173 6 K 4.6577 7.7785 115.0858 52.7588 34.7362 174.2763 7 I 4.8052 9.1268 117.2597 59.4059 41.4788 174.0818 8 S 5.4863 9.4874 119.4280 56.9073 66.0841 173.3425 9 V 4.9868 9.1638 123.4836 60.9517 34.7515 173.9006 10 A 4.7449 8.5371 128.7888 49.9495 21.9962 174.7326 11 F 4.8718 8.7758 120.9215 55.7981 41.5223 175.1045 12 I 5.6854 9.3245 122.8245 58.8747 41.5065 174.4968 13 C 5.0079 8.2810 118.9525 57.1718 33.2490 173.8254 14 L 3.9102 8.9767 119.5324 58.1355 42.2831 179.3060 15 G 4.0606 8.1983 103.3978 44.2268 0.0000 172.2942 16 N 4.5701 8.1201 115.7736 53.6408 37.6813 174.2005 17 F 4.8402 8.2351 117.8650 59.3305 42.6674 175.0271 18 C 4.5896 8.0964 114.9130 61.0318 29.9515 176.0925 19 R 3.9995 7.9398 118.0542 59.2170 30.1924 179.1398 20 S 4.0891 7.9732 113.4473 60.9848 63.0539 174.4750 21 P 4.0532 0.0000 0.0000 65.3019 30.9875 178.2363 22 M 3.9405 7.4590 115.6057 58.5258 32.1899 178.1406 23 A 3.5916 7.8293 121.0213 54.8106 18.3603 179.2554 24 E 3.8102 8.1783 117.8535 59.2492 29.7476 178.8912 25 A 3.9301 7.8875 120.7000 55.2991 18.5049 179.6931 26 I 3.4944 7.6868 118.3991 64.3537 37.1267 178.4891 27 F 3.9934 8.1096 121.4681 61.1778 39.2293 177.2281 28 K 3.7654 8.2116 118.1856 59.6463 31.7605 178.7239 29 H 4.0726 8.1303 118.3881 59.4266 29.8050 177.2605 30 E 3.8225 8.1347 120.3489 59.0835 29.2204 179.3881 31 V 3.3482 7.3608 118.3500 66.0136 31.4746 177.6169 32 E 3.8373 8.0842 118.1319 59.3239 29.1035 179.2841 33 K 3.8199 7.7969 117.7200 59.5133 32.3894 178.1619 34 A 4.2861 7.8204 116.9751 51.0280 19.7191 176.3743 35 N 4.8783 8.4030 113.4079 54.2804 36.3751 174.7451 36 L 4.7251 7.8397 115.2323 54.2841 43.5234 178.7266 37 E 3.8383 8.3724 120.3811 59.6446 29.4643 178.9843 38 N 4.5420 8.1210 114.1925 55.0538 37.7890 175.9608 39 R 4.1074 8.8507 118.3622 56.9700 30.6448 175.8914 40 F 5.2703 7.9132 116.0295 55.7910 41.3306 173.5960 41 N 4.8728 9.0367 120.9151 54.5646 39.8392 174.5277 42 K 4.8396 8.2594 117.5178 54.5815 36.1836 175.1291 43 I 5.0069 8.4701 123.2495 60.0946 40.3555 173.8021 44 D 5.0526 9.0301 126.7768 52.5019 45.6672 174.6922 45 S 5.0034 7.7419 112.3185 57.2676 66.0773 173.2880 46 F 5.0783 9.2640 120.1592 56.0755 44.0476 173.4327 47 G 4.8977 8.9542 106.6544 44.5281 0.0000 174.3178 48 T 4.3215 8.7128 111.1874 63.7840 69.8018 175.1455 49 S 4.7144 8.2021 116.3426 56.9714 65.3318 174.1486 50 N 4.8392 8.0974 114.5338 52.5755 37.5668 175.9202 51 Y 4.1914 7.6908 117.4770 61.1845 38.1652 176.7160 52 H 5.3763 7.8606 114.9571 54.0767 29.9842 173.3080 53 V 3.8959 7.4207 119.2447 64.3872 31.6631 176.5413 54 G 4.0510 9.2180 115.3771 45.5291 0.0000 173.6476 55 E 4.4661 8.0278 119.3897 55.5744 30.6025 176.3624 56 S 5.1248 8.2859 116.7302 56.5841 63.9203 172.6118 57 P 4.1835 0.0000 0.0000 62.0404 31.9175 175.8942 58 D 3.7354 7.4657 119.5455 54.9151 41.6133 177.6947 59 H 4.1349 8.7561 121.6152 58.9641 28.3901 177.9958 60 R 3.7843 7.6383 120.5768 58.7642 29.1016 179.1319 61 T 3.9583 7.1791 115.4105 66.4616 68.5076 176.7916 62 V 3.5635 7.6429 120.1159 66.1442 31.4907 178.0999 63 S 4.0622 8.3876 115.2058 61.7903 62.4244 176.9276 64 I 3.6529 7.6356 122.1924 64.3569 36.7435 178.2391 65 C 4.3219 8.0541 117.5182 62.9241 27.9840 176.1678 66 K 3.8615 8.2476 120.2418 59.7388 31.4484 179.0429 67 Q 3.8949 8.1051 118.5622 58.7177 28.8551 177.2556 68 H 4.6509 7.4154 114.4317 54.3590 29.2496 174.5760 69 G 3.8431 8.0682 108.5624 46.7871 0.0000 