NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 D 4.6645 8.2227 120.4537 53.3055 41.7381 173.2916 2 E 4.8740 8.6015 119.6739 53.5573 31.8653 169.5477 3 V 4.4047 9.0190 128.9848 61.0968 34.5403 173.5165 4 A 5.0710 8.3968 128.3768 50.2693 21.1991 176.1750 5 V 4.4746 8.3245 120.9502 61.0141 34.8995 174.5908 6 K 4.8131 8.8454 127.4902 55.9539 34.1685 175.8346 7 M 4.6310 9.0240 124.5502 54.0317 33.4558 175.0098 8 L 5.1385 8.3829 124.2240 52.8065 45.1252 177.8944 9 N 4.4132 9.8170 120.8133 55.8619 39.7208 175.5751 10 S 4.8643 7.6968 111.7301 56.6404 65.6364 173.0372 11 G 4.0050 8.5068 115.2405 44.8261 0.0000 169.6965 12 P 4.3337 0.0000 0.0000 64.6115 31.3452 176.6681 13 G 4.0126 8.7258 112.1789 44.1312 0.0000 172.7382 14 G 3.9768 7.9870 104.8403 44.4649 0.0000 173.1793 15 M 4.6103 8.5455 122.6321 56.4336 32.6917 175.5112 16 M 3.1391 9.0848 123.1705 55.9514 29.4128 175.9022 17 V 4.5455 8.1081 113.6571 59.3421 36.8186 174.5818 18 F 5.2410 8.7718 120.8604 56.3879 41.0696 175.1905 19 D 4.8279 9.0845 121.8264 51.9407 43.9837 173.0525 20 P 4.8425 0.0000 0.0000 62.8518 32.2581 176.2002 21 A 4.4838 8.7112 121.5477 52.7919 20.3774 176.3808 22 L 5.0375 7.8389 116.9278 53.1534 44.6499 175.6840 23 V 4.3393 8.5831 126.3487 61.0802 34.3192 174.1348 24 R 4.9152 8.5419 126.7269 54.7183 31.5474 175.4330 25 L 4.8549 8.9604 123.3326 52.9100 46.6059 175.5211 26 K 4.8959 9.2557 119.2927 53.7846 35.1974 174.7217 27 P 4.4904 0.0000 0.0000 64.3947 31.7409 176.6612 28 G 4.0709 9.2624 111.4430 45.3888 0.0000 173.7838 29 D 4.9178 8.1269 119.4587 54.4695 42.1870 175.6030 30 S 5.3954 9.0852 114.6152 56.7898 67.0724 172.6812 31 I 4.7247 8.6822 121.1906 59.3448 40.2624 174.4805 32 K 4.8253 8.9761 128.0441 54.7850 34.3991 174.7342 33 F 4.9476 9.1948 127.4263 56.4645 40.6538 174.7042 34 L 4.9728 9.5043 125.7719 51.7878 43.4799 175.6693 35 P 4.7068 0.0000 0.0000 62.1886 28.3432 176.0224 36 T 4.0432 8.0403 120.6032 67.0681 69.1321 174.6110 37 D 4.9944 7.6756 118.8931 52.0166 43.3171 176.2709 38 K 4.1462 8.3390 123.3524 57.0835 33.0211 176.8996 39 G 3.8634 8.8451 108.0884 45.6648 0.0000 172.6953 40 H 5.1902 7.7934 115.8256 53.9868 32.7632 173.0401 41 N 5.2048 8.2738 116.2134 51.9115 41.2698 172.4302 42 V 4.9278 8.3752 117.1076 61.5744 35.0124 174.5717 43 E 5.0985 9.4607 127.7839 54.6279 33.4160 174.4149 44 T 4.0343 8.2999 123.3136 64.1072 69.5973 173.8130 45 I 4.2003 8.0263 126.1744 59.2820 38.5757 175.4741 46 K 4.0661 8.7241 128.8186 58.3164 32.3971 176.8364 47 G 3.9683 9.2991 113.3907 45.6772 0.0000 172.7121 48 M 4.9008 7.6732 117.8726 52.6098 32.2254 174.7390 49 A 4.4128 7.2570 117.9264 50.9944 22.8805 174.9774 50 P 4.3428 0.0000 0.0000 62.0459 32.1947 175.6898 51 D 4.5650 8.2885 120.0626 54.8550 39.8893 176.1879 52 G 4.0070 8.9583 110.4160 45.4231 0.0000 173.8702 53 A 4.2658 7.3784 121.9456 51.9301 18.9699 177.1199 54 D 4.6351 8.4471 121.4650 54.0764 41.7519 175.7212 55 Y 4.1651 8.4756 123.4054 57.2632 39.7562 174.6038 56 V 4.3502 8.0263 127.0486 61.1231 34.1816 174.7906 57 K 4.7747 8.4609 129.2078 56.1241 33.5567 174.9562 58 T 4.4771 8.5042 118.4744 60.7658 71.1655 174.3562 59 T 4.3425 8.1661 118.7784 62.3170 70.0213 174.9373 60 V 3.8431 8.4682 126.0663 64.6915 31.8495 176.1895 61 G 3.9528 9.0517 114.7745 45.7336 0.0000 172.9275 62 Q 4.7875 7.4755 117.2964 53.7428 31.1623 175.6298 63 E 4.5330 8.7078 120.5455 56.8411 30.5682 176.1393 64 A 4.7696 8.7915 122.1962 50.6868 23.2019 175.2829 65 V 4.8686 8.4186 119.8562 61.0224 34.4996 174.9264 66 V 4.2313 8.6301 126.7596 60.9289 34.0789 174.0896 67 K 4.6457 8.4852 129.1313 55.3300 33.9461 175.3879 68 F 4.8095 9.1545 125.1910 55.9376 41.0374 175.4824 69 D 4.8183 9.0029 122.7307 54.2143 41.3334 