NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.2121 8.1733 122.0536 56.3682 34.1406 174.5720 2 I 4.9974 8.0967 126.4329 58.9124 39.3721 174.4103 3 F 4.6403 9.1394 126.4589 56.9659 39.8781 175.0892 4 S 4.3248 8.4483 115.7932 57.0481 65.5613 175.1577 5 K 3.0154 8.1330 119.5637 59.7345 31.9477 179.3605 6 C 4.2571 7.8881 116.1590 59.5501 37.0408 175.6324 7 E 3.8555 7.7241 120.6594 59.2749 29.2658 178.6134 8 L 3.8977 7.5848 118.9328 58.1398 42.2459 178.7804 9 A 4.1090 8.1470 120.7184 55.2666 18.1422 179.8499 10 R 3.9699 8.0014 116.7016 58.9405 29.9974 179.1872 11 K 3.9988 8.0131 119.7576 59.3495 32.2963 178.9608 12 L 3.8899 8.3006 119.6921 57.6498 41.6922 179.3768 13 K 3.8892 7.8639 118.1879 59.7713 31.8642 179.3705 14 S 4.2212 7.6068 112.7728 61.2383 62.6613 175.2758 15 M 4.5073 7.4673 120.0929 54.5888 32.3451 176.4001 16 G 3.9474 7.6829 105.2459 46.8870 0.0000 175.7218 17 M 3.8141 7.8235 121.4871 56.9859 32.1187 175.6087 18 D 4.3438 7.9772 117.3355 56.6874 40.4349 175.5977 19 G 3.9402 9.1197 115.2446 44.8392 0.0000 170.8689 20 F 4.0250 8.2870 122.2807 59.5625 39.1161 174.3871 21 H 3.9302 8.8754 127.8789 57.2042 27.7309 175.7633 22 G 3.7999 8.2832 104.9926 45.1831 0.0000 173.8314 23 Y 4.2949 7.9036 118.8479 56.4168 38.7351 175.7208 24 S 4.5653 8.5419 120.1197 58.1935 65.1749 174.8979 25 L 4.2596 8.6216 124.1876 58.4661 41.7804 179.2312 26 A 4.2794 8.2077 120.3093 55.2257 18.3587 179.0356 27 N 4.3334 7.7707 114.6473 56.3556 38.5510 177.3411 28 W 4.1004 7.5487 120.1865 59.9009 29.2160 178.7314 29 V 3.8821 8.2089 117.8290 66.4511 31.0518 177.2865 30 C 4.6349 8.4516 119.5078 59.0782 43.7626 175.0392 31 M 4.0440 8.2631 119.8429 58.6217 31.6961 178.1250 32 A 3.9319 7.7707 120.7761 55.1204 18.7485 178.9027 33 E 2.5400 7.6087 117.7999 59.4559 29.2466 178.7406 34 Y 3.9754 7.3232 114.4178 60.4923 38.1036 177.5184 35 E 4.3369 8.2388 119.5680 58.4953 29.4996 177.8232 36 S 4.5088 7.9318 110.0919 56.7860 64.6712 173.2356 37 N 3.7984 8.1544 116.9342 56.4504 37.3156 173.5895 38 F 3.9665 7.3880 109.6721 58.1994 37.5198 174.6691 39 N 5.1581 7.7982 119.4926 52.2012 38.8211 175.6919 40 T 4.0785 8.8787 117.1998 63.8688 69.7586 175.5777 41 Q 4.7989 8.4503 119.4871 55.3719 29.8922 175.8298 42 A 4.2287 7.8703 123.0704 52.5555 19.3729 176.8712 43 F 5.0747 8.5779 122.6848 57.0525 43.1526 173.6741 44 Q 3.9151 7.2921 125.7668 54.6666 31.4308 175.1748 45 G 3.6663 8.7817 116.7365 47.9549 0.0000 172.2699 46 R 4.5936 7.0112 117.2891 54.0761 33.0107 174.4324 47 Q 4.2670 8.6998 112.7259 57.1509 30.6218 173.9020 48 S 3.4792 9.3292 112.9135 60.7860 63.0031 172.4143 49 Q 4.4394 12.0000 117.8201 54.5592 29.0528 173.9981 50 G 3.9565 8.3906 101.9615 47.7370 0.0000 172.4920 51 S 4.3750 7.3488 114.5670 57.7571 66.3116 174.5651 52 S 4.7053 8.5005 111.0792 57.9691 68.1688 173.5445 53 D 5.2521 8.2696 123.2266 53.6064 42.3481 175.1409 54 Y 4.9469 8.9727 121.0537 57.3858 41.8774 177.4893 55 G 4.2816 8.7943 112.1203 45.3881 0.0000 173.1993 56 I 3.5986 8.2055 117.0080 63.0864 37.5724 177.3134 57 F 4.7763 7.7251 114.7082 56.7598 39.6400 175.2526 58 Q 3.4673 7.9653 119.4620 56.8341 26.8677 174.6758 59 L 4.2890 8.2683 117.9941 54.6941 43.2143 178.1103 60 N 5.2854 9.3375 123.1919 53.8046 39.8576 175.8639 61 S 4.5581 9.3147 121.3687 61.1334 62.9550 175.5947 62 K 3.9178 8.3592 120.7448 58.3662 32.7473 178.1441 63 W 4.2395 8.0620 117.4135 58.2107 31.7454 178.5229 64 W 4.4866 8.3569 119.5592 59.4090 28.7644 173.5658 65 C 5.8496 8.0351 109.5083 53.2199 39.1536 172.7355 66 K 4.2913 9.1552 121.7830 55.9451 32.6781 175.9162 67 S 4.8223 8.4709 122.0932 57.2116 63.6826 173.9187 68 Q 4.2336 8.6843 122.0729 57.0075 29.0205 176.9041 69 S 4.7279 7.5071 109.6114 57.9785 64.9501 173.9760 70 H 4.9294 7.5984 115.4089 53.0600 31.0379 173.1560 71 S 4.2839 8.5891 116.8154 58.5846 63.5516 173.1812 72 S 4.3109 7.6923 110.7065 57.4667 