NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 S 4.4189 8.1927 115.2991 58.4870 64.5140 175.6922 3 V 3.3612 7.6875 119.2165 65.6795 30.8481 176.1575 4 Y 3.8901 8.7783 117.3199 61.2062 38.0248 177.8195 5 D 4.4118 8.0929 119.1346 57.2837 41.0844 178.5240 6 A 3.9792 8.0825 121.1887 54.9034 18.4150 179.4626 7 A 3.9226 8.2047 118.9823 54.6651 18.1320 179.5556 8 A 4.0266 7.4552 118.7028 54.9434 18.4952 179.1312 9 Q 4.2309 7.7461 114.7059 56.7699 30.0252 177.2751 10 L 4.2185 7.3316 121.7127 53.7998 40.1448 177.0598 11 T 4.2110 7.6061 114.1468 60.3937 71.5786 175.1703 12 A 3.9353 8.4732 122.6201 55.6738 18.2170 179.6630 13 D 4.2376 7.9527 116.5922 57.4019 40.9777 178.9672 14 V 3.4869 7.4032 118.4849 66.0196 31.4683 178.2439 15 K 3.8414 8.1774 118.3519 59.1336 31.8099 179.2489 16 K 3.9215 7.9749 119.9690 59.7521 32.1824 178.7099 17 D 4.5693 8.1476 119.1125 57.1009 40.5771 178.8153 18 L 3.7644 7.9738 119.7064 57.7868 41.6331 179.7315 19 R 4.0315 8.1690 118.1099 59.4253 28.7180 178.9461 20 D 4.4771 8.4238 118.9722 57.4543 40.8280 179.0373 21 S 3.1930 8.3605 114.8327 60.6971 63.0043 176.3226 22 W 4.2719 8.7176 132.2130 60.0502 30.2029 177.6686 23 K 3.8478 7.9272 119.0578 59.0926 31.7623 178.3303 24 V 3.8403 7.0554 115.4167 65.2436 32.0577 177.9166 25 I 3.4067 7.5575 119.5824 64.3192 36.9937 178.1241 26 G 2.2414 7.0592 106.2830 45.6074 0.0000 174.2831 27 S 4.1884 7.3332 114.1893 59.4059 63.5434 174.4702 28 D 4.5903 7.2301 119.7410 51.3775 41.3340 175.3595 29 K 3.9268 8.0977 123.5705 58.5259 32.4206 178.4056 30 K 4.0107 7.9677 119.5897 59.3757 32.4051 178.9730 31 G 3.6127 8.2582 107.2824 47.5663 0.0000 175.4785 32 N 4.4613 8.3273 119.7606 55.2694 38.5175 177.9339 33 G 3.5437 8.1721 107.5048 47.9280 0.0000 176.0071 34 V 3.5622 7.8376 120.9948 65.2925 31.4594 177.8937 35 A 3.9173 7.7634 120.4533 54.9911 18.2018 179.6138 36 L 3.7635 7.9626 117.4849 58.1236 41.7407 179.6854 37 M 3.4763 7.7043 118.6732 58.4786 31.9261 179.0440 38 T 3.9082 7.9620 110.1478 65.0588 68.7516 176.6725 39 T 3.8581 7.7618 118.6717 66.0438 68.3702 176.3958 40 L 3.8406 7.6816 122.2840 58.3881 41.8651 179.2187 41 F 4.5630 7.7631 117.2789 60.4398 38.5276 177.6765 42 A 4.0663 7.8745 119.8646 55.3043 18.3658 179.0843 43 D 4.6607 8.3738 116.2785 55.6612 42.5120 176.8523 44 N 5.0555 8.5010 117.1627 49.6825 39.5017 174.3059 45 Q 4.3370 8.7435 122.4757 58.6410 28.7942 179.0468 46 E 4.0901 8.3481 118.8246 59.2811 29.6651 178.8135 47 T 4.4969 8.3812 110.2880 64.1888 68.7993 176.4061 48 I 3.8709 8.1612 123.5012 64.1109 36.7769 178.1360 49 G 3.7117 7.8530 105.6916 47.7297 0.0000 174.6018 50 Y 4.2479 7.8447 116.5568 58.8771 38.3025 175.9738 51 F 4.9793 8.3666 119.8849 56.6441 40.0843 177.6472 52 K 3.8490 8.3846 124.6469 59.5630 32.1205 178.5370 53 R 3.9901 8.0278 117.7288 59.1092 30.0834 177.2999 54 L 4.2040 8.0052 116.8558 55.5637 42.7337 179.0315 55 G 3.9021 7.6781 106.5289 46.6628 0.0000 177.3177 56 D 4.5631 8.3720 118.3702 53.5163 39.6702 176.5227 57 V 3.8489 7.9121 118.4768 62.7593 31.6717 177.2017 58 S 4.3400 7.9570 113.2974 60.4485 63.0148 175.6758 59 Q 4.1550 8.2164 121.5253 56.6082 28.9483 177.0576 60 G 3.8935 8.4105 109.5384 46.1775 0.0000 175.8025 61 M 3.8681 9.1035 120.7682 58.6550 31.9517 177.4819 62 A 3.9862 7.5661 119.9284 54.2760 18.8678 177.3076 63 N 4.5551 8.4277 115.4839 52.8735 39.2058 174.8718 64 D 4.4100 8.7659 129.0209 57.6996 41.0251 179.1896 65 K 3.9914 8.0099 118.0873 59.3392 32.0558 179.0444 66 L 3.9955 7.8832 120.1381 58.2068 42.1443 178.7871 67 R 3.9845 8.5927 119.2795 59.3237 29.8362 178.7302 68 G 3.6396 8.3091 105.8342 47.8040 