NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 V 4.0426 8.0393 114.0489 61.2449 33.0789 176.5399 2 H 4.4359 8.3406 116.2271 55.2341 25.5405 171.9915 3 L 4.8320 7.5085 125.2620 53.3832 45.9078 178.7057 4 T 4.2758 8.5726 114.0397 60.4838 71.2283 174.1175 5 P 4.2587 0.0000 0.0000 65.5712 31.2493 178.7779 6 E 4.0472 8.0648 116.0612 59.0732 29.7193 179.0130 7 E 3.8833 7.8097 119.8352 59.1001 29.5880 178.9195 8 K 3.7381 7.8234 118.5356 60.0154 32.1246 179.5321 9 S 4.2611 8.1586 114.6446 61.3022 62.7239 176.7892 10 A 3.9642 7.9892 123.6555 55.0238 18.1005 179.7151 11 V 3.3909 8.1307 117.3759 66.4893 31.4600 178.4423 12 T 3.9866 8.4420 109.6107 64.5127 68.3271 176.3273 13 A 3.9918 8.1527 123.2643 55.0874 18.7885 179.0784 14 L 3.8943 7.9535 118.6993 57.9696 42.1204 178.9170 15 W 4.3246 8.8634 128.5878 60.2004 30.3852 177.8041 16 G 3.7854 7.9933 104.3228 46.3507 0.0000 174.1375 17 K 4.4392 7.7161 119.1470 56.1038 32.5107 176.2716 18 V 3.8858 7.3457 120.0049 61.6494 32.3763 176.0945 19 N 4.5164 8.2007 125.3416 52.1754 38.5096 175.1866 20 V 3.4882 8.1214 127.7666 66.0900 31.6001 177.2728 21 D 4.3023 8.0108 117.8502 57.2057 40.8202 178.1425 22 E 3.8160 8.4994 119.7761 59.4116 29.6878 179.0147 23 V 3.5383 7.6886 118.4203 65.6383 31.4356 178.0543 24 G 3.7539 8.2984 105.8499 47.9680 0.0000 175.9597 25 G 3.5636 7.9853 108.7410 47.1685 0.0000 175.4607 26 E 3.8916 8.1774 121.5010 58.8875 29.5583 178.8702 27 A 3.9313 8.5304 121.2622 54.9471 18.4654 179.3440 28 L 3.9433 8.1024 119.1273 58.3106 42.2101 179.3852 29 G 3.5876 8.3603 105.9956 47.9612 0.0000 175.8827 30 R 3.9081 8.1170 120.3146 58.5574 29.9673 178.6771 31 L 4.0284 8.0274 120.5654 58.4619 41.9516 179.2994 32 L 4.0421 8.0256 119.8000 56.7000 41.2123 179.6273 33 V 3.5947 7.3919 117.7920 65.5740 31.6964 177.8333 34 V 3.5698 8.1083 117.3293 64.0117 32.8687 175.6494 35 Y 3.8314 7.2013 116.2805 53.9167 37.7933 174.0524 36 P 4.5430 0.0000 0.0000 64.6527 31.4016 178.4353 37 W 4.3591 7.7692 116.2015 59.3529 27.9725 177.6716 38 T 4.2714 7.8947 110.3164 63.5873 68.2016 176.1202 39 Q 4.4837 8.1601 121.5221 58.2392 28.4716 177.9731 40 R 3.6814 7.6042 116.3906 58.5908 29.1647 177.2661 41 F 4.3416 7.4776 114.2756 57.3498 39.6240 175.8101 42 F 4.5618 7.8153 120.1315 56.8695 39.6284 177.1055 43 E 4.0291 8.3707 123.6687 59.3849 29.3081 178.6529 44 S 4.5973 8.0648 110.6955 58.6329 63.3970 174.6017 45 F 4.7334 8.4062 120.1239 58.4219 40.3462 175.8334 46 G 4.0244 7.2997 104.9365 44.0066 0.0000 176.4355 47 D 4.5626 8.7612 128.9068 53.8394 40.5183 175.1180 48 L 4.9352 8.2295 128.4058 54.5635 43.0362 178.2115 49 S 4.3403 8.1345 115.9950 60.2259 63.6052 174.2108 50 T 4.7480 7.4409 110.4400 58.3572 73.0245 172.8675 51 P 4.1862 0.0000 0.0000 65.9147 31.2469 178.7849 52 D 4.3287 8.0947 116.9773 57.2488 40.4956 178.6044 53 A 4.0166 8.2768 121.0637 54.8262 18.7770 179.6174 54 V 3.6673 8.0350 117.0050 66.6251 31.4883 178.2163 55 M 4.0197 8.2137 117.5030 58.1811 31.8923 177.8739 56 G 3.7628 7.6475 105.1838 46.0763 0.0000 173.7044 57 N 4.4873 7.9459 120.4503 52.5522 39.8557 173.7428 58 P 4.2818 0.0000 0.0000 65.7839 31.3045 178.7074 59 K 3.6505 8.5454 119.0248 58.8632 31.7771 179.4426 60 V 3.7280 7.9565 118.1134 66.0099 31.5363 177.9308 61 K 3.8334 8.0599 117.9790 59.6312 31.9823 179.2094 62 A 3.9710 8.2521 121.1702 55.1130 18.1418 179.2889 63 H 4.3080 8.5924 117.5022 59.3061 30.0046 177.3851 64 G 3.8316 8.8781 108.8728 48.2050 0.0000 175.6830 65 K 4.0329 8.2468 121.1595 58.7443 32.1252 179.4785 66 K 3.9666 7.9609 119.5416 59.4246 32.1917 179.0726 67 V 3.6436 7.9735 118.7051 66.2068 31.5576 178.0385 