177.0309 70 K 4.3151 8.0718 118.5964 55.6270 32.8404 176.6645 71 E 4.3802 8.5545 122.9754 56.3768 30.4725 176.6831 72 G 3.9352 7.7722 107.2198 43.1230 0.0000 171.7656 73 V 4.7914 8.3164 120.2567 61.4784 33.3885 175.0986 74 Y 4.8012 9.3699 125.6750 56.0115 41.5131 174.7375 75 G 4.3492 8.8440 110.6119 44.3931 0.0000 172.0151 76 F 5.4839 9.2791 122.2754 55.2099 43.3297 174.1123 77 K 5.3547 9.3396 120.4942 55.3508 36.4946 174.4933 78 C 5.4484 9.3639 121.3146 57.5425 31.9905 173.6762 79 A 4.1372 9.4876 131.1789 55.0153 18.0848 177.8935 80 P 4.2806 0.0000 0.0000 65.2910 31.7384 176.7314 81 H 5.0056 7.7890 115.9865 55.5556 29.4615 175.6455 82 Y 4.2092 8.0463 123.9181 61.0725 38.7053 178.3938 83 M 3.8876 8.0101 117.7038 58.1823 32.1609 176.7953 84 M 4.2338 7.9117 116.1343 55.0339 32.2115 176.4992 85 G 4.1148 8.1962 107.1341 45.0935 0.0000 174.1609 86 M 4.5292 7.9152 121.1590 53.7836 31.9523 175.3371 87 V 5.4905 8.3678 117.1071 59.7528 36.3898 174.4356 88 A 4.9555 9.1674 122.9640 50.4847 23.3821 174.7567 89 L 5.0889 9.2745 121.1647 53.1660 45.4306 175.3241 90 V 4.8052 8.8936 126.1266 61.1471 34.2228 174.3470 91 V 4.8814 8.7585 121.5523 59.5379 34.4849 174.6383 92 V 4.4658 8.8878 126.1066 62.0275 33.6259 176.4979 93 G 3.9108 8.7914 118.1863 46.0269 0.0000 172.3315 94 D 4.8093 8.4237 117.1777 54.2118 42.5384 177.1303 95 K 4.2209 8.1293 119.9084 56.6657 32.7369 177.2919 96 R 4.8030 8.3263 121.1696 55.9122 31.6887 177.1360 97 D 4.3519 8.6566 120.3472 57.4688 40.9197 177.5263 98 N 4.6825 7.9723 113.4632 52.6965 38.2754 176.2081 99 L 3.9576 7.9420 122.3932 58.7356 42.2044 178.5117 100 E 3.8162 8.1383 118.3183 59.0338 29.4015 178.2908 101 A 3.9306 7.9037 119.1176 55.2702 18.6904 179.0481 102 A 4.3414 8.3088 120.9843 54.6863 18.2618 179.8239 103 K 3.0706 7.8788 117.2155 59.0991 32.2311 178.7897 104 S 4.2041 7.6016 113.5240 59.1890 63.2074 174.8306 105 V 3.6818 6.9479 122.4200 62.8170 31.8461 175.2910 106 Q 4.5779 8.2301 125.0287 55.1055 30.5461 174.0483 107 H 5.0031 8.1309 115.9062 53.2469 33.2087 173.4864 108 N 4.5706 8.4712 118.2108 52.4455 39.0377 175.5526 109 K 3.7807 8.6424 122.0541 59.9731 31.6205 178.3870 110 L 3.9453 7.8934 119.5486 58.5739 42.0930 178.9641 111 T 3.8766 8.4371 115.9360 66.5060 68.3269 176.5259 112 Q 4.0428 8.3746 121.8027 59.3629 28.8606 178.7366 113 K 4.0551 7.9976 118.1633 59.2418 32.0664 179.3020 114 R 4.1406 7.6498 118.0855 59.0968 30.0383 178.9233 115 L 4.0920 8.0564 118.8836 57.4087 41.6140 178.8466 116 D 4.5707 8.3885 119.6633 57.3013 40.9243 177.6253 117 P 4.3847 0.0000 0.0000 65.3894 31.2052 178.4794 118 L 3.9455 7.0336 118.6824 57.7108 41.8810 178.8371 119 F 4.1870 8.5831 117.9486 60.5386 38.9706 177.4077 120 A 4.1167 8.2830 120.3427 55.3478 17.9508 178.9104 121 Q 4.3413 7.8161 112.8014 56.9692 28.9975 176.6219 122 I 4.3331 7.6443 120.0758 61.2696 39.2380 175.7188 123 Q 4.2493 7.6347 122.3972 55.9325 28.6588 175.3047 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 D 8.22 4.66 0.00 2.79 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 2 E 8.60 4.87 0.00 2.01 1.80 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 2.11 2.31 0.00 3 V 9.02 4.40 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 0.76 0.00 0.00 0.85 0.00 0.00 4 A 8.40 5.07 1.16 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 0.00 0.00 5 V 8.32 4.47 1.54 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 1.22 0.00 0.00 0.67 0.00 0.00 6 K 8.85 4.81 0.00 1.78 1.73 0.00 1.72 0.00 0.00 1.66 0.00 0.00 2.84 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.44 1.57 7.81 7 M 9.02 4.63 0.00 1.83 2.16 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.82 2.74 0.00 8 L 8.38 5.14 0.00 1.58 1.59 0.92 