64.4364 176.1372 73 A 3.9027 8.1835 130.2348 53.2840 18.7988 176.9725 74 N 4.2807 7.8993 113.6999 53.8448 37.9295 175.2840 75 A 4.0640 7.9877 121.2678 55.8451 18.8479 179.0474 76 C 4.5741 8.8151 111.9946 57.9620 40.6280 173.1970 77 N 4.1793 8.2318 116.2497 53.7064 36.1073 173.6859 78 I 4.4308 8.5449 115.9664 59.7935 41.7469 173.7389 79 M 4.5848 8.4879 125.0324 54.8667 31.3528 178.6846 80 C 3.2105 8.1858 123.0781 59.3299 40.4741 177.2593 81 S 3.9668 7.7505 113.6337 61.2380 62.4920 175.8093 82 K 4.0927 8.2578 120.3352 58.6798 31.5999 177.9832 83 F 5.3824 8.1216 117.7986 57.7337 38.6487 175.8799 84 L 5.0085 7.6339 119.2795 53.8813 42.4658 175.2801 85 D 5.0921 7.9062 118.7542 52.9741 44.2752 175.0829 86 D 4.4049 8.4835 118.5708 57.5823 41.2678 176.2610 87 N 4.3169 8.0856 116.8683 54.4668 39.3946 175.3133 88 I 4.3005 8.5194 118.5398 62.0764 38.3482 177.4330 89 D 4.4052 8.0444 121.6555 57.8270 40.6654 178.5031 90 D 4.4996 8.3175 118.4378 57.8831 40.8491 178.7995 91 D 4.1765 8.2449 118.4474 57.3696 40.8816 178.8703 92 I 3.6235 8.0818 119.9867 64.4263 36.7757 178.3285 93 A 3.9223 8.4742 121.8888 55.2923 18.0452 178.8769 94 C 4.1169 8.4948 116.7885 59.5042 40.0009 175.5120 95 A 3.8739 8.0448 122.5758 55.1556 17.6613 179.7209 96 K 3.6600 7.2216 115.2803 59.3328 32.2713 179.3437 97 R 4.0418 7.4952 118.5692 60.4331 30.1440 178.0519 98 V 2.0764 7.8349 115.8033 65.9721 31.3330 177.6900 99 V 3.6495 8.1067 119.2879 65.1557 31.1262 178.3339 100 K 4.0585 7.7901 117.0263 57.2047 32.3021 176.8842 101 D 4.6710 7.4906 120.0295 52.9332 41.5370 175.3345 102 P 4.3090 0.0000 0.0000 65.9747 31.1851 178.3024 103 Q 4.0771 8.1292 116.8879 56.6390 30.1223 176.9270 104 G 4.3078 7.7382 106.4491 45.8173 0.0000 175.6060 105 M 4.1126 7.7542 122.3698 56.3933 31.7025 177.7283 106 S 4.6766 7.4039 113.7702 59.5758 63.1562 175.1231 107 A 3.8472 7.4880 123.1038 53.3528 18.2499 177.9386 108 W 4.6828 7.8983 116.7030 54.7500 30.9117 176.4197 109 V 3.6611 8.6847 124.6144 66.1908 30.9223 177.4678 110 A 4.4259 8.1959 119.5562 54.2445 18.3773 179.2219 111 W 3.9186 8.2979 127.0550 60.3072 30.6536 178.3426 112 V 3.0678 7.4599 117.4659 65.8846 31.1980 177.8030 113 K 3.8861 8.1794 117.1298 58.8956 31.9923 177.4558 114 H 4.4280 7.7190 112.1459 55.4261 30.5481 173.7224 115 C 4.4456 7.2048 114.1538 58.1706 43.5402 176.8916 116 K 3.5456 7.0456 120.2030 55.6804 30.5299 176.5444 117 G 4.1139 7.2804 104.1465 44.8656 0.0000 173.9370 118 K 4.3090 7.8375 119.1383 54.5253 33.7778 176.4492 119 D 4.5848 8.2390 121.4602 53.2791 40.3552 175.5670 120 L 4.5555 8.1587 124.9265 54.3732 41.9556 178.9540 121 S 4.2239 8.0568 115.6844 60.6996 62.7959 175.4112 122 K 4.5316 7.8635 117.4300 55.9855 34.0800 177.1290 123 Y 4.2519 7.7429 120.6338 60.3155 38.9145 177.5506 124 L 4.5844 7.9396 116.0954 54.0843 42.5178 177.5281 125 A 4.0335 8.1003 124.1319 55.4079 18.2657 179.7950 126 S 4.2706 7.9155 108.4924 60.6392 63.5997 175.4580 127 C 4.2653 7.8024 119.7026 56.9474 40.2319 172.9150 128 N 4.7400 8.6089 122.2604 51.9699 38.2850 175.0885 129 L 4.2938 8.3350 122.4346 54.7295 41.9686 176.8854 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 K 8.17 4.21 0.00 1.90 1.75 0.00 1.49 0.00 0.00 1.40 0.00 0.00 2.48 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.02 1.41 7.81 2 I 8.10 5.00 1.90 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.91 1.06 0.00 0.00 3 F 9.14 4.64 0.00 2.67 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 4 S 8.45 4.32 0.00 3.77 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 5 K 8.13 3.02 0.00 1.52 1.58 0.00 0.70 0.00 0.00 1.10 0.00 0.00 2.72 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.26 1.34 7.81 6 C 7.89 4.26 0.00 2.94 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 7 E 7.72 3.86 0.00 2.02 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 2.55 2.36 0.00 8 L 7.58 3.90 0.00 1.64 