68 L 4.4099 8.3067 118.3939 57.2169 41.4126 179.6698 69 G 3.8151 8.2796 106.1132 47.6435 0.0000 175.7900 70 A 4.2000 7.9651 122.1096 54.7138 18.6124 179.3364 71 F 4.3354 8.5307 119.3693 61.5126 39.6943 177.0130 72 S 3.9251 8.9116 113.2966 61.9256 62.1028 176.1630 73 D 4.5498 8.7786 121.4096 56.9619 40.5852 178.9870 74 G 3.5157 8.3262 107.0373 47.3563 0.0000 175.2516 75 L 3.9490 7.3053 118.4804 55.9455 41.6355 178.0162 76 A 4.3591 7.3165 119.9564 52.3583 19.7447 176.5698 77 H 4.9072 7.7830 114.8880 54.9916 29.9622 175.8164 78 L 3.8944 8.0160 120.6839 57.8243 41.7650 178.5802 79 D 4.5032 7.9261 116.1693 55.9029 41.7911 176.2045 80 N 4.9853 8.1048 118.2375 51.5383 39.9246 175.0808 81 L 4.1376 7.7731 121.8124 57.6426 42.2795 179.6045 82 K 4.0087 8.0123 118.3606 59.3443 31.8778 179.3706 83 G 3.5704 7.7675 104.0061 48.2094 0.0000 175.4394 84 T 3.7768 7.6904 117.1643 65.5272 68.6713 175.7642 85 F 4.7187 8.0439 116.7562 56.9225 39.5496 177.2945 86 A 4.1047 7.9827 122.4533 55.9765 18.1590 180.1273 87 T 4.0501 7.8746 113.3763 66.7402 68.5041 176.9408 88 L 4.1822 7.9726 120.5335 57.6092 41.6891 179.3580 89 S 4.2791 8.3183 113.5291 61.3291 62.2747 175.9964 90 E 3.8635 8.1346 121.3122 59.2425 29.1559 178.9971 91 L 3.8903 8.4017 120.5529 58.7115 42.1361 178.7930 92 H 4.1278 8.6167 116.3213 58.8650 28.2956 177.1845 93 C 3.5202 7.7501 120.5280 62.2184 31.2085 175.3718 94 D 4.3582 8.1643 120.0971 56.2464 40.5712 177.5966 95 K 4.2338 7.6820 116.8641 57.8757 33.3254 177.5550 96 L 4.1397 7.9775 116.9413 55.1318 42.0383 176.3731 97 H 4.0984 7.1797 114.4564 56.7354 26.4594 175.0879 98 V 4.1844 8.1763 119.7185 61.0663 32.0622 174.7982 99 D 4.3716 8.9274 127.4169 53.9961 41.4589 175.1095 100 P 3.3451 0.0000 0.0000 65.1127 31.1510 177.9067 101 E 3.8172 8.1849 118.4529 59.4244 29.3963 178.5936 102 N 4.3198 8.0542 116.6301 56.1158 38.4515 177.3218 103 F 4.4650 7.3782 119.3287 60.2296 38.8769 178.0146 104 R 3.9892 7.7530 117.6730 59.0593 29.9542 178.7834 105 L 3.7878 7.7902 118.8147 57.5988 41.6019 179.2938 106 L 4.0562 8.1307 120.4426 58.1499 42.0721 179.0195 107 G 3.8226 8.3001 105.7195 48.2060 0.0000 175.3204 108 N 4.5078 8.2823 118.6140 55.9385 38.6090 177.7994 109 V 3.7152 8.1860 119.9381 65.4484 31.5782 177.9664 110 L 3.8444 8.2910 120.8885 58.0771 41.9205 178.9589 111 V 3.5546 7.8164 118.1702 66.3192 31.3791 177.7241 112 C 4.0683 8.0263 116.3270 62.7734 27.8924 176.3717 113 V 3.5374 7.6398 119.7999 65.9881 31.0909 178.1600 114 L 3.9094 8.2260 118.8546 57.5757 41.2240 179.3854 115 A 3.7558 7.3731 120.9385 54.9984 18.0015 179.2667 116 H 4.1122 8.0776 116.2061 59.6643 30.0611 176.9234 117 H 3.7208 8.0063 116.7094 58.6773 28.9820 177.3148 118 F 4.5150 8.5818 118.5496 56.7502 39.5243 177.3116 119 G 3.8713 9.0957 108.4519 46.0597 0.0000 177.5305 120 K 4.1370 8.9199 122.6356 59.4218 32.3201 177.5368 121 E 4.1259 8.1718 118.6402 57.5809 30.0081 176.8458 122 F 4.5449 8.1837 122.7889 57.6547 38.0667 174.9940 123 T 4.2764 7.1653 116.0698 60.0155 71.5978 173.8616 124 P 4.1782 0.0000 0.0000 65.1683 31.3799 177.1863 125 P 4.1705 0.0000 0.0000 65.4544 31.2330 178.6686 126 V 3.4956 7.2172 115.8359 65.9957 31.3847 177.4270 127 Q 3.7681 7.8733 119.2654 59.3411 28.7893 178.2825 128 A 3.9739 8.1017 121.3013 55.4694 18.3311 179.5694 129 A 3.8862 7.9094 118.6792 55.5578 18.4602 179.5523 130 Y 3.7991 8.4844 115.6129 61.1086 37.9040 178.7234 131 Q 4.2020 8.9975 119.5932 58.8968 28.7760 178.9836 132 K 4.0271 8.1580 119.6556 59.2568 32.0379 179.6198 133 V 3.5187 7.7252 118.5280 66.2087 31.5659 178.5535 134 V 3.9142 8.4861 111.7381 63.7439 31.3361 178.2395 