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 9 N 9.82 4.41 0.00 2.67 2.84 0.00 0.00 6.32 7.61 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 10 S 7.70 4.86 0.00 3.74 3.66 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 11 G 8.51 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 12 P 0.00 4.33 0.00 2.06 2.03 0.00 3.65 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 2.32 2.09 0.00 13 G 8.73 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 14 G 7.99 3.98 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 0.00 0.00 0.00 15 M 8.55 4.61 0.00 1.98 1.97 0.00 0.00 0.00 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.48 0.00 16 M 9.08 3.14 0.00 2.03 2.01 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.54 0.00 17 V 8.11 4.55 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 0.85 0.00 0.00 0.93 0.00 0.00 18 F 8.77 5.24 0.00 2.98 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 19 D 9.08 4.83 0.00 2.78 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 20 P 0.00 4.84 0.00 2.27 2.02 0.00 3.78 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 1.93 1.93 0.00 21 A 8.71 4.48 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 22 L 7.84 5.04 0.00 1.54 1.49 0.87 0.80 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 23 V 8.58 4.34 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 0.84 0.00 0.00 0.81 0.00 0.00 24 R 8.54 4.92 0.00 1.67 1.79 0.00 3.17 0.00 0.00 3.20 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.58 0.00 25 L 8.96 4.85 0.00 1.27 1.35 0.29 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 26 K 9.26 4.90 0.00 1.73 1.68 0.00 1.66 0.00 0.00 1.64 0.00 0.00 2.85 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.34 1.36 7.81 27 P 0.00 4.49 0.00 2.07 2.20 0.00 3.65 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.25 0.00 28 G 9.26 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 0.00 0.00 0.00 29 D 8.13 4.92 0.00 2.63 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 30 S 9.09 5.40 0.00 3.91 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 31 I 8.68 4.72 1.61 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.69 -0.40 0.00 0.00 32 K 8.98 4.83 0.00 1.72 1.57 0.00 1.59 0.00 0.00 1.64 0.00 0.00 2.84 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.33 1.38 7.81 33 F 9.19 4.95 0.00 3.02 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 34 L 9.50 4.97 0.00 1.53 1.60 0.91 0.80 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 35 P 0.00 4.71 0.00 2.11 2.14 0.00 3.83 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.09 0.00 36 T 8.04 4.04 4.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 37 D 7.68 4.99 0.00 2.85 2.67 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 38 K 8.34 4.15 0.00 1.72 1.71 0.00 1.79 0.00 0.00 1.70 0.00 0.00 3.00 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.39 1.42 7.81 39 G 8.85 3.86 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 0.00 0.00 0.00 40 H 7.79 5.19 0.00 3.03 3.09 0.00 5.57 0.00 0.00 0.00 0.00 6.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 N 8.27 5.20 0.00 2.76 2.90 0.00 0.00 5.39 7.68 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 42 V 8.38 4.93 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 -0.03 0.00 0.00 43 E 9.46 5.10 0.00 2.01 1.72 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 2.17 2.43 0.00 44 T 8.30 4.03 3.07 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 1.08 0.00 0.00 45 I 8.03 4.20 1.81 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.93 0.92 0.00 0.00 46 K 8.72 4.07 0.00 1.81 1.76 0.00 1.78 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.45 1.52 7.81 47 G 9.30 3.97 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 0.00 0.00 0.00 48 M 7.67 4.90 0.00 2.09 2.01 0.00 0.00 0.00 0.00 0.00 2.