174.0292 70 V 4.2061 7.9193 119.2010 60.2443 33.2956 174.9350 71 K 4.2603 8.4570 128.2234 55.8500 32.9533 175.7685 72 I 4.4605 8.0110 124.7370 59.4012 40.7134 173.8466 73 N 4.7731 8.6129 125.8973 52.8116 40.5903 172.3175 74 H 4.9260 8.3928 124.2607 54.8953 33.7028 171.9530 75 K 4.8626 8.0151 121.9077 54.0211 35.6007 176.4111 76 G 4.0144 9.2853 112.5996 46.7289 0.0000 172.5030 77 K 5.1266 9.3413 122.5630 55.1052 36.7010 174.6060 78 Q 5.2366 8.6273 122.1152 54.1820 30.7266 175.0892 79 I 3.4454 8.4569 126.6167 61.1729 38.9279 175.1036 80 K 4.7626 8.3096 125.3085 54.3108 36.2291 177.5583 81 T 4.2486 8.5194 111.0013 64.6526 69.0309 176.6491 82 K 4.0312 8.0594 121.8070 60.1934 32.4617 178.6139 83 H 4.3306 8.1279 117.2131 58.5643 28.4336 177.3107 84 F 4.2019 8.4483 118.9884 59.2855 38.4963 176.0340 85 D 4.8153 8.0999 116.7638 54.4350 41.7229 177.1531 86 E 4.2428 8.1037 118.1083 55.9176 30.3910 175.4541 87 Y 4.7078 7.2097 115.8996 56.0344 41.2945 176.0094 88 D 4.4833 8.9620 122.6702 56.6217 42.5288 176.1936 89 Y 5.2734 8.1140 115.4238 56.1726 42.2706 174.5461 90 I 4.5323 8.8314 124.9142 59.6856 40.1330 174.7140 91 I 4.8465 8.7157 129.8882 59.5599 38.8714 176.1262 92 G 4.2101 9.4115 115.4140 44.8250 0.0000 173.8546 93 M 4.6020 8.9428 119.6496 56.8871 33.9094 175.9532 94 D 5.2942 8.6814 116.3019 50.5109 43.1689 176.0513 95 E 4.0569 8.8044 117.9874 59.5369 29.3234 179.6751 96 S 4.1548 8.2187 113.8862 61.3358 63.0041 176.3264 97 N 4.3541 8.7285 120.2163 56.3158 38.2853 177.2110 98 I 3.7524 7.5921 120.7045 64.4277 37.3066 177.8065 99 N 4.2835 8.4482 117.9152 57.0359 38.9057 176.6123 100 N 4.4012 8.0432 117.1679 56.2665 38.7163 177.4999 101 L 4.1881 8.1244 120.3975 57.8934 41.5596 179.7261 102 K 4.0344 8.2148 117.5369 59.3457 31.9890 179.2993 103 K 4.1137 7.8223 118.0251 58.8129 32.0882 178.5968 104 I 4.0887 7.3190 110.4125 60.3237 38.2039 175.7605 105 Q 2.5875 6.9652 122.9462 54.6627 29.4472 173.9029 106 P 4.1951 0.0000 0.0000 62.0795 32.0217 175.5490 107 E 4.0354 8.4883 123.9646 57.4652 30.0562 177.0557 108 G 3.9387 8.3997 113.5952 45.5683 0.0000 173.9537 109 S 4.5513 7.5417 113.5867 57.3784 64.0720 174.5823 110 K 3.9739 8.5776 123.6601 59.4997 32.1214 177.5614 111 A 4.3328 7.7997 118.9850 51.9779 19.0557 176.9371 112 K 4.4450 8.7606 121.3189 54.9233 34.1017 175.7200 113 V 4.7902 8.4420 125.5625 62.1017 32.7071 174.5963 114 C 4.9467 9.0859 124.1543 58.4434 33.7194 173.0475 115 L 4.8231 8.5146 120.4689 53.9863 42.5674 178.3203 116 F 4.9536 9.3381 125.2188 61.5971 39.4089 177.3635 117 G 3.1446 7.9237 104.0426 45.2934 0.0000 174.4267 118 D 4.3773 7.9848 120.6868 55.6511 40.8269 176.7367 119 W 4.4655 7.3936 117.7645 56.1533 29.4345 176.0095 120 N 4.8557 7.6655 117.9265 53.6589 38.9394 174.4290 121 T 4.6142 8.5136 112.7974 60.6476 70.6868 173.3769 122 N 4.8778 8.5138 117.0340 54.1581 38.8221 175.7137 123 D 4.7848 8.2611 115.4132 52.6855 40.4418 176.3458 124 G 3.9290 8.3789 107.3284 46.5603 0.0000 175.0161 125 T 3.9165 8.1294 117.1886 65.8291 68.4392 175.1611 126 V 4.6137 6.9818 111.1155 59.1307 35.5502 175.4887 127 Q 4.3713 9.1937 121.3475 56.1857 29.2964 177.2151 128 T 4.2047 8.6709 117.7158 66.5765 68.8853 174.7545 129 I 4.2725 7.6846 121.2589 60.7956 38.2825 176.7524 130 I 4.5877 8.2506 128.4113 59.2305 36.2947 175.1366 131 E 4.2198 8.5658 125.8601 55.6057 30.4930 176.3087 132 D 4.3388 8.8406 123.2404 54.3874 41.5524 174.2660 