0.0000 175.9456 69 V 3.7181 7.9445 120.8017 65.6595 31.4369 178.3092 70 S 4.1101 8.3510 115.1400 61.7124 62.5085 176.7266 71 I 3.7991 7.6470 120.8582 64.8915 37.2226 178.3593 72 T 4.2297 7.8757 116.4259 66.5003 68.2137 176.3281 73 L 4.0857 8.3481 122.5872 58.6770 42.1254 179.0848 74 M 4.2847 7.9781 118.3756 58.3083 31.8303 177.9144 75 Y 4.1683 8.0581 116.0856 59.7346 38.0955 177.6999 76 A 3.7790 7.8857 122.5874 54.9585 18.4480 179.6283 77 L 3.5193 7.5124 117.0199 57.6090 41.6965 179.3018 78 Q 3.4057 7.7260 119.5598 58.8529 28.7606 177.7339 79 N 4.2162 7.6222 116.8546 56.7967 39.4311 176.3309 80 F 4.5147 7.6372 118.9844 60.8593 38.8982 177.7353 81 I 3.4986 7.6565 119.4115 64.5380 36.6126 178.3151 82 D 4.4011 7.9807 118.3065 56.6309 40.9336 177.7548 83 Q 4.3836 7.6915 116.5774 55.6003 28.8235 177.1957 84 L 3.8807 7.3666 121.4065 58.0933 41.7521 178.0862 85 D 4.5137 7.9207 114.8110 55.0772 41.1808 176.5457 86 N 4.7988 8.1193 117.8898 50.0364 40.1862 171.9562 87 P 4.1412 0.0000 0.0000 65.6627 31.6621 177.7656 88 D 4.5448 8.1304 118.1935 57.0613 40.8245 178.4897 89 D 4.3699 8.1306 119.3523 57.0006 40.7490 178.5188 90 L 3.8418 8.0180 121.0578 58.0570 41.9905 179.1964 91 V 3.2806 7.7593 118.6124 66.0831 31.4442 177.8107 92 C 4.0987 7.8165 113.7035 61.2815 29.4151 175.9943 93 V 3.7296 7.8261 120.8243 65.5492 31.0211 178.2924 94 V 3.5148 7.9867 118.4533 65.9479 31.1138 177.9241 95 E 3.9448 8.2081 117.6459 59.0930 29.4065 178.9817 96 K 4.1123 8.1031 119.6855 59.5400 31.8602 178.5807 97 F 4.1401 8.5376 120.7307 61.4287 39.2611 176.9601 98 A 4.2285 8.5786 120.5804 54.6812 18.1106 179.5462 99 V 3.5077 7.5347 117.2161 66.6698 31.0603 178.1623 100 N 4.3352 7.5637 116.1519 56.4675 38.3256 177.1927 101 H 4.1796 7.9839 117.1829 58.4506 28.8005 177.7103 102 I 3.7716 7.9828 122.1416 64.6088 36.7119 178.5062 103 T 3.8752 7.6925 115.5464 66.1287 68.2794 175.8386 104 R 4.3130 7.2978 116.7639 54.9143 30.6195 176.2057 105 K 3.7878 7.9896 117.3695 57.4773 30.0222 176.0459 106 I 4.0753 7.6824 120.4540 59.9323 37.4356 177.1931 107 S 4.4856 8.3983 120.9600 57.5099 65.3493 174.7801 108 A 4.0218 8.4828 123.1777 55.1844 17.8317 179.7584 109 A 3.9868 7.9165 118.1375 55.2530 18.8808 178.9841 110 E 4.0750 8.1856 117.5470 59.4738 29.8836 178.8341 111 F 4.1795 8.6240 120.9249 61.0961 39.4799 177.0385 112 G 3.8600 8.2728 104.7744 46.7205 0.0000 175.3367 113 K 4.1782 7.9387 120.6660 58.7808 32.0600 178.1434 114 M 3.9871 7.8007 117.8817 57.2396 32.0753 177.5481 115 N 4.4792 8.1520 117.1436 56.6083 38.6146 177.2014 116 G 3.5727 7.6630 106.6279 47.4165 0.0000 173.7232 117 P 4.1865 0.0000 0.0000 65.1080 31.2848 178.7019 118 I 3.4895 7.6865 118.2796 64.2488 37.0452 178.3531 119 K 3.9129 8.1670 120.4539 59.5199 32.0914 179.0024 120 K 3.9917 8.2518 118.8991 59.3078 31.9074 179.5985 121 V 3.5234 8.0602 118.9601 65.8376 31.4026 178.0317 122 L 3.9458 8.0364 118.6677 57.9081 41.5318 179.3550 123 A 4.1474 8.1706 120.8050 55.2113 18.0309 179.7500 124 S 4.1840 7.8536 111.4811 60.4732 63.0744 175.8293 125 K 4.3794 7.1506 119.5958 55.4355 32.2797 175.6473 126 N 4.1308 7.9546 115.1896 54.3801 36.0148 174.2330 127 F 4.3834 8.1461 118.0160 55.7958 39.8585 177.3025 128 G 4.0496 8.5622 114.4413 44.1399 0.0000 171.9327 129 D 4.5170 8.9426 118.6394 57.6198 40.5273 178.8524 130 K 3.8552 8.1753 119.3890 59.9336 32.1830 178.2970 131 Y 4.1402 8.2788 116.6286 60.8152 37.8321 177.9155 132 A 4.2167 8.2720 121.3843 55.4038 18.5015 179.2215 133 N 4.3247 8.7466 115.1753 56.3619 38.4237 177.4931 134 A 3.9338 7.8021 122.2223 55.0913 18.4861 179.8259 135 W 3.8476 8.5342 117.2010 