NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 L 4.1961 8.1849 122.4758 55.1250 42.9519 175.9308 3 T 4.1799 8.2703 123.0078 61.8811 69.9357 172.8256 4 S 4.6751 9.1720 122.3285 57.2187 64.8928 174.1996 5 C 4.9798 8.3402 121.9820 53.9705 39.1661 172.3117 6 P 4.4681 0.0000 0.0000 61.7509 31.5796 174.2532 7 P 4.5441 0.0000 0.0000 64.3421 31.6009 176.7729 8 L 3.9068 8.7750 119.5359 54.5180 40.0086 174.3582 9 W 4.7602 7.8067 117.5022 55.8835 31.2923 175.2599 10 T 4.8093 9.0513 114.0117 61.0311 70.6115 172.4887 11 G 4.5368 8.7849 113.5759 44.4324 0.0000 172.1082 12 F 4.4725 8.8970 124.9288 57.4973 42.4674 174.3628 13 N 3.9438 9.1158 125.8045 54.2727 35.9339 175.2768 14 G 3.8662 8.0731 104.8913 45.2236 0.0000 173.8390 15 K 4.3729 7.5822 118.8171 54.5917 34.5262 174.1918 16 C 5.3605 8.0073 118.4316 55.2874 41.5734 172.8688 17 F 5.9322 9.8726 123.0744 55.8531 42.1817 174.5744 18 R 4.4909 8.7036 121.3464 54.2740 33.4537 173.5069 19 L 4.5522 8.0860 127.8386 54.2279 42.8936 175.3990 20 F 4.3274 8.8637 125.7151 56.3226 40.5416 176.6323 21 H 4.4731 8.9810 119.2010 56.3548 29.3829 174.9090 22 N 4.8780 8.0858 117.6945 51.6020 38.3363 174.4255 23 H 4.6487 9.1480 120.6171 56.1921 29.3546 174.7127 24 L 5.1036 9.1234 122.8988 52.5195 46.2122 176.0193 25 N 5.6622 8.5850 118.3602 52.1628 38.9491 175.7448 26 F 3.0994 9.0356 120.6080 61.4880 39.2583 176.3352 27 D 4.3717 8.3821 117.5644 58.1468 40.6168 179.0000 28 N 4.2194 8.0878 115.5296 56.0074 38.4387 177.3115 29 A 3.1075 7.6944 122.7046 54.4281 18.3409 179.2299 30 E 3.5629 7.6784 117.9256 59.3006 29.5079 178.2618 31 N 4.1340 7.7890 115.4373 56.8909 39.2563 175.9935 32 A 4.0150 8.0209 122.1029 55.5943 18.2480 179.0477 33 C 4.6526 7.9910 114.5833 60.1054 40.1276 175.9511 34 R 4.0780 7.7406 117.2238 57.8226 29.5985 178.3310 35 Q 3.9496 7.5632 118.0280 57.5897 29.2604 176.5551 36 F 4.5193 7.2386 119.2427 57.6835 40.3381 175.5661 37 G 4.1653 8.2883 107.9172 45.3551 0.0000 170.7590 38 L 4.8704 8.6565 120.6311 53.3424 45.1193 175.9243 39 A 5.3230 8.5603 126.9464 49.7199 22.6226 175.6405 40 S 4.3671 8.6885 113.8330 57.9127 64.0483 175.4558 41 C 4.1193 8.7007 119.6297 63.1262 28.0977 175.4085 42 S 4.1496 7.3539 115.3645 61.7040 62.5572 174.5219 43 G 3.6200 7.6742 109.6922 45.7218 0.0000 174.2726 44 D 4.4045 8.0717 121.5341 53.6535 41.3819 175.2592 45 E 4.2674 8.7800 125.1327 56.6594 30.0795 175.9446 46 L 4.6400 8.5512 125.8902 56.0555 43.9236 175.9952 47 A 4.5192 7.4009 117.8767 51.7055 22.5385 175.0709 48 T 4.9405 8.4083 114.8964 61.5927 72.1397 174.6695 49 G 4.0401 8.8389 111.8858 46.8237 0.0000 171.9020 50 H 5.0961 8.9531 116.0976 53.8806 34.0775 173.1755 51 L 4.6394 8.9674 119.8369 55.1262 42.1119 177.7318 52 A 4.5013 9.0273 124.8956 52.7931 19.3745 177.0235 53 S 3.3756 8.5185 115.0750 55.8220 65.4362 173.7635 54 I 4.3849 5.4200 120.6667 60.1255 40.1699 175.1093 55 H 5.1556 8.3769 120.2209 54.5008 30.2215 173.4291 56 S 4.3104 7.2926 112.9390 56.0916 66.1014 176.0141 57 A 3.9340 8.2556 124.3955 55.6614 17.9213 179.8677 58 E 3.9137 8.0787 115.9791 59.9705 29.6909 179.1084 59 S 3.8895 8.0842 114.8944 61.9069 62.9521 176.3783 60 Q 3.8523 8.0057 121.4333 59.6566 28.6159 179.2445 61 A 3.8439 7.8868 121.4907 54.7452 18.3667 179.3465 62 F 3.7457 7.7052 119.2347 61.3268 39.4672 177.2400 63 L 3.2236 7.4856 118.4145 57.8055 41.0479 179.7973 64 T 3.5991 7.5243 115.4020 66.6102 68.4326 176.1295 65 E 3.7281 8.0003 121.2940 58.9260 29.5293 178.2310 66 L 3.5730 7.5157 120.8093 58.2598 41.8240 179.3166 67 V 3.3819 7.4646 117.5078 65.8864 31.3541 177.7558 68 K 3.7625 7.9069 117.6725 59.9831 32.0295 178.8922 