NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 V 3.8926 8.0544 120.3886 62.6004 31.5566 175.0286 2 H 4.0947 8.7108 128.1228 55.1539 28.9268 172.4330 3 L 4.8093 7.7632 128.3213 52.5669 45.6962 176.4438 4 T 4.1251 8.6212 116.5595 60.7977 70.9624 174.1931 5 P 3.7185 0.0000 0.0000 66.0507 31.4096 178.6030 6 E 4.0257 8.0824 118.0649 58.9903 29.4350 178.9090 7 E 3.9085 8.3084 119.2030 59.2616 29.6129 179.0994 8 K 3.8624 8.8138 121.0307 59.4266 32.0799 178.8046 9 S 4.2198 8.1677 114.2853 60.9039 63.3274 176.2655 10 A 3.9904 7.9162 124.3464 54.8926 18.0844 179.8748 11 V 3.5722 7.8132 116.6347 66.5939 31.6358 178.4988 12 T 3.9947 7.8780 115.2468 66.3973 68.0066 176.4875 13 A 3.9961 8.1738 122.2023 55.1909 18.7078 179.0208 14 L 3.8741 7.9048 118.4030 58.1565 42.2062 179.0372 15 W 4.3363 8.7782 128.2171 60.3280 30.3455 178.0829 16 G 3.7355 7.9039 104.6425 46.9780 0.0000 174.8535 17 K 4.3420 7.9616 118.5665 55.7231 32.9063 176.9865 18 V 3.6400 6.9679 120.1119 62.1921 32.2417 175.7940 19 N 4.5909 8.1478 124.7734 52.2377 39.0898 175.8386 20 V 3.5802 8.0118 122.6340 64.1203 31.8725 178.0799 21 D 4.3307 8.0840 118.2848 57.3318 40.7191 178.2837 22 E 3.8505 7.9817 119.5272 59.4102 29.6743 179.0018 23 V 3.5295 7.8072 118.4174 65.7203 31.6259 178.1145 24 G 3.7364 8.4134 105.9944 47.8116 0.0000 175.9485 25 G 3.5984 7.9829 108.1033 47.4190 0.0000 175.6425 26 E 3.9186 8.3816 121.0469 59.1238 29.5120 179.4149 27 A 3.9298 8.3271 121.1857 54.8881 18.5619 179.5130 28 L 3.9552 7.8806 118.6532 58.1370 42.2707 179.1066 29 G 3.6818 8.1164 105.7583 48.2539 0.0000 175.7730 30 R 3.9059 8.1801 121.2949 58.4220 30.0044 178.9025 31 L 4.0430 7.9029 120.2594 58.3338 41.9717 179.1358 32 L 4.0427 7.8272 118.3055 57.1242 41.2792 179.5378 33 V 3.6085 7.2578 117.5580 65.6766 31.7668 177.9991 34 V 3.4970 7.8248 117.0242 64.3792 32.8551 175.6500 35 Y 3.8551 7.2937 115.1703 54.4361 37.9243 174.1962 36 P 4.6507 0.0000 0.0000 64.4721 31.8917 178.1102 37 W 4.3964 8.2330 115.2929 59.6611 27.3707 177.8143 38 T 4.2568 7.9920 110.2544 63.7489 68.2122 176.0896 39 Q 4.3554 8.2886 121.7219 58.1514 28.4499 178.0369 40 R 3.9087 7.4987 116.5770 58.9647 29.1501 177.8065 41 F 4.3612 7.1870 115.0636 57.3639 39.5388 175.6216 42 F 4.5780 8.1611 119.2140 56.6420 40.2735 177.2125 43 E 4.0359 8.3656 121.3464 59.3392 29.5610 178.5342 44 S 4.4668 8.0344 111.9334 59.8748 63.3215 174.4615 45 F 4.6654 8.4480 119.5254 57.7168 39.8317 177.0972 46 G 3.9825 7.5040 108.3525 45.9843 0.0000 175.3400 47 D 4.5781 8.6812 126.2740 53.9270 41.1935 175.5781 48 L 4.9098 8.3231 125.9811 54.5459 43.3447 177.8477 49 S 4.3453 8.2002 116.2792 60.2942 63.5831 174.5717 50 T 4.7392 7.4571 110.5731 58.3882 73.0071 172.6725 51 P 4.2101 0.0000 0.0000 66.0845 31.4142 178.8055 52 D 4.3995 8.0786 116.8869 57.0826 40.5368 178.4357 53 A 3.9873 7.5033 120.6343 55.0092 18.7334 179.7065 54 V 3.6638 7.8548 116.6496 66.6121 31.5343 178.3313 55 M 4.1911 8.3534 117.4808 57.5697 31.8589 178.0214 56 G 4.0350 7.6681 103.0641 43.2569 0.0000 173.2354 57 N 4.3346 7.4932 121.1101 52.9593 39.3502 173.7470 58 P 4.1941 0.0000 0.0000 65.8595 31.2496 178.7321 59 K 3.6205 7.9206 117.8731 59.0442 31.7749 179.3907 60 V 3.6901 7.7567 118.0256 65.9545 31.5482 178.1022 61 K 3.9190 8.2705 118.1417 59.3102 32.0425 179.2779 62 A 3.9522 8.1341 121.1910 55.5319 18.3035 179.0716 63 H 4.3437 8.6856 117.3793 59.4910 29.8595 177.6316 64 G 3.5768 8.4415 107.8000 47.6272 0.0000 175.6063 65 K 4.0077 7.9838 121.5883 59.0599 32.3001 178.9162 66 K 3.9933 8.0257 119.6782 59.3824 32.1813 178.9690 67 V 3.6543 7.9811 118.7191 66.2008 31.4980 178.0503 