1.66 0.36 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 9 A 8.15 4.11 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 10 R 8.00 3.97 0.00 2.13 2.00 0.00 3.13 0.00 0.00 3.39 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.63 0.00 11 K 8.01 4.00 0.00 1.99 2.01 0.00 1.56 0.00 0.00 1.73 0.00 0.00 3.05 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.52 1.53 7.81 12 L 8.30 3.89 0.00 1.71 1.63 1.02 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 13 K 7.86 3.89 0.00 2.03 1.89 0.00 1.71 0.00 0.00 1.73 0.00 0.00 3.01 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.50 1.51 7.81 14 S 7.61 4.22 0.00 3.98 4.19 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 15 M 7.47 4.51 0.00 1.87 2.00 0.00 0.00 0.00 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.75 0.00 16 G 7.68 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 17 M 7.82 3.81 0.00 1.53 1.94 0.00 0.00 0.00 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.46 0.00 18 D 7.98 4.34 0.00 2.68 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 19 G 9.12 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 20 F 8.29 4.03 0.00 3.42 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 21 H 8.88 3.93 0.00 2.94 3.71 0.00 6.05 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 G 8.28 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 0.00 0.00 0.00 0.00 23 Y 7.90 4.29 0.00 2.97 2.32 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 24 S 8.54 4.57 0.00 4.14 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 25 L 8.62 4.26 0.00 2.08 1.86 1.03 1.16 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 26 A 8.21 4.28 1.50 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 0.00 0.00 27 N 7.77 4.33 0.00 2.75 2.59 0.00 0.00 7.02 7.55 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 28 W 7.55 4.10 0.00 3.53 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 29 V 8.21 3.88 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 1.17 0.00 0.00 30 C 8.45 4.63 0.00 2.08 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 M 8.26 4.04 0.00 2.04 1.87 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 2.33 0.00 32 A 7.77 3.93 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 33 E 7.61 2.54 0.00 1.16 1.61 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 1.49 1.55 0.00 34 Y 7.32 3.98 0.00 3.09 2.95 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 35 E 8.24 4.34 0.00 2.00 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 0.00 2.53 2.46 0.00 36 S 7.93 4.51 0.00 4.02 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 37 N 8.15 3.80 0.00 2.81 2.86 0.00 0.00 7.26 6.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 F 7.39 3.97 0.00 3.33 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 39 N 7.80 5.16 0.00 2.95 2.87 0.00 0.00 6.99 6.88 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 40 T 8.88 4.08 4.48 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 1.60 0.00 0.00 41 Q 8.45 4.80 0.00 2.17 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.83 0.00 0.00 0.00 0.00 0.00 2.34 2.52 0.00 42 A 7.87 4.23 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 43 F 8.58 5.07 0.00 2.91 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 44 Q 7.29 3.92 0.00 2.03 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.49 0.00 0.00 0.00 0.00 0.00 2.17 2.40 0.00 45 G 8.78 3.67 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 0.00 0.00 0.00 46 R 7.01 4.59 0.00 1.71 1.78 0.00 3.27 0.00 0.00 3.27 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.56 0.00 47 Q 8.70 4.27 0.00 2.25 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.20 5.68 0.00 0.00 0.00 0.00 0.00 2.24 2.52 0.00 48 S 9.33 3.48 0.00 3.95 4.08 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 0.00 0.00 0.00 0.00 49 Q 12.00 4.44 0.00 2.13 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.53 