135 A 4.2702 8.1672 121.1377 54.5094 18.3009 179.8655 136 G 3.4828 8.2604 104.6868 47.8127 0.0000 176.2448 137 V 3.2616 7.9342 120.5624 65.6582 31.5109 177.9160 138 A 3.9718 7.9743 120.4734 55.3484 17.9308 179.4308 139 N 4.3129 8.0971 113.9986 56.3680 38.8319 177.3162 140 A 4.1547 8.1606 122.3632 55.0657 18.2486 179.6987 141 L 3.8705 7.8546 116.6604 56.9859 41.9365 178.4750 142 A 4.4889 7.6869 119.1321 52.6481 18.9008 178.6047 143 H 4.3413 8.0451 114.2729 58.0351 28.6936 176.3534 144 K 4.3717 7.8752 118.3463 56.1256 32.1790 176.4284 145 Y 4.2342 8.0053 117.9595 58.5177 38.3745 175.8327 146 H 4.4535 8.4262 117.8510 56.1886 28.2308 173.3012 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 1 V 8.04 4.04 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 0.84 0.00 0.00 0.93 0.00 0.00 2 H 8.34 4.44 0.00 3.29 3.32 0.00 5.48 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 L 7.51 4.83 0.00 1.56 1.52 0.87 0.95 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 4 T 8.57 4.28 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 1.24 0.00 0.00 5 P 0.00 4.26 0.00 2.16 2.12 0.00 3.57 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 2.09 2.12 0.00 6 E 8.06 4.05 0.00 2.14 2.19 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 2.33 2.32 0.00 7 E 7.81 3.88 0.00 2.17 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 2.27 2.30 0.00 8 K 7.82 3.74 0.00 1.99 1.83 0.00 1.63 0.00 0.00 1.61 0.00 0.00 2.89 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.40 1.44 7.81 9 S 8.16 4.26 0.00 3.87 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 10 A 7.99 3.96 1.36 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 0.00 0.00 0.00 11 V 8.13 3.39 2.02 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 0.71 0.00 0.00 0.48 0.00 0.00 12 T 8.44 3.99 4.30 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 1.27 0.00 0.00 13 A 8.15 3.99 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 14 L 7.95 3.89 0.00 2.06 1.79 0.54 -0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 15 W 8.86 4.32 0.00 3.77 3.30 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 16 G 7.99 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 17 K 7.72 4.44 0.00 2.09 2.07 0.00 1.77 0.00 0.00 1.80 0.00 0.00 3.17 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.48 1.56 7.81 18 V 7.35 3.89 1.07 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 -0.12 0.00 0.00 0.77 0.00 0.00 19 N 8.20 4.52 0.00 2.71 2.73 0.00 0.00 6.82 7.71 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 20 V 8.12 3.49 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.95 0.00 0.00 21 D 8.01 4.30 0.00 2.82 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 E 8.50 3.82 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 2.26 2.28 0.00 23 V 7.69 3.54 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 0.84 0.00 0.00 0.64 0.00 0.00 24 G 8.30 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 25 G 7.99 3.56 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 0.00 26 E 8.18 3.89 0.00 2.09 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 2.25 2.33 0.00 27 A 8.53 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 28 L 8.10 3.94 0.00 1.73 1.62 0.93 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 29 G 8.36 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.12 3.91 0.00 1.94 1.92 0.00 3.09 0.00 0.00 3.02 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.63 0.00 31 L 8.03 4.03 0.00 1.86 1.94 1.02 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 32 L 8.03 4.04 0.00 1.86 1.66 1.02 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 