59.5867 29.0783 178.6771 136 A 4.1174 8.4276 121.0682 55.1288 17.5604 179.8552 137 K 3.9354 7.7195 116.0346 59.2878 32.4799 179.0964 138 L 3.9003 7.4952 120.8491 58.0892 41.9312 179.1918 139 V 3.7429 8.0971 118.0489 65.9638 31.4527 177.8401 140 A 4.3641 8.0826 121.9618 54.4132 17.8946 179.8224 141 V 3.3898 7.2043 115.9855 66.1229 31.8867 178.1833 142 V 3.4588 7.4300 117.5266 65.8929 31.2693 177.8504 143 Q 3.8927 8.3318 117.8856 58.7215 28.2959 178.4772 144 A 4.0256 7.7201 120.3970 54.0144 18.4587 178.4244 145 A 4.3374 7.6002 117.4791 52.4667 19.6209 177.0816 146 L 4.1204 7.3666 121.6467 54.8157 41.8284 176.5612 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 2 S 8.19 4.42 0.00 3.88 3.92 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 0.00 0.00 0.00 3 V 7.69 3.36 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 0.85 0.00 0.00 0.86 0.00 0.00 4 Y 8.78 3.89 0.00 3.03 2.94 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 5 D 8.09 4.41 0.00 2.87 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 6 A 8.08 3.98 1.29 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 0.00 0.00 0.00 7 A 8.20 3.92 1.25 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 0.00 0.00 8 A 7.46 4.03 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 9 Q 7.75 4.23 0.00 2.15 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 7.28 0.00 0.00 0.00 0.00 0.00 2.36 2.51 0.00 10 L 7.33 4.22 0.00 1.71 1.52 0.75 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 11 T 7.61 4.21 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 1.18 0.00 0.00 12 A 8.47 3.94 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 13 D 7.95 4.24 0.00 2.65 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 14 V 7.40 3.49 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 0.89 0.00 0.00 0.86 0.00 0.00 15 K 8.18 3.84 0.00 1.77 1.77 0.00 1.65 0.00 0.00 1.49 0.00 0.00 2.85 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.34 1.60 7.81 16 K 7.97 3.92 0.00 1.96 2.00 0.00 1.56 0.00 0.00 1.67 0.00 0.00 3.08 0.00 0.00 3.32 0.00 0.00 0.00 0.00 1.46 1.57 7.81 17 D 8.15 4.57 0.00 2.77 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 18 L 7.97 3.76 0.00 1.64 1.25 0.53 -0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 19 R 8.17 4.03 0.00 2.03 2.05 0.00 3.13 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.89 0.00 20 D 8.42 4.48 0.00 2.98 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 21 S 8.36 3.19 0.00 3.40 3.34 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 22 W 8.72 4.27 0.00 3.77 3.38 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 23 K 7.93 3.85 0.00 2.04 2.01 0.00 1.89 0.00 0.00 1.66 0.00 0.00 3.03 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.48 7.81 24 V 7.06 3.84 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 1.05 0.00 0.00 1.09 0.00 0.00 25 I 7.56 3.41 1.57 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.63 0.62 0.00 0.00 26 G 7.06 2.24 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 0.00 27 S 7.33 4.19 0.00 3.89 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 28 D 7.23 4.59 0.00 2.70 2.39 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 29 K 8.10 3.93 0.00 1.75 1.71 0.00 1.24 0.00 0.00 0.72 0.00 0.00 2.27 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.25 1.37 7.81 30 K 7.97 4.01 0.00 1.83 1.78 0.00 1.73 0.00 0.00 1.83 0.00 0.00 2.95 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.49 1.50 7.81 31 G 8.26 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 32 N 8.33 4.46 0.00 2.70 2.72 0.00 0.00 6.98 7.09 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 