69 T 4.0768 8.0922 108.6460 64.6331 69.0883 176.8391 70 S 4.2672 7.9702 117.0762 60.3932 63.3099 174.4488 71 L 4.9004 7.7732 122.0170 53.4428 42.8482 176.7055 72 P 4.3085 0.0000 0.0000 65.5675 31.6820 177.6549 73 D 4.5061 8.0331 117.0875 55.7479 41.0013 176.5707 74 L 4.4151 7.7927 118.0807 54.5835 42.3295 176.4405 75 I 4.0356 7.1874 120.2294 61.4513 37.2941 176.1443 76 T 4.4453 8.5693 118.5207 60.3188 70.8746 175.8269 77 G 3.8607 8.8554 107.9883 46.5410 0.0000 174.1601 78 G 4.5633 8.2999 109.8015 46.3805 0.0000 175.8278 79 W 4.8939 9.7908 124.2763 57.2463 31.1208 175.2162 80 A 4.5209 8.3039 121.2728 51.7811 19.0836 174.9431 81 P 4.8810 0.0000 0.0000 62.1222 33.7139 174.6030 82 Q 4.8180 8.4570 120.9879 54.4505 30.3170 174.9274 83 V 4.4614 8.3487 124.6853 60.7977 34.2772 174.5163 84 Y 5.1160 9.1924 126.5986 58.6157 39.1645 175.4145 85 I 5.0198 8.5680 115.9254 58.5993 41.6549 175.5419 86 G 4.4869 9.2088 107.8434 47.0334 0.0000 173.0213 87 M 4.1943 8.2096 121.9316 54.7536 33.3198 175.2181 88 K 4.6752 9.0063 125.6333 54.4075 36.1258 175.3727 89 V 4.4495 8.3371 123.5901 60.5219 33.8771 173.9512 90 G 3.9544 8.9202 126.9039 46.6716 0.0000 174.7287 91 S 4.2513 9.0319 118.7896 61.2893 63.5600 174.3370 92 T 3.9652 8.0652 114.5754 62.0952 67.7450 175.1535 93 N 4.4241 8.5920 123.2706 54.9841 38.5877 175.8195 94 S 4.5716 7.5001 111.8714 58.3776 63.9124 174.9707 95 D 4.7041 7.5918 124.2581 53.3308 39.0603 173.9498 96 Q 5.1050 7.9276 118.4116 54.3402 30.8498 175.4470 97 T 4.7361 8.5340 113.3785 59.7246 72.7339 172.9769 98 W 5.4820 8.5939 121.8338 55.6552 31.1565 177.6817 99 T 4.1473 8.6987 112.7660 64.2771 68.6376 175.6567 100 D 3.9456 8.1361 119.8459 53.8879 39.7537 177.1781 101 G 3.9935 7.9281 108.9628 45.2723 0.0000 173.7908 102 S 4.4274 8.7040 114.7262 58.2078 63.6850 173.4962 103 S 4.9844 8.2727 115.1142 56.7004 64.6580 175.5749 104 V 4.4410 8.3889 123.1625 63.0181 28.9507 174.9169 105 D 5.0060 8.5939 118.7496 52.4542 40.1500 176.4332 106 Y 4.7331 8.0646 119.9773 56.2313 41.6166 173.5336 107 D 4.5240 8.0180 126.7321 52.7837 41.8777 175.4174 108 G 2.9502 5.9007 114.6413 44.2295 0.0000 171.6317 109 W 4.7725 7.0405 118.8633 56.0075 29.9692 176.6062 110 V 3.6318 9.2357 123.9534 62.9864 32.3902 174.7259 111 S 4.0983 8.3342 121.2826 60.8352 61.8039 174.1086 112 G 4.0891 9.4147 116.6174 45.0779 0.0000 172.5017 113 E 4.5288 8.1994 118.9976 53.7504 31.3996 174.0968 114 P 4.3333 0.0000 0.0000 62.6122 32.2355 175.6113 115 N 4.4496 8.3003 112.2911 53.5151 40.3897 174.6575 116 N 4.7620 8.7567 116.6560 53.0027 39.1436 174.8417 117 G 3.7459 7.6766 107.8644 44.0212 0.0000 172.1288 118 P 4.9090 0.0000 0.0000 62.9917 31.8060 175.2661 119 N 4.1115 8.3270 114.2166 54.4247 36.4902 174.9023 120 S 4.6272 7.5952 112.6105 57.6929 65.9242 172.5721 121 R 4.8761 8.7777 117.1847 54.6040 34.5640 175.3341 122 G 4.4172 8.7914 108.6752 45.7007 0.0000 172.5820 123 A 5.1090 8.8260 121.8056 49.9054 23.2333 175.9270 124 I 4.2950 8.6203 122.8060 61.6266 38.6055 175.1772 125 A 5.0328 8.7608 128.5319 50.2612 19.9335 176.4132 126 A 4.1036 9.1375 123.0156 53.6299 19.1551 178.0101 127 G 3.9281 8.6510 104.1391 46.6016 0.0000 174.7339 128 D 4.4250 9.0310 120.9511 56.9247 41.3487 178.3841 129 Y 4.1356 8.1428 120.2567 60.5983 38.7836 177.1640 130 S 3.6286 7.8310 112.3705 58.1893 63.6508 174.4232 131 R 3.8339 9.0466 116.6973 57.3231 28.6308 176.1086 132 G 3.9005 7.8958 107.5515 47.4985 0.0000 175.0926 133 F 4.5206 7.6047 117.7219 57.0785 40.4768 174.9579 134 W 5.5054 8.8940 120.1252 56.3369 30.8563 175.7328 135 A 5.7425 9.2638 123.1685 50.4899 22.3887 174.5973 136 D 5.6942 9.2764 