33 V 7.39 3.59 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 0.71 0.00 0.00 0.93 0.00 0.00 34 V 8.11 3.57 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.12 0.00 0.00 0.75 0.00 0.00 35 Y 7.20 3.83 0.00 2.58 1.43 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 36 P 0.00 4.54 0.00 2.33 2.33 0.00 3.71 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 2.24 1.94 0.00 37 W 7.77 4.36 0.00 3.57 3.49 0.00 0.00 0.00 0.00 0.00 0.00 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 7.89 4.27 4.46 0.00 0.00 0.00 0.00 0.00 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 39 Q 8.16 4.48 0.00 2.34 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.74 0.00 0.00 0.00 0.00 0.00 2.43 2.48 0.00 40 R 7.60 3.68 0.00 1.62 2.02 0.00 2.78 0.00 0.00 2.39 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.59 0.50 0.00 41 F 7.48 4.34 0.00 1.51 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 F 7.82 4.56 0.00 2.78 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 0.00 0.00 0.00 43 E 8.37 4.03 0.00 2.02 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 0.00 2.41 2.29 0.00 44 S 8.06 4.60 0.00 4.10 4.07 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 0.00 0.00 0.00 45 F 8.41 4.73 0.00 3.10 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 46 G 7.30 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 0.00 0.00 0.00 47 D 8.76 4.56 0.00 2.66 2.64 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.23 4.94 0.00 1.65 1.61 0.97 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 49 S 8.13 4.34 0.00 3.95 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 T 7.44 4.75 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 51 P 0.00 4.19 0.00 2.15 2.10 0.00 3.58 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 2.08 2.14 0.00 52 D 8.09 4.33 0.00 2.67 2.71 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 0.00 0.00 0.00 0.00 53 A 8.28 4.02 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 54 V 8.03 3.67 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 1.05 0.00 0.00 0.97 0.00 0.00 55 M 8.21 4.02 0.00 2.00 2.10 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 2.60 2.82 0.00 56 G 7.65 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 N 7.95 4.49 0.00 3.04 2.89 0.00 0.00 6.84 7.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 P 0.00 4.28 0.00 2.25 2.26 0.00 3.73 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.03 0.00 59 K 8.55 3.65 0.00 1.80 0.77 0.00 1.67 0.00 0.00 1.51 0.00 0.00 2.82 0.00 0.00 3.00 0.00 0.00 0.00 0.00 0.98 1.22 7.81 60 V 7.96 3.73 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 1.03 0.00 0.00 1.04 0.00 0.00 61 K 8.06 3.83 0.00 1.98 1.82 0.00 1.82 0.00 0.00 1.62 0.00 0.00 2.93 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.44 1.52 7.81 62 A 8.25 3.97 1.27 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 0.00 0.00 0.00 0.00 0.00 0.00 63 H 8.59 4.31 0.00 3.57 3.45 0.00 5.82 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 G 8.88 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 65 K 8.25 4.03 0.00 1.83 2.00 0.00 1.68 0.00 0.00 1.94 0.00 0.00 2.91 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.48 1.67 7.81 66 K 7.96 3.97 0.00 2.06 1.94 0.00 1.81 0.00 0.00 1.68 0.00 0.00 2.96 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.52 1.51 7.81 67 V 7.97 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 1.02 0.00 0.00 0.86 0.00 0.00 68 L 8.31 4.41 0.00 2.00 1.86 1.18 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 69 G 8.28 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 