33 G 8.17 3.54 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 0.00 0.00 0.00 0.00 34 V 7.84 3.56 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 1.09 0.00 0.00 0.95 0.00 0.00 35 A 7.76 3.92 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 36 L 7.96 3.76 0.00 1.78 1.58 0.82 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 37 M 7.70 3.48 0.00 1.55 1.88 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.66 0.00 38 T 7.96 3.91 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 1.26 0.00 0.00 39 T 7.76 3.86 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 1.21 0.00 0.00 40 L 7.68 3.84 0.00 1.61 1.35 0.88 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 41 F 7.76 4.56 0.00 3.21 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 42 A 7.87 4.07 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 43 D 8.37 4.66 0.00 2.64 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 N 8.50 5.06 0.00 2.94 2.97 0.00 0.00 6.58 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 45 Q 8.74 4.34 0.00 2.30 2.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.89 0.00 0.00 0.00 0.00 0.00 2.46 2.34 0.00 46 E 8.35 4.09 0.00 2.23 2.31 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 2.50 2.41 0.00 47 T 8.38 4.50 4.68 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 1.43 0.00 0.00 48 I 8.16 3.87 1.89 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.54 0.62 0.71 0.00 0.00 49 G 7.85 3.71 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 0.00 0.00 0.00 50 Y 7.84 4.25 0.00 2.78 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 51 F 8.37 4.98 0.00 2.97 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 0.00 52 K 8.38 3.85 0.00 1.77 1.81 0.00 1.71 0.00 0.00 1.72 0.00 0.00 2.85 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.51 1.43 7.81 53 R 8.03 3.99 0.00 1.84 2.01 0.00 3.31 0.00 0.00 3.25 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.68 0.00 54 L 8.01 4.20 0.00 1.85 1.78 1.06 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 55 G 7.68 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 56 D 8.37 4.56 0.00 2.75 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 57 V 7.91 3.85 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 0.60 0.00 0.00 0.65 0.00 0.00 58 S 7.96 4.34 0.00 4.06 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 59 Q 8.22 4.16 0.00 2.27 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 5.87 0.00 0.00 0.00 0.00 0.00 2.38 2.50 0.00 60 G 8.41 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 M 9.10 3.87 0.00 1.96 2.14 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.63 0.00 62 A 7.57 3.99 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 63 N 8.43 4.56 0.00 2.79 2.91 0.00 0.00 7.00 8.05 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 64 D 8.77 4.41 0.00 2.74 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 65 K 8.01 3.99 0.00 1.83 1.91 0.00 1.74 0.00 0.00 1.83 0.00 0.00 2.94 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.56 1.52 7.81 66 L 7.88 4.00 0.00 1.80 1.87 1.01 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 67 R 8.59 3.98 0.00 2.13 2.07 0.00 3.16 0.00 0.00 3.37 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.66 0.00 68 G 8.31 3.64 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 0.00 0.00 0.00 69 V 7.94 3.72 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 1.27 0.00 0.00 1.12 0.00 0.00 70 S 8.35 4.11 0.00 4.04 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 71 I 7.65 3.80 1.97 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.67 1.16 0.00 0.00 72 T 7.88 4.23 4.