133 P 4.5206 0.0000 0.0000 62.3152 32.2662 177.0380 134 W 4.4684 8.6329 130.1876 61.2099 30.3684 176.4556 135 Y 4.1519 8.0813 111.7114 58.6135 38.5336 176.9299 136 G 4.1042 7.9426 116.0128 45.3995 0.0000 171.6700 137 D 4.9232 9.5627 122.0631 50.3700 43.0595 176.1118 138 I 3.4080 8.5125 117.7154 64.7721 37.4253 176.9864 139 Q 4.0233 8.4114 120.1442 59.2855 28.7258 178.1306 140 D 4.4777 9.1663 120.8577 57.1959 40.8370 178.7274 141 F 3.9945 8.4082 118.0317 60.4044 39.0099 177.0888 142 E 4.0128 8.6406 119.1842 59.5352 29.3551 178.3234 143 Y 4.1142 8.1829 119.5826 60.6176 38.7933 177.4163 144 N 4.2956 8.4756 117.7291 56.2673 38.5999 176.9428 145 F 3.7304 8.3243 121.8952 61.1528 39.4719 177.0462 146 K 3.9133 8.0571 119.1216 59.4892 31.8773 178.7118 147 Q 3.1854 7.6481 118.3062 58.8353 28.5186 178.8948 148 I 3.3774 7.5560 120.9911 64.3964 37.1722 178.6290 149 T 3.6148 7.5625 116.6020 66.6680 68.3748 175.9259 150 Y 3.9542 7.5279 121.1912 60.9010 38.7255 178.3189 151 F 4.4676 7.5892 118.4921 60.3703 38.7412 177.9229 152 S 4.5590 8.1942 115.4930 61.6675 62.6494 176.8910 153 K 3.9776 7.9406 120.8854 59.5638 31.7625 179.5179 154 Q 4.0140 7.9334 118.1820 58.6928 28.6087 178.5788 155 F 3.5025 8.5791 122.0282 61.2891 39.2443 177.2766 156 L 4.4315 8.2206 117.2140 57.5833 41.3960 179.2658 157 K 4.1073 8.0015 119.1272 59.0554 32.3072 178.3610 158 K 4.3579 8.3520 116.9058 57.3850 32.8079 177.8260 159 E 4.3175 8.2856 117.2119 56.4047 29.8257 176.1071 160 L 4.3165 7.6953 123.4396 54.7277 42.3291 176.0857 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 4.38 0.00 2.05 2.16 0.00 3.60 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 1.91 2.10 0.00 6 K 7.78 4.66 0.00 1.69 1.70 0.00 1.71 0.00 0.00 1.76 0.00 0.00 3.20 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.52 1.49 7.81 7 I 9.13 4.81 2.09 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 1.28 0.92 0.00 0.00 8 S 9.49 5.49 0.00 3.71 3.70 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 9 V 9.16 4.99 1.71 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 -0.43 0.00 0.00 0.88 0.00 0.00 10 A 8.54 4.74 0.38 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 11 F 8.78 4.87 0.00 2.82 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 12 I 9.32 5.69 1.89 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 1.69 0.95 0.00 0.00 13 C 8.28 5.01 0.00 2.99 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 14 L 8.98 3.91 0.00 1.86 1.75 0.99 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 15 G 8.20 4.06 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 0.00 0.00 0.00 16 N 8.12 4.57 0.00 2.89 2.93 0.00 0.00 7.04 7.02 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 17 F 8.24 4.84 0.00 2.99 2.87 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 18 C 8.10 4.59 0.00 3.10 3.04 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 19 R 7.94 4.00 0.00 1.88 1.97 0.00 3.25 0.00 0.00 3.49 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.65 0.00 20 S 7.97 4.09 0.00 4.17 4.12 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 0.00 0.00 0.00 21 P 0.00 4.05 0.00 2.11 2.01 0.00 3.68 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 2.10 2.11 0.00 22 M 7.46 3.94 0.00 2.19 2.21 0.00 0.00 0.00 0.00 0.00 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.44 0.00 23 A 7.83 3.59 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.18 3.81 