70 A 7.97 4.20 1.55 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 0.00 0.00 0.00 71 F 8.53 4.34 0.00 3.14 3.26 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 72 S 8.91 3.93 0.00 4.67 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 73 D 8.78 4.55 0.00 2.68 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 74 G 8.33 3.52 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 75 L 7.31 3.95 0.00 1.42 1.42 -0.47 -0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 76 A 7.32 4.36 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 H 7.78 4.91 0.00 3.12 3.16 0.00 5.82 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 L 8.02 3.89 0.00 1.54 1.65 0.77 0.92 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 79 D 7.93 4.50 0.00 2.62 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 N 8.10 4.99 0.00 2.71 2.61 0.00 0.00 7.09 7.41 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 81 L 7.77 4.14 0.00 1.75 1.86 0.92 0.81 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 82 K 8.01 4.01 0.00 1.70 1.56 0.00 1.48 0.00 0.00 1.54 0.00 0.00 2.89 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.39 1.42 7.81 83 G 7.77 3.57 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 0.00 0.00 0.00 0.00 0.00 0.00 84 T 7.69 3.78 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 0.34 0.00 0.00 85 F 8.04 4.72 0.00 3.25 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 86 A 7.98 4.10 1.44 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 0.00 0.00 87 T 7.87 4.05 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 88 L 7.97 4.18 0.00 2.03 1.86 1.17 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 89 S 8.32 4.28 0.00 4.15 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 90 E 8.13 3.86 0.00 2.26 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 2.29 2.49 0.00 91 L 8.40 3.89 0.00 1.80 1.87 0.90 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 92 H 8.62 4.13 0.00 3.57 3.81 0.00 5.86 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 93 C 7.75 3.52 0.00 1.23 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 94 D 8.16 4.36 0.00 2.71 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 95 K 7.68 4.23 0.00 1.78 1.80 0.00 1.74 0.00 0.00 1.68 0.00 0.00 2.97 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.32 1.35 7.81 96 L 7.98 4.14 0.00 1.67 1.63 0.74 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 97 H 7.18 4.10 0.00 3.36 3.45 0.00 5.64 0.00 0.00 0.00 0.00 8.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 8.18 4.18 2.23 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 0.31 0.00 0.00 0.42 0.00 0.00 99 D 8.93 4.37 0.00 2.79 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 P 0.00 3.35 0.00 1.93 1.87 0.00 3.40 0.00 0.00 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.46 0.00 101 E 8.18 3.82 0.00 2.03 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 2.31 2.42 0.00 102 N 8.05 4.32 0.00 2.41 2.69 0.00 0.00 6.97 8.66 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 0.00 103 F 7.38 4.46 0.00 3.04 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 0.00 104 R 7.75 3.99 0.00 1.99 1.96 0.00 3.29 0.00 0.00 3.35 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.64 0.00 105 L 7.79 3.79 0.00 1.73 1.37 0.70 -0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 106 L 8.13 4.06 0.00 1.82 1.74 0.93 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 107 G 8.30 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 0.00 108 N 8.28 4.51 0.00 2.96 2.95 0.00 0.00 6.66 7.76 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 0.00 109 V 