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 73 L 8.35 4.09 0.00 1.93 1.97 0.95 1.30 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 74 M 7.98 4.28 0.00 2.03 2.19 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.80 2.94 0.00 75 Y 8.06 4.17 0.00 3.26 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 76 A 7.89 3.78 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 L 7.51 3.52 0.00 1.55 1.27 1.03 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 78 Q 7.73 3.41 0.00 2.42 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.79 0.00 0.00 0.00 0.00 0.00 2.53 2.50 0.00 79 N 7.62 4.22 0.00 2.83 2.71 0.00 0.00 7.29 7.04 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 80 F 7.64 4.51 0.00 2.97 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 81 I 7.66 3.50 1.49 0.00 0.00 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.05 0.78 0.00 0.00 82 D 7.98 4.40 0.00 2.80 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 83 Q 7.69 4.38 0.00 2.07 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.73 0.00 0.00 0.00 0.00 0.00 2.62 2.56 0.00 84 L 7.37 3.88 0.00 1.50 1.67 0.76 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 85 D 7.92 4.51 0.00 2.65 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 86 N 8.12 4.80 0.00 2.70 2.63 0.00 0.00 7.10 7.22 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 87 P 0.00 4.14 0.00 2.29 2.15 0.00 3.67 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 2.14 2.19 0.00 88 D 8.13 4.54 0.00 2.91 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 89 D 8.13 4.37 0.00 2.76 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 90 L 8.02 3.84 0.00 1.83 1.66 0.74 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 91 V 7.76 3.28 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 0.68 0.00 0.00 -0.00 0.00 0.00 92 C 7.82 4.10 0.00 3.22 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 93 V 7.83 3.73 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 1.28 0.00 0.00 1.07 0.00 0.00 94 V 7.99 3.51 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 0.81 0.00 0.00 0.28 0.00 0.00 95 E 8.21 3.94 0.00 1.95 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 2.28 2.53 0.00 96 K 8.10 4.11 0.00 1.95 2.12 0.00 1.56 0.00 0.00 1.60 0.00 0.00 3.00 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.50 1.58 7.81 97 F 8.54 4.14 0.00 3.41 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 98 A 8.58 4.23 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 99 V 7.53 3.51 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 1.01 0.00 0.00 1.06 0.00 0.00 100 N 7.56 4.34 0.00 2.74 2.70 0.00 0.00 7.14 8.04 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 0.00 101 H 7.98 4.18 0.00 3.11 3.33 0.00 5.81 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 0.00 102 I 7.98 3.77 2.00 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 1.50 0.82 0.90 0.00 0.00 103 T 7.69 3.88 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 1.19 0.00 0.00 104 R 7.30 4.31 0.00 1.88 1.95 0.00 3.17 0.00 0.00 3.07 7.