120.0575 52.2592 41.7804 176.0634 137 V 4.6409 8.8175 113.8009 60.3518 36.9025 173.4393 138 Y 4.8732 8.9506 118.0747 56.9319 39.3782 177.6120 139 S 4.2072 9.0965 117.7565 61.2505 63.0696 175.4800 140 N 4.7964 8.1782 115.3998 52.9123 38.1538 174.8342 141 N 4.2855 8.4364 118.0102 54.1060 40.0005 173.7727 142 N 4.9816 8.1669 119.5077 51.8515 40.2648 173.8449 143 F 5.0753 8.9947 121.8089 55.0020 44.2199 174.7771 144 K 4.7699 8.6433 119.0675 57.2129 33.2900 175.7278 145 Y 5.5065 8.2530 119.4609 55.6548 42.3890 173.7395 146 I 5.0062 8.5157 120.0249 59.9511 39.9074 174.5782 147 C 5.6350 9.3787 124.5636 55.5200 42.3181 172.6120 148 Q 5.3737 9.1902 119.1978 54.3715 31.1070 175.2355 149 L 4.3492 8.6174 122.3481 53.4541 42.6894 175.2216 150 P 4.0668 0.0000 0.0000 63.5222 31.6913 175.4761 151 C 4.4028 8.4873 122.9018 58.2130 32.2853 173.0115 152 V 4.5548 7.8600 119.1798 60.2987 35.3221 173.5790 153 H 4.7335 8.0304 116.6099 53.7819 31.4854 172.7766 154 Y 4.3363 8.1205 118.8926 58.2181 38.3395 175.6815 155 T 4.4849 8.4984 114.2779 60.4882 69.3939 174.0905 156 L 4.6655 8.2906 127.2222 56.1528 42.4004 176.6870 157 E 4.1180 7.8205 123.9052 56.0111 28.9309 177.2862 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 L 8.18 4.20 0.00 1.56 1.63 0.89 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 3 T 8.27 4.18 4.17 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 1.12 0.00 0.00 4 S 9.17 4.68 0.00 3.79 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 C 8.34 4.98 0.00 2.94 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 6 P 0.00 4.47 0.00 2.06 1.90 0.00 3.30 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.82 0.00 7 P 0.00 4.54 0.00 2.24 2.10 0.00 3.84 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.03 0.00 8 L 8.78 3.91 0.00 1.90 1.83 0.90 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 9 W 7.81 4.76 0.00 3.26 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 10 T 9.05 4.81 4.36 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 1.52 0.00 0.00 11 G 8.78 4.54 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 12 F 8.90 4.47 0.00 1.56 2.53 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 0.00 0.00 0.00 0.00 13 N 9.12 3.94 0.00 2.73 2.70 0.00 0.00 7.21 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 G 8.07 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 K 7.58 4.37 0.00 1.57 1.17 0.00 1.65 0.00 0.00 1.79 0.00 0.00 2.95 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.24 1.30 7.81 16 C 8.01 5.36 0.00 2.56 2.89 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 17 F 9.87 5.93 0.00 3.26 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 R 8.70 4.49 0.00 0.67 0.66 0.00 2.21 0.00 0.00 2.25 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.70 0.00 19 L 8.09 4.55 0.00 1.47 1.31 0.79 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 20 F 8.86 4.33 0.00 1.51 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 21 H 8.98 4.47 0.00 3.11 3.37 0.00 5.69 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 N 8.09 4.88 0.00 2.95 2.97 0.00 0.00 6.10 7.90 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 23 H 9.15 4.65 0.00 3.07 3.39 0.00 5.84 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 24 L 9.12 5.10 0.00 1.55 1.41 0.98 0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 25 N 8.59 5.66 0.00 3.10 3.03 0.00 0.00 6.36 8.12 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 26 F 9.04 3.10 0.00 2.66 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 27 D 8.38 4.37 0.00 2.84 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 28 N 8.09 4.22 0.00 2.67 2.78 