0.00 0.00 0.00 0.00 0.00 2.27 2.43 0.00 50 G 8.39 3.96 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 0.00 51 S 7.35 4.38 0.00 3.90 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 S 8.50 4.71 0.00 4.15 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 53 D 8.27 5.25 0.00 2.48 2.61 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 54 Y 8.97 4.95 0.00 3.37 3.21 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 55 G 8.79 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 0.00 0.00 0.00 0.00 56 I 8.21 3.60 1.47 0.00 0.00 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 1.28 -0.55 0.00 0.00 57 F 7.73 4.78 0.00 2.98 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 58 Q 7.97 3.47 0.00 2.36 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.91 6.84 0.00 0.00 0.00 0.00 0.00 2.39 2.79 0.00 59 L 8.27 4.29 0.00 1.74 1.80 -0.00 0.57 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 60 N 9.34 5.29 0.00 3.18 3.11 0.00 0.00 7.21 7.35 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 61 S 9.31 4.56 0.00 4.06 4.13 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 0.00 0.00 0.00 0.00 62 K 8.36 3.92 0.00 2.13 1.68 0.00 1.33 0.00 0.00 1.59 0.00 0.00 2.84 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.13 0.97 7.81 63 W 8.06 4.24 0.00 2.27 1.74 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 64 W 8.36 4.49 0.00 3.77 3.39 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 65 C 8.04 5.85 0.00 2.95 3.13 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 0.00 0.00 0.00 0.00 66 K 9.16 4.29 0.00 1.78 1.64 0.00 1.56 0.00 0.00 1.53 0.00 0.00 2.77 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.35 1.34 7.81 67 S 8.47 4.82 0.00 3.85 3.58 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 68 Q 8.68 4.23 0.00 2.07 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.64 0.00 0.00 0.00 0.00 0.00 2.31 2.31 0.00 69 S 7.51 4.73 0.00 4.05 3.99 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 70 H 7.60 4.93 0.00 3.21 3.24 0.00 5.53 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 S 8.59 4.28 0.00 3.93 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 72 S 7.69 4.31 0.00 3.95 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 73 A 8.18 3.90 1.18 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 0.00 0.00 74 N 7.90 4.28 0.00 3.04 2.77 0.00 0.00 6.86 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 A 7.99 4.06 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 0.00 0.00 76 C 8.82 4.57 0.00 3.43 3.42 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 77 N 8.23 4.18 0.00 2.92 2.93 0.00 0.00 6.65 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 78 I 8.54 4.43 1.89 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 1.02 1.23 0.81 0.00 0.00 79 M 8.49 4.58 0.00 1.95 1.89 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 2.57 2.41 0.00 80 C 8.19 3.21 0.00 2.28 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 81 S 7.75 3.97 0.00 3.94 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 82 K 8.26 4.09 0.00 1.53 1.85 0.00 1.63 0.00 0.00 1.61 0.00 0.00 2.88 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.35 1.42 7.81 83 F 8.12 5.38 0.00 3.34 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 84 L 7.63 5.01 0.00 1.87 1.70 1.23 1.