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.72 0.00 105 K 7.99 3.79 0.00 2.00 1.97 0.00 1.72 0.00 0.00 1.72 0.00 0.00 3.03 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.41 1.42 7.81 106 I 7.68 4.08 2.00 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.54 0.93 0.00 0.00 107 S 8.40 4.49 0.00 4.09 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 0.00 108 A 8.48 4.02 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 0.00 109 A 7.92 3.99 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 0.00 110 E 8.19 4.08 0.00 2.20 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 0.00 2.15 2.30 0.00 111 F 8.62 4.18 0.00 3.33 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 0.00 112 G 8.27 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 0.00 113 K 7.94 4.18 0.00 1.94 1.89 0.00 1.89 0.00 0.00 1.64 0.00 0.00 2.95 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.50 1.74 7.81 114 M 7.80 3.99 0.00 1.91 1.74 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.43 0.00 115 N 8.15 4.48 0.00 2.96 2.88 0.00 0.00 6.73 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 G 7.66 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 0.00 117 P 0.00 4.19 0.00 2.16 2.16 0.00 3.66 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 2.02 2.12 0.00 118 I 7.69 3.49 1.97 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 1.21 0.70 0.64 0.00 0.00 119 K 8.17 3.91 0.00 1.90 1.99 0.00 1.67 0.00 0.00 1.67 0.00 0.00 2.97 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.46 1.53 7.81 120 K 8.25 3.99 0.00 1.95 1.80 0.00 1.69 0.00 0.00 1.55 0.00 0.00 2.89 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.44 1.56 7.81 121 V 8.06 3.52 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 0.89 0.00 0.00 0.89 0.00 0.00 122 L 8.04 3.95 0.00 1.90 1.95 0.88 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 123 A 8.17 4.15 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.85 4.18 0.00 4.04 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 0.00 125 K 7.15 4.38 0.00 2.22 1.96 0.00 1.79 0.00 0.00 1.68 0.00 0.00 2.96 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.39 1.61 7.81 126 N 7.95 4.13 0.00 2.61 2.76 0.00 0.00 6.80 6.93 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 0.00 127 F 8.15 4.38 0.00 3.08 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 0.00 128 G 8.56 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 0.00 129 D 8.94 4.52 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 0.00 130 K 8.18 3.86 0.00 1.78 1.65 0.00 1.61 0.00 0.00 1.73 0.00 0.00 2.87 0.00 0.00 2.52 0.00 0.00 0.00 0.00 1.31 1.41 7.81 131 Y 8.28 4.14 0.00 3.45 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 0.00 132 A 8.27 4.22 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 0.00 133 N 8.75 4.32 0.00 2.89 2.89 0.00 0.00 6.93 7.13 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 0.00 134 A 7.80 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 0.00 135 W 8.53 3.85 0.00 3.63 3.36 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 0.00 136 A 8.43 4.12 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 0.00 137 K 7.72 3.94 0.00 1.83 1.81 0.00 1.66 0.00 0.00 1.71 0.00 0.00 2.95 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.45 1.65 7.81 138 L 7.50 3.90 0.00 1.38 1.69 0.61 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 139 V 8.10 3.74 2.35 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 1.25 0.00 0.00 1.18 0.00 0.00 140 A 8.08 4.36 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 0.00 141 V 7.20 3.39 1.97 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 0.56 0.00 0.00 0.80 0.00 0.00 142 V 7.43 3.46 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 0.45 0.00 0.00 0.41 0.00 0.00 143 Q 8.33 3.89 0.00 2.29 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.58 0.00 0.00 0.00 0.00 0.00 2.62 2.74 0.00 144 A 7.72 4.03 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 0.00 145 A 7.60 4.34 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 146 L 7.37 4.12 0.00 1.69 1.53 0.64 1.01 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