8.19 3.72 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 1.02 0.00 0.00 1.18 0.00 0.00 110 L 8.29 3.84 0.00 1.75 1.81 0.87 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 111 V 7.82 3.55 2.33 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 1.37 0.00 0.00 1.17 0.00 0.00 112 C 8.03 4.07 0.00 3.19 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 V 7.64 3.54 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 0.96 0.00 0.00 0.87 0.00 0.00 114 L 8.23 3.91 0.00 0.68 1.36 0.55 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 115 A 7.37 3.76 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 0.00 116 H 8.08 4.11 0.00 3.16 3.44 0.00 5.79 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 H 8.01 3.72 0.00 3.10 2.46 0.00 5.70 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 F 8.58 4.51 0.00 3.24 3.18 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 G 9.10 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 0.00 120 K 8.92 4.14 0.00 1.92 2.01 0.00 1.61 0.00 0.00 1.66 0.00 0.00 2.99 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.45 1.49 7.81 121 E 8.17 4.13 0.00 2.10 2.43 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 2.38 2.29 0.00 122 F 8.18 4.54 0.00 3.12 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 0.00 123 T 7.17 4.28 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 1.28 0.00 0.00 124 P 0.00 4.18 0.00 2.16 2.13 0.00 3.57 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 2.11 2.17 0.00 125 P 0.00 4.17 0.00 2.11 2.06 0.00 3.47 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.11 0.00 126 V 7.22 3.50 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 0.98 0.00 0.00 0.89 0.00 0.00 127 Q 7.87 3.77 0.00 1.90 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.49 0.00 0.00 0.00 0.00 0.00 2.45 2.63 0.00 128 A 8.10 3.97 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 0.00 129 A 7.91 3.89 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 0.00 130 Y 8.48 3.80 0.00 3.48 3.32 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 0.00 131 Q 9.00 4.20 0.00 2.21 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.81 0.00 0.00 0.00 0.00 0.00 2.70 2.63 0.00 132 K 8.16 4.03 0.00 1.88 1.80 0.00 1.53 0.00 0.00 1.25 0.00 0.00 2.80 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.37 1.63 7.81 133 V 7.73 3.52 2.02 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 0.80 0.00 0.00 0.75 0.00 0.00 134 V 8.49 3.91 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 1.11 0.00 0.00 1.16 0.00 0.00 135 A 8.17 4.27 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 0.00 136 G 8.26 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 137 V 7.93 3.26 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 0.66 0.00 0.00 0.67 0.00 0.00 138 A 7.97 3.97 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 N 8.10 4.31 0.00 2.84 2.88 0.00 0.00 7.02 6.95 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 0.00 140 A 8.16 4.15 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 0.00 141 L 7.85 3.87 0.00 0.80 0.69 -0.06 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 142 A 7.69 4.49 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 0.00 143 H 8.05 4.34 0.00 3.31 3.68 0.00 5.55 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 K 7.88 4.37 0.00 1.74 1.83 0.00 1.45 0.00 0.00 1.55 0.00 0.00 2.92 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.11 1.62 7.81 145 Y 8.01 4.23 0.00 3.07 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 146 H 8.43 4.45 0.00 3.22 3.26 0.00 5.75 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00