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 85 D 7.91 5.09 0.00 2.68 2.61 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 86 D 8.48 4.40 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 87 N 8.09 4.32 0.00 2.71 2.80 0.00 0.00 6.92 7.94 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 88 I 8.52 4.30 1.68 0.00 0.00 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.67 0.98 0.00 0.00 89 D 8.04 4.41 0.00 3.12 2.80 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 0.00 90 D 8.32 4.50 0.00 2.94 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 91 D 8.24 4.18 0.00 2.88 2.57 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 92 I 8.08 3.62 2.13 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.13 0.84 0.00 0.00 93 A 8.47 3.92 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 94 C 8.49 4.12 0.00 3.25 3.35 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 95 A 8.04 3.87 0.97 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 96 K 7.22 3.66 0.00 1.49 1.46 0.00 1.32 0.00 0.00 0.97 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.30 1.09 7.81 97 R 7.50 4.04 0.00 1.96 2.10 0.00 3.29 0.00 0.00 3.20 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.88 0.00 98 V 7.83 2.08 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 0.00 0.00 -0.39 0.00 0.00 -0.33 0.00 0.00 99 V 8.11 3.65 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 1.10 0.00 0.00 0.83 0.00 0.00 100 K 7.79 4.06 0.00 1.95 1.94 0.00 2.11 0.00 0.00 1.74 0.00 0.00 3.73 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.55 1.48 7.81 101 D 7.49 4.67 0.00 2.96 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 0.00 102 P 0.00 4.31 0.00 2.00 2.12 0.00 3.62 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 1.98 2.11 0.00 103 Q 8.13 4.08 0.00 1.98 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.74 0.00 0.00 0.00 0.00 0.00 2.38 2.23 0.00 104 G 7.74 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 0.00 0.00 0.00 0.00 105 M 7.75 4.11 0.00 0.51 0.57 0.00 0.00 0.00 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.93 0.00 106 S 7.40 4.68 0.00 4.10 4.03 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 0.00 107 A 7.49 3.85 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 W 7.90 4.68 0.00 3.61 3.21 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 0.00 109 V 8.68 3.66 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 1.05 0.00 0.00 1.00 0.00 0.00 110 A 8.20 4.43 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 0.00 111 W 8.30 3.92 0.00 3.41 3.69 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 0.00 112 V 7.46 3.07 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 0.84 0.00 0.00 1.27 0.00 0.00 113 K 8.18 3.89 0.00 1.44 1.54 0.00 1.64 0.00 0.00 1.69 0.00 0.00 3.08 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.38 1.67 7.81 114 H 7.72 4.43 0.00 2.64 1.55 0.00 5.60 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 0.00 115 C 7.20 4.45 0.00 2.28 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 0.00 116 K 7.05 3.55 0.00 0.79 0.74 0.00 2.01 0.00 0.00 1.47 0.00 0.00 2.74 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.10 1.13 7.81 117 G 7.28 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 0.00 118 K 7.84 4.31 0.00 1.72 1.60 0.00 1.63 0.00 0.00 1.56 0.00 0.00 2.76 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.25 1.41 7.81 119 D 8.24 4.58 0.00 2.61 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 L 8.16 4.56 0.00 1.78 1.72 0.85 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 121 S 8.06 4.22 0.00 4.04 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 0.00 122 K 7.86 4.53 0.00 1.90 1.89 0.00 1.62 0.00 0.00 1.78 0.00 0.00 2.99 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.44 1.47 7.81 123 Y 7.74 4.25 0.00 3.07 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 0.00 124 L 7.94 4.58 0.00 1.79 1.66 1.09 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 125 A 8.10 4.03 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 0.00 126 S 7.92 4.27 0.00 3.96 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 0.00 127 C 7.80 4.27 0.00 3.10 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 0.00 128 N 8.61 4.74 0.00 2.69 2.78 0.00 0.00 7.00 7.85 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 0.00 129 L 8.34 4.29 0.00 1.64 1.58 0.96 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00