68 L 4.3695 8.1875 118.8021 57.4559 41.4984 179.5367 69 G 3.7982 8.6653 106.1403 47.9574 0.0000 175.6346 70 A 4.1967 7.9487 121.8578 54.5568 18.5927 179.2051 71 F 4.3320 8.4983 119.5112 61.6225 39.3802 177.1499 72 S 4.0866 9.0026 115.1239 62.1592 62.9080 176.3648 73 D 4.1412 8.3645 121.2884 57.6928 40.5942 179.5287 74 G 3.4910 7.8233 105.5757 47.2295 0.0000 175.2110 75 L 3.9496 8.2573 120.1944 55.9357 41.7294 177.8539 76 A 4.4719 7.3135 119.3470 52.0554 19.6900 176.5941 77 H 4.8691 7.9983 115.8097 54.6994 30.0555 175.5800 78 L 4.0136 8.1507 120.7128 57.6717 41.6702 178.4146 79 D 4.5575 7.8824 115.9146 55.2399 41.9848 176.0162 80 N 4.9925 8.2779 118.2987 51.4483 39.3669 174.7532 81 L 3.9448 7.8161 123.3510 57.7376 42.1922 179.1458 82 K 3.9643 8.0971 116.9190 59.5764 32.1809 179.0166 83 G 3.7168 7.9493 105.3135 48.2460 0.0000 175.7232 84 T 3.6551 7.6839 117.3038 65.5040 68.6490 175.7049 85 F 4.8065 8.0219 117.0069 56.9887 39.2860 177.2731 86 A 4.0910 7.7441 123.2401 55.8031 18.1782 180.4649 87 T 4.0518 7.8701 107.5653 64.8619 68.9301 176.3111 88 L 4.0355 7.9747 122.7815 57.7476 42.2390 178.5874 89 S 4.2665 8.6556 113.5740 61.5607 62.2895 175.9202 90 E 3.8597 8.1529 121.0902 59.4293 29.2889 179.1867 91 L 3.9055 8.0537 120.1598 58.6273 42.1769 178.8075 92 H 4.2176 8.8369 116.5402 58.8290 28.6954 177.2346 93 C 3.5806 7.6950 120.6660 62.3470 31.1412 175.3349 94 D 4.3679 8.1040 120.1523 56.3753 40.6256 177.8295 95 K 4.1915 7.6674 117.0143 58.1708 33.0083 177.7080 96 L 4.1542 7.4506 116.0516 54.9777 42.1405 176.3773 97 H 4.0435 7.1896 113.6144 56.5980 26.5820 175.2359 98 V 3.6059 7.7092 119.1913 61.3680 31.8273 174.9322 99 D 4.3612 8.7864 127.5841 53.7664 41.6144 175.1039 100 P 3.2326 0.0000 0.0000 64.9991 31.7399 177.8781 101 E 3.8976 8.0759 118.3196 59.2724 29.1584 178.6031 102 N 4.2772 8.0689 116.8374 56.1934 38.4801 177.2359 103 F 4.4244 7.2111 119.2199 60.6092 38.9168 177.9841 104 R 3.9904 7.9236 117.3794 59.0763 29.9849 178.7160 105 L 3.8235 7.8157 118.8778 57.7538 41.5703 179.4004 106 L 4.1009 8.2724 120.4922 57.8403 42.0001 179.0676 107 G 3.7455 8.2273 105.8344 48.1031 0.0000 175.2800 108 N 4.4088 8.2181 119.5475 55.9719 38.6050 177.7281 109 V 3.6673 7.9071 119.5884 65.8198 31.5683 177.8140 110 L 3.9158 8.1476 120.2961 58.0260 41.9258 179.1495 111 V 3.6300 7.8450 118.1983 66.3332 31.4739 177.8901 112 C 4.1992 8.0750 116.1742 62.5498 27.8838 176.3850 113 V 3.5181 7.7156 120.0810 65.9603 31.1010 178.0749 114 L 3.8021 8.1414 118.9241 57.6320 41.2858 179.4208 115 A 3.6764 7.4748 120.6953 55.1994 18.0514 179.2027 116 H 4.1411 8.0201 116.1318 59.6307 29.9968 177.0067 117 H 3.9934 8.0055 117.0769 58.1914 28.9491 176.9800 118 F 4.6769 8.3409 117.6695 56.7066 39.7476 177.3233 119 G 3.8253 8.5266 108.7805 45.8755 0.0000 176.7319 120 K 4.1156 8.9948 120.8386 59.7231 32.2588 177.9114 121 E 4.0016 8.1919 119.4967 58.2957 29.5680 176.7426 122 F 4.6863 8.3532 121.8970 57.1954 38.1483 175.5874 123 T 4.3045 7.6975 117.0170 59.6487 71.3807 173.4262 124 P 4.1411 0.0000 0.0000 65.7857 31.4883 177.2125 125 P 4.2081 0.0000 0.0000 65.3065 31.2253 178.9509 126 V 3.5572 7.4599 117.3929 65.8223 31.3318 177.7995 127 Q 3.4894 7.9358 119.4796 59.0779 28.7365 178.1236 128 A 3.9700 8.1305 121.5603 55.1501 18.3199 179.5589 129 A 3.9095 7.9187 118.7749 55.5594 18.5230 179.4921 130 Y 3.8751 8.1742 115.3001 61.1442 37.9427 178.8866 131 Q 4.1286 8.5919 119.4136 59.0083 28.8813 178.9424 132 K 3.9751 7.8896 119.3105 59.3572 31.9598 179.6279 133 V 3.4882 7.6970 118.4303 66.2196 31.4429 178.6626 134 V 3.8026 8.5192 112.2309 64.1963 31.2525 178.5233 135 