0.00 2.06 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 2.29 2.35 0.00 25 A 7.89 3.93 1.33 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 0.00 0.00 26 I 7.69 3.49 1.65 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 0.74 0.56 0.59 0.00 0.00 27 F 8.11 3.99 0.00 2.94 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 28 K 8.21 3.77 0.00 2.05 1.80 0.00 1.72 0.00 0.00 1.57 0.00 0.00 2.90 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.43 1.47 7.81 29 H 8.13 4.07 0.00 3.30 3.40 0.00 5.78 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 30 E 8.13 3.82 0.00 1.76 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 2.45 2.36 0.00 31 V 7.36 3.35 1.85 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 0.90 0.00 0.00 -0.17 0.00 0.00 32 E 8.08 3.84 0.00 2.26 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 2.29 2.53 0.00 33 K 7.80 3.82 0.00 1.79 1.85 0.00 1.64 0.00 0.00 1.68 0.00 0.00 3.01 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.38 1.39 7.81 34 A 7.82 4.29 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 35 N 8.40 4.88 0.00 2.83 2.90 0.00 0.00 6.80 7.81 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 36 L 7.84 4.73 0.00 1.76 1.86 0.98 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 37 E 8.37 3.84 0.00 2.10 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 2.40 2.38 0.00 38 N 8.12 4.54 0.00 2.84 2.97 0.00 0.00 6.04 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 39 R 8.85 4.11 0.00 1.69 1.70 0.00 3.19 0.00 0.00 3.14 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.72 0.00 40 F 7.91 5.27 0.00 3.07 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 41 N 9.04 4.87 0.00 2.69 2.81 0.00 0.00 6.94 6.72 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 42 K 8.26 4.84 0.00 1.74 1.98 0.00 1.69 0.00 0.00 1.59 0.00 0.00 2.13 0.00 0.00 2.35 0.00 0.00 0.00 0.00 1.37 1.35 7.81 43 I 8.47 5.01 1.92 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.69 1.07 0.00 0.00 44 D 9.03 5.05 0.00 2.50 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 0.00 0.00 0.00 45 S 7.74 5.00 0.00 3.74 3.70 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 46 F 9.26 5.08 0.00 2.89 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 47 G 8.95 4.90 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 48 T 8.71 4.32 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 1.27 0.00 0.00 49 S 8.20 4.71 0.00 3.93 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 50 N 8.10 4.84 0.00 2.83 3.16 0.00 0.00 5.91 7.57 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 51 Y 7.69 4.19 0.00 2.90 2.78 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 52 H 7.86 5.38 0.00 3.34 3.19 0.00 6.10 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 V 7.42 3.90 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 0.80 0.00 0.00 1.00 0.00 0.00 54 G 9.22 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 55 E 8.03 4.47 0.00 2.42 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 0.00 2.40 2.34 0.00 56 S 8.29 5.12 0.00 3.91 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 57 P 0.00 4.18 0.00 1.92 1.96 0.00 3.69 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 2.00 2.09 0.00 58 D 7.47 3.74 0.00 2.28 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 59 H 8.76 4.13 0.00 3.32 3.51 0.00 5.51 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 R 7.64 3.78 