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.67 0.00 49 A 7.26 4.41 1.04 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 0.00 0.00 50 P 0.00 4.34 0.00 2.16 2.04 0.00 2.55 0.00 0.00 3.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.71 0.00 51 D 8.29 4.57 0.00 2.78 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 52 G 8.96 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 53 A 7.38 4.27 1.47 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 54 D 8.45 4.64 0.00 2.71 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 55 Y 8.48 4.17 0.00 2.96 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 56 V 8.03 4.35 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 0.77 0.00 0.00 0.96 0.00 0.00 57 K 8.46 4.77 0.00 1.99 1.77 0.00 1.86 0.00 0.00 1.81 0.00 0.00 3.05 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.37 1.66 7.81 58 T 8.50 4.48 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 1.09 0.00 0.00 59 T 8.17 4.34 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 1.21 0.00 0.00 60 V 8.47 3.84 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 0.79 0.00 0.00 0.92 0.00 0.00 61 G 9.05 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 62 Q 7.48 4.79 0.00 2.10 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.05 6.86 0.00 0.00 0.00 0.00 0.00 2.31 2.31 0.00 63 E 8.71 4.53 0.00 1.88 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.34 0.00 64 A 8.79 4.77 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 65 V 8.42 4.87 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 0.80 0.00 0.00 0.93 0.00 0.00 66 V 8.63 4.23 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 0.17 0.00 0.00 0.82 0.00 0.00 67 K 8.49 4.65 0.00 1.76 1.60 0.00 1.76 0.00 0.00 1.69 0.00 0.00 2.84 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.38 1.47 7.81 68 F 9.15 4.81 0.00 3.05 2.83 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 69 D 9.00 4.82 0.00 2.79 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 K 8.07 4.32 0.00 2.00 1.89 0.00 1.81 0.00 0.00 1.77 0.00 0.00 3.03 0.00 0.00 3.26 0.00 0.00 0.00 0.00 1.56 1.51 7.81 71 E 8.55 4.38 0.00 2.01 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 0.00 2.37 2.36 0.00 72 G 7.77 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 V 8.32 4.79 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 1.06 0.00 0.00 0.99 0.00 0.00 74 Y 9.37 4.80 0.00 3.03 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 0.00 0.00 0.00 75 G 8.84 4.35 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 0.00 76 F 9.28 5.48 0.00 2.76 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 77 K 9.34 5.35 0.00 2.01 2.01 0.00 1.16 0.00 0.00 1.06 0.00 0.00 2.72 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.45 1.40 7.81 78 C 9.36 5.45 0.00 2.97 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 A 9.49 4.14 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 80 P 0.00 4.28 0.00 1.88 2.11 0.00 3.74 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 1.79 1.90 0.00 81 H 7.79 5.01 0.00 3.19 3.28 0.00 5.64 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 82 Y 8.05 4.21 0.00 3.24 3.05 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 83 M 8.01 3.89 0.00 2.02 2.12 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 2.64 2.59 0.00 84 M 7.91 4.23 0.00 1.98 2.25 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.51 0.00 85 G 8.20 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 0.00 0.00 0.00 86 M 7.92 4.53 0.00 2.17 2.02 0.00 0.00 0.00 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 1.73 0.00 87 V 8.37 5.49 2.21 