A 4.1085 8.1444 120.9901 55.0898 18.2368 179.9619 136 G 3.4853 8.2156 104.3491 47.7453 0.0000 176.2712 137 V 3.4563 8.1055 120.6785 65.6516 31.3972 178.0171 138 A 3.9097 8.2389 120.8206 55.2978 18.0002 179.4105 139 N 4.3546 8.2595 113.9829 56.0944 38.8685 177.2954 140 A 4.1670 8.0017 122.5724 55.0739 18.3027 179.6012 141 L 3.8750 7.7984 116.1042 56.7390 41.9219 178.4023 142 A 4.4488 7.6046 119.7690 52.5931 18.8494 178.3488 143 H 4.4814 8.0964 114.0881 57.7814 28.9599 176.2592 144 K 4.3223 7.8877 119.0945 56.3776 31.9588 176.4513 145 Y 4.1610 7.9664 117.7553 58.3129 38.4386 175.5679 146 H 4.4467 8.2799 117.6195 56.1923 28.2422 173.3089 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 8.05 3.89 2.03 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 0.90 0.00 0.00 0.89 0.00 0.00 2 H 8.71 4.09 0.00 3.21 3.23 0.00 5.72 0.00 0.00 0.00 0.00 6.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 L 7.76 4.81 0.00 1.49 1.39 0.84 0.93 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 4 T 8.62 4.13 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 1.23 0.00 0.00 5 P 0.00 3.72 0.00 2.26 2.32 0.00 3.65 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 2.04 2.03 0.00 6 E 8.08 4.03 0.00 1.98 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 2.38 2.33 0.00 7 E 8.31 3.91 0.00 2.23 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 2.29 2.27 0.00 8 K 8.81 3.86 0.00 1.75 1.91 0.00 1.56 0.00 0.00 1.62 0.00 0.00 2.92 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.39 1.38 7.81 9 S 8.17 4.22 0.00 4.11 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 0.00 10 A 7.92 3.99 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 11 V 7.81 3.57 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 0.59 0.00 0.00 0.52 0.00 0.00 12 T 7.88 3.99 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 13 A 8.17 4.00 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 14 L 7.90 3.87 0.00 1.98 1.94 0.13 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 15 W 8.78 4.34 0.00 3.83 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 16 G 7.90 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 0.00 0.00 0.00 17 K 7.96 4.34 0.00 1.97 2.07 0.00 1.70 0.00 0.00 1.74 0.00 0.00 2.99 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.48 1.60 7.81 18 V 6.97 3.64 1.12 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 -0.01 0.00 0.00 0.61 0.00 0.00 19 N 8.15 4.59 0.00 2.71 2.61 0.00 0.00 7.18 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 8.01 3.58 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 0.80 0.00 0.00 0.99 0.00 0.00 21 D 8.08 4.33 0.00 2.79 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 22 E 7.98 3.85 0.00 1.97 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 2.26 2.29 0.00 23 V 7.81 3.53 1.89 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 0.89 0.00 0.00 0.63 0.00 0.00 24 G 8.41 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 0.00 0.00 0.00 25 G 7.98 3.60 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 0.00 0.00 0.00 26 E 8.38 3.92 0.00 2.16 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 0.00 2.31 2.48 0.00 27 A 8.33 3.93 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 28 L 7.88 3.96 0.00 1.79 1.63 0.93 0.82 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 8.12 3.68 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 0.00 0.00 0.00 30 R 8.18 3.91 0.00 1.91 1.94 0.00 3.08 0.00 0.00 3.02 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.58 0.00 31 L 7.90 4.04 0.00 1.88 1.88 0.98 0.48 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 