0.00 0.67 0.76 0.00 2.70 0.00 0.00 2.91 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.95 0.00 61 T 7.18 3.96 4.34 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 1.27 0.00 0.00 62 V 7.64 3.56 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 1.09 0.00 0.00 0.91 0.00 0.00 63 S 8.39 4.06 0.00 3.72 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 64 I 7.64 3.65 1.94 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 1.67 1.10 0.87 0.00 0.00 65 C 8.05 4.32 0.00 3.19 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 66 K 8.25 3.86 0.00 1.91 1.84 0.00 1.65 0.00 0.00 1.55 0.00 0.00 2.88 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.45 1.61 7.81 67 Q 8.11 3.89 0.00 2.18 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 7.04 0.00 0.00 0.00 0.00 0.00 2.19 2.31 0.00 68 H 7.42 4.65 0.00 2.80 3.18 0.00 6.02 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 G 8.07 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 70 V 7.92 4.21 2.30 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 0.76 0.00 0.00 0.87 0.00 0.00 71 K 8.46 4.26 0.00 1.77 1.69 0.00 1.80 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 1.41 1.37 7.81 72 I 8.01 4.46 1.86 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.97 0.90 0.00 0.00 73 N 8.61 4.77 0.00 2.64 2.66 0.00 0.00 6.90 7.89 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 74 H 8.39 4.93 0.00 3.22 3.05 0.00 5.86 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 K 8.02 4.86 0.00 1.56 1.63 0.00 1.80 0.00 0.00 1.71 0.00 0.00 2.72 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.51 1.40 7.81 76 G 9.29 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 77 K 9.34 5.13 0.00 2.04 1.93 0.00 1.33 0.00 0.00 1.47 0.00 0.00 2.46 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.21 1.24 7.81 78 Q 8.63 5.24 0.00 2.11 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 7.02 0.00 0.00 0.00 0.00 0.00 2.27 2.60 0.00 79 I 8.46 3.45 1.71 0.00 0.00 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.50 0.94 0.00 0.00 80 K 8.31 4.76 0.00 1.45 1.53 0.00 1.72 0.00 0.00 1.87 0.00 0.00 2.94 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.52 1.28 7.81 81 T 8.52 4.25 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 1.17 0.00 0.00 82 K 8.06 4.03 0.00 1.98 2.08 0.00 1.47 0.00 0.00 1.73 0.00 0.00 3.02 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.23 1.60 7.81 83 H 8.13 4.33 0.00 3.04 3.16 0.00 5.64 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 F 8.45 4.20 0.00 3.34 3.14 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 0.00 85 D 8.10 4.82 0.00 2.81 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 86 E 8.10 4.24 0.00 1.83 1.67 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 2.23 2.54 0.00 87 Y 7.21 4.71 0.00 2.99 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 88 D 8.96 4.48 0.00 2.92 2.56 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 8.11 5.27 0.00 2.78 2.77 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.83 4.53 1.79 0.00 0.00 0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.68 0.68 0.00 0.00 91 I 8.72 4.85 1.29 0.00 0.00 0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.30 0.82 0.00 0.00 92 G 9.41 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 93 M 8.94 4.60 0.00 2.18 2.32 0.00 0.00 0.00 0.00 0.00 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.83 0.00 94 D 8.68 