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 1.01 0.00 0.00 1.06 0.00 0.00 88 A 9.17 4.96 0.96 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 89 L 9.27 5.09 0.00 1.49 1.31 0.69 0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 90 V 8.89 4.81 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 0.16 0.00 0.00 1.10 0.00 0.00 91 V 8.76 4.88 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 0.61 0.00 0.00 0.93 0.00 0.00 92 V 8.89 4.47 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 1.15 0.00 0.00 0.68 0.00 0.00 93 G 8.79 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 94 D 8.42 4.81 0.00 2.68 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 95 K 8.13 4.22 0.00 1.84 1.74 0.00 1.74 0.00 0.00 1.83 0.00 0.00 2.92 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.54 1.62 7.81 96 R 8.33 4.80 0.00 1.79 1.87 0.00 3.35 0.00 0.00 3.36 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.57 0.00 97 D 8.66 4.35 0.00 2.65 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 N 7.97 4.68 0.00 2.81 2.98 0.00 0.00 5.84 6.67 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 99 L 7.94 3.96 0.00 1.88 1.79 1.11 0.97 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 0.00 100 E 8.14 3.82 0.00 2.08 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 2.35 2.40 0.00 101 A 7.90 3.93 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 0.00 102 A 8.31 4.34 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 0.00 103 K 7.88 3.07 0.00 1.58 1.51 0.00 1.58 0.00 0.00 1.47 0.00 0.00 2.82 0.00 0.00 2.88 0.00 0.00 0.00 0.00 0.75 0.21 7.81 104 S 7.60 4.20 0.00 3.99 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 V 6.95 3.68 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 0.71 0.00 0.00 0.99 0.00 0.00 106 Q 8.23 4.58 0.00 2.06 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.54 0.00 0.00 0.00 0.00 0.00 2.27 2.45 0.00 107 H 8.13 5.00 0.00 3.14 3.23 0.00 5.90 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 0.00 108 N 8.47 4.57 0.00 2.95 2.91 0.00 0.00 5.52 7.77 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 0.00 109 K 8.64 3.78 0.00 1.84 1.87 0.00 1.72 0.00 0.00 1.74 0.00 0.00 2.90 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.52 1.54 7.81 110 L 7.89 3.95 0.00 1.78 1.62 0.93 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 111 T 8.44 3.88 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 1.17 0.00 0.00 112 Q 8.37 4.04 0.00 2.32 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.80 0.00 0.00 0.00 0.00 0.00 2.40 2.50 0.00 113 K 8.00 4.06 0.00 1.92 1.88 0.00 1.79 0.00 0.00 1.72 0.00 0.00 3.04 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.72 1.63 7.81 114 R 7.65 4.14 0.00 2.04 2.00 0.00 3.30 0.00 0.00 3.19 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.80 0.00 115 L 8.06 4.09 0.00 2.00 2.02 0.97 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 116 D 8.39 4.57 0.00 2.74 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 0.00 117 P 0.00 4.38 0.00 2.35 2.33 0.00 3.56 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.19 0.00 118 L 7.03 3.95 0.00 1.60 1.60 0.89 0.80 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 0.00 119 F 8.58 4.19 0.00 3.08 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 A 8.28 4.12 1.47 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 0.00 121 Q 7.82 4.34 0.00 2.17 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.72 0.00 0.00 0.00 0.00 0.00 2.40 2.55 0.00 122 I 7.64 4.33 2.02 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 1.23 0.44 1.00 0.00 0.00 123 Q 7.63 4.25 0.00 2.15 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.99 6.55 0.00 0.00 0.00 0.00 0.00 2.39 2.46 0.00