32 L 7.83 4.04 0.00 1.87 1.66 0.62 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 33 V 7.26 3.61 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 0.72 0.00 0.00 0.90 0.00 0.00 34 V 7.82 3.50 1.59 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 -0.04 0.00 0.00 0.78 0.00 0.00 35 Y 7.29 3.86 0.00 2.69 1.51 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 0.00 0.00 0.00 0.00 36 P 0.00 4.65 0.00 2.24 2.13 0.00 3.75 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.09 0.00 37 W 8.23 4.40 0.00 3.56 3.47 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 38 T 7.99 4.26 4.42 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 1.12 0.00 0.00 39 Q 8.29 4.36 0.00 2.24 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.76 0.00 0.00 0.00 0.00 0.00 2.43 2.47 0.00 40 R 7.50 3.91 0.00 1.63 1.98 0.00 2.99 0.00 0.00 2.60 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.50 0.00 41 F 7.19 4.36 0.00 2.11 2.42 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 42 F 8.16 4.58 0.00 2.83 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 E 8.37 4.04 0.00 2.16 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 0.00 2.34 2.32 0.00 44 S 8.03 4.47 0.00 4.14 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 45 F 8.45 4.67 0.00 3.20 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 46 G 7.50 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 47 D 8.68 4.58 0.00 2.65 2.62 0.00 0.00 0.00 0.00 0.00 0.00 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 8.32 4.91 0.00 1.65 1.60 1.01 1.03 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 49 S 8.20 4.35 0.00 3.94 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 50 T 7.46 4.74 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 4.21 0.00 2.15 2.11 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 2.15 0.00 52 D 8.08 4.40 0.00 2.67 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 53 A 7.50 3.99 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 54 V 7.85 3.66 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.97 0.00 0.00 55 M 8.35 4.19 0.00 1.96 2.09 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 2.60 2.83 0.00 56 G 7.67 4.04 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 0.00 57 N 7.49 4.33 0.00 3.07 2.82 0.00 0.00 6.86 7.54 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 58 P 0.00 4.19 0.00 2.23 2.25 0.00 3.70 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 2.02 2.02 0.00 59 K 7.92 3.62 0.00 1.45 0.74 0.00 1.45 0.00 0.00 1.26 0.00 0.00 2.81 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.18 1.23 7.81 60 V 7.76 3.69 2.29 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 1.11 0.00 0.00 1.02 0.00 0.00 61 K 8.27 3.92 0.00 1.97 1.81 0.00 1.69 0.00 0.00 1.62 0.00 0.00 2.93 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.43 1.55 7.81 62 A 8.13 3.95 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 H 8.69 4.34 0.00 3.51 3.53 0.00 5.79 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 8.44 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 0.00 0.00 0.00 65 K 7.98 4.01 0.00 1.87 2.02 0.00 1.69 0.00 0.00 1.59 0.00 0.00 2.92 0.00 0.00 3.31 0.00 0.00 0.00 0.00 1.47 1.57 7.81 66 K 8.03 3.99 0.00 1.96 2.02 0.00 1.87 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.51 1.51 7.81 67 V 7.98 3.65 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 1.02 0.00 0.00 0.93 0.00 0.00 68 L 8.19 4.37 0.00 2.00 1.88 1.11 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 69 G 8.67 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 70 A 7.95 4.20 1.49 