5.29 0.00 2.91 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 95 E 8.80 4.06 0.00 2.04 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 2.44 2.35 0.00 96 S 8.22 4.15 0.00 4.09 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 0.00 97 N 8.73 4.35 0.00 3.01 2.96 0.00 0.00 6.92 7.21 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 98 I 7.59 3.75 2.05 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 1.67 1.04 0.95 0.00 0.00 99 N 8.45 4.28 0.00 2.76 3.00 0.00 0.00 7.27 7.44 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 0.00 100 N 8.04 4.40 0.00 2.98 2.90 0.00 0.00 7.12 6.87 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 0.00 101 L 8.12 4.19 0.00 1.97 1.93 0.97 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 102 K 8.21 4.03 0.00 1.85 1.87 0.00 1.72 0.00 0.00 1.71 0.00 0.00 3.04 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.50 1.65 7.81 103 K 7.82 4.11 0.00 1.89 1.85 0.00 1.68 0.00 0.00 1.75 0.00 0.00 3.08 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.48 1.59 7.81 104 I 7.32 4.09 1.82 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.49 0.95 0.00 0.00 105 Q 6.97 2.59 0.00 1.72 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.85 0.00 0.00 0.00 0.00 0.00 2.16 1.88 0.00 106 P 0.00 4.20 0.00 2.14 1.88 0.00 3.12 0.00 0.00 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.90 0.00 107 E 8.49 4.04 0.00 1.88 1.82 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 2.25 2.22 0.00 108 G 8.40 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 0.00 109 S 7.54 4.55 0.00 4.24 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 0.00 110 K 8.58 3.97 0.00 1.70 1.90 0.00 1.97 0.00 0.00 1.69 0.00 0.00 2.96 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.56 1.38 7.81 111 A 7.80 4.33 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 0.00 112 K 8.76 4.45 0.00 1.66 1.75 0.00 1.61 0.00 0.00 1.49 0.00 0.00 2.53 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.30 1.26 7.81 113 V 8.44 4.79 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 0.88 0.00 0.00 1.19 0.00 0.00 114 C 9.09 4.95 0.00 3.11 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 0.00 115 L 8.51 4.82 0.00 1.96 1.63 0.95 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 116 F 9.34 4.95 0.00 3.35 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 0.00 117 G 7.92 3.14 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 0.00 0.00 0.00 0.00 118 D 7.98 4.38 0.00 2.21 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 0.00 0.00 0.00 0.00 119 W 7.39 4.47 0.00 3.68 3.19 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 0.00 120 N 7.67 4.86 0.00 2.60 2.75 0.00 0.00 7.04 7.21 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 0.00 121 T 8.51 4.61 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 1.40 0.00 0.00 122 N 8.51 4.88 0.00 2.77 2.90 0.00 0.00 6.70 8.06 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 0.00 123 D 8.26 4.78 0.00 2.77 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 G 8.38 3.93 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 0.00 0.00 0.00 125 T 8.13 3.92 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 0.66 0.00 0.00 126 V 6.98 4.61 1.84 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 0.33 0.00 0.00 0.60 0.00 0.00 127 Q 9.19 4.37 0.00 2.23 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.97 0.00 0.00 0.00 0.00 