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 0.00 0.00 71 F 8.50 4.33 0.00 3.21 3.29 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 72 S 9.00 4.09 0.00 4.34 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 D 8.36 4.14 0.00 2.77 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 74 G 7.82 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 0.00 0.00 0.00 75 L 8.26 3.95 0.00 1.39 1.43 -0.28 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 76 A 7.31 4.47 1.20 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 0.00 0.00 77 H 8.00 4.87 0.00 3.06 3.11 0.00 5.84 0.00 0.00 0.00 0.00 6.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 L 8.15 4.01 0.00 1.54 1.65 0.78 0.93 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 79 D 7.88 4.56 0.00 2.62 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 80 N 8.28 4.99 0.00 2.66 2.58 0.00 0.00 7.09 6.30 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 81 L 7.82 3.94 0.00 1.74 1.81 0.87 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 82 K 8.10 3.96 0.00 1.64 1.69 0.00 1.67 0.00 0.00 1.54 0.00 0.00 2.99 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.21 1.45 7.81 83 G 7.95 3.72 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 0.00 0.00 0.00 84 T 7.68 3.66 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 0.50 0.00 0.00 85 F 8.02 4.81 0.00 3.15 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 86 A 7.74 4.09 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 87 T 7.87 4.05 4.26 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 1.22 0.00 0.00 88 L 7.97 4.04 0.00 1.95 1.81 1.03 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 89 S 8.66 4.27 0.00 4.08 4.09 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 90 E 8.15 3.86 0.00 2.27 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 0.00 2.32 2.32 0.00 91 L 8.05 3.91 0.00 1.88 1.90 0.91 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 92 H 8.84 4.22 0.00 3.47 3.70 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 7.70 3.58 0.00 1.23 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 94 D 8.10 4.37 0.00 2.63 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 95 K 7.67 4.19 0.00 1.83 1.79 0.00 1.59 0.00 0.00 1.67 0.00 0.00 3.06 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.36 1.48 7.81 96 L 7.45 4.15 0.00 1.68 1.59 0.69 1.21 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 97 H 7.19 4.04 0.00 3.54 3.44 0.00 5.65 0.00 0.00 0.00 0.00 8.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 7.71 3.61 2.03 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 0.13 0.00 0.00 0.29 0.00 0.00 99 D 8.79 4.36 0.00 2.78 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 0.00 100 P 0.00 3.23 0.00 1.93 1.88 0.00 3.38 0.00 0.00 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.84 0.00 101 E 8.08 3.90 0.00 2.05 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 0.00 2.31 2.40 0.00 102 N 8.07 4.28 0.00 2.50 2.71 0.00 0.00 6.87 8.89 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 0.00 103 F 7.21 4.42 0.00 3.08 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 0.00 104 R 7.92 3.99 0.00 1.96 1.98 0.00 3.13 0.00 0.00 3.34 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.73 0.00 105 L 7.82 3.82 0.00 1.70 1.33 0.70 0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 106 L 8.27 4.10 0.00 1.81 1.88 0.94 1.10 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 0.00 107 G 8.23 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 0.00 108 N 8.22 4.41 0.00 2.96 2.97 0.00 0.00 6.75 7.17 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 0.00 