0.00 2.61 2.57 0.00 128 T 8.67 4.20 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 1.27 0.00 0.00 129 I 7.68 4.27 1.96 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.82 1.00 0.00 0.00 130 I 8.25 4.59 2.14 0.00 0.00 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 1.34 1.23 0.95 0.00 0.00 131 E 8.57 4.22 0.00 1.93 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 2.38 2.39 0.00 132 D 8.84 4.34 0.00 2.72 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 0.00 133 P 0.00 4.52 0.00 0.99 1.76 0.00 3.73 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 1.10 1.18 0.00 134 W 8.63 4.47 0.00 3.40 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 0.00 135 Y 8.08 4.15 0.00 3.06 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 0.00 136 G 7.94 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 0.00 137 D 9.56 4.92 0.00 2.77 2.76 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 0.00 138 I 8.51 3.41 1.83 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.39 0.91 0.00 0.00 139 Q 8.41 4.02 0.00 2.26 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.59 0.00 0.00 0.00 0.00 0.00 2.36 2.48 0.00 140 D 9.17 4.48 0.00 2.81 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 0.00 141 F 8.41 3.99 0.00 3.31 3.16 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 0.00 0.00 0.00 0.00 142 E 8.64 4.01 0.00 2.14 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 2.35 2.45 0.00 143 Y 8.18 4.11 0.00 3.14 3.12 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 0.00 0.00 0.00 144 N 8.48 4.30 0.00 2.97 2.81 0.00 0.00 6.64 8.57 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 0.00 145 F 8.32 3.73 0.00 3.23 3.14 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 0.00 146 K 8.06 3.91 0.00 1.88 1.72 0.00 1.74 0.00 0.00 1.57 0.00 0.00 2.97 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.25 1.45 7.81 147 Q 7.65 3.19 0.00 1.88 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.58 0.00 0.00 0.00 0.00 0.00 1.68 1.59 0.00 148 I 7.56 3.38 1.61 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.63 0.78 0.00 0.00 149 T 7.56 3.61 4.28 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 1.19 0.00 0.00 150 Y 7.53 3.95 0.00 2.95 2.65 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 0.00 0.00 0.00 0.00 151 F 7.59 4.47 0.00 1.54 2.28 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 0.00 152 S 8.19 4.56 0.00 4.02 4.06 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 0.00 153 K 7.94 3.98 0.00 1.85 1.78 0.00 1.64 0.00 0.00 1.62 0.00 0.00 2.93 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.42 1.55 7.81 154 Q 7.93 4.01 0.00 2.26 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.81 0.00 0.00 0.00 0.00 0.00 2.21 2.44 0.00 155 F 8.58 3.50 0.00 2.81 3.19 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 0.00 156 L 8.22 4.43 0.00 1.83 1.79 0.76 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 157 K 8.00 4.11 0.00 1.96 2.04 0.00 1.80 0.00 0.00 1.72 0.00 0.00 3.02 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.49 7.81 158 K 8.35 4.36 0.00 1.92 1.94 0.00 1.85 0.00 0.00 1.77 0.00 0.00 3.08 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.48 1.78 7.81 159 E 8.29 4.32 0.00 1.16 1.56 0.00 0.00 0.00 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 1.47 0.00 160 L 7.70 4.32 0.00 1.60 1.50 1.09 0.65 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