109 V 7.91 3.67 2.26 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 1.04 0.00 0.00 1.16 0.00 0.00 110 L 8.15 3.92 0.00 1.84 1.84 0.89 0.21 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 0.00 111 V 7.84 3.63 2.34 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 1.32 0.00 0.00 1.19 0.00 0.00 112 C 8.08 4.20 0.00 3.03 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 0.00 113 V 7.72 3.52 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.95 0.00 0.00 114 L 8.14 3.80 0.00 1.09 1.11 0.72 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 115 A 7.47 3.68 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 0.00 116 H 8.02 4.14 0.00 3.22 3.50 0.00 5.77 0.00 0.00 0.00 0.00 7.07 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 3.99 0.00 2.79 2.46 0.00 5.71 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 8.34 4.68 0.00 3.17 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 0.00 119 G 8.53 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 0.00 120 K 8.99 4.12 0.00 1.92 2.02 0.00 1.64 0.00 0.00 1.68 0.00 0.00 3.03 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.47 1.43 7.81 121 E 8.19 4.00 0.00 2.19 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 2.30 0.00 122 F 8.35 4.69 0.00 2.96 3.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 T 7.70 4.30 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 1.30 0.00 0.00 124 P 0.00 4.14 0.00 2.15 2.16 0.00 3.58 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.21 0.00 125 P 0.00 4.21 0.00 2.12 2.07 0.00 3.50 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 2.09 2.11 0.00 126 V 7.46 3.56 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 0.88 0.00 0.00 0.91 0.00 0.00 127 Q 7.94 3.49 0.00 1.59 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.55 0.00 0.00 0.00 0.00 0.00 2.38 2.51 0.00 128 A 8.13 3.97 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 0.00 129 A 7.92 3.91 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 0.00 130 Y 8.17 3.88 0.00 3.25 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 0.00 131 Q 8.59 4.13 0.00 2.26 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.80 0.00 0.00 0.00 0.00 0.00 2.71 2.62 0.00 132 K 7.89 3.98 0.00 1.92 1.84 0.00 1.64 0.00 0.00 1.69 0.00 0.00 2.91 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.45 7.81 133 V 7.70 3.49 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 0.88 0.00 0.00 0.72 0.00 0.00 134 V 8.52 3.80 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 1.05 0.00 0.00 1.08 0.00 0.00 135 A 8.14 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 0.00 136 G 8.22 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 0.00 0.00 0.00 137 V 8.11 3.46 2.05 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 0.76 0.00 0.00 0.62 0.00 0.00 138 A 8.24 3.91 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 0.00 139 N 8.26 4.35 0.00 2.69 2.90 0.00 0.00 7.03 7.29 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 0.00 140 A 8.00 4.17 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 0.00 141 L 7.80 3.87 0.00 0.71 0.55 -0.03 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 142 A 7.60 4.45 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 8.10 4.48 0.00 3.34 3.79 0.00 5.75 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 7.89 4.32 0.00 1.77 1.84 0.00 1.55 0.00 0.00 1.54 0.00 0.00 2.98 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.22 1.68 7.81 145 Y 7.97 4.16 0.00 3.08 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 0.00 146 H 8.28 4.45 0.00 3.20 3.24 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