0.00 0.00 6.85 7.81 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 29 A 7.69 3.11 0.77 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 0.00 0.00 0.00 0.00 0.00 0.00 30 E 7.68 3.56 0.00 1.56 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.29 0.00 31 N 7.79 4.13 0.00 2.84 2.83 0.00 0.00 7.27 7.48 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 32 A 8.02 4.01 1.22 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 0.00 0.00 33 C 7.99 4.65 0.00 3.18 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 34 R 7.74 4.08 0.00 1.85 1.93 0.00 3.13 0.00 0.00 3.20 7.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.87 0.00 35 Q 7.56 3.95 0.00 1.56 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.81 6.86 0.00 0.00 0.00 0.00 0.00 2.48 2.36 0.00 36 F 7.24 4.52 0.00 2.97 2.90 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 37 G 8.29 4.17 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 0.00 0.00 0.00 38 L 8.66 4.87 0.00 1.61 1.43 0.87 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 39 A 8.56 5.32 1.22 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 0.00 0.00 40 S 8.69 4.37 0.00 4.03 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 41 C 8.70 4.12 0.00 2.98 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 42 S 7.35 4.15 0.00 4.13 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 43 G 7.67 3.62 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 0.00 0.00 0.00 44 D 8.07 4.40 0.00 2.72 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 45 E 8.78 4.27 0.00 1.89 1.86 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 2.29 2.39 0.00 46 L 8.55 4.64 0.00 1.64 1.67 0.93 0.63 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 47 A 7.40 4.52 1.19 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 0.00 0.00 48 T 8.41 4.94 4.22 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 0.98 0.00 0.00 49 G 8.84 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 50 H 8.95 5.10 0.00 3.11 3.22 0.00 5.64 0.00 0.00 0.00 0.00 6.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 L 8.97 4.64 0.00 1.62 1.67 0.20 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 52 A 9.03 4.50 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 53 S 8.52 3.38 0.00 2.72 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 54 I 5.42 4.38 2.30 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.39 0.96 0.00 0.00 55 H 8.38 5.16 0.00 3.10 3.35 0.00 5.93 0.00 0.00 0.00 0.00 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 S 7.29 4.31 0.00 4.09 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 57 A 8.26 3.93 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 58 E 8.08 3.91 0.00 2.22 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 2.51 2.55 0.00 59 S 8.08 3.89 0.00 3.94 3.81 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 60 Q 8.01 3.85 0.00 2.14 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.82 0.00 0.00 0.00 0.00 0.00 2.59 2.33 0.00 61 A 7.89 3.84 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 62 F 7.71 3.75 0.00 2.02 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 L 7.49 3.22 0.00 1.44 1.38 0.57 -0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 64 T 7.52 3.60 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 0.97 0.00 0.00 65 E 8.00 3.73 0.00 1.96 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 2.19 2.21 0.00 66 L 7.52 3.57 0.00 1.08 1.34 0.71 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 67 V 7.46 3.38 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 0.87 0.00 0.00 0.80 0.00 0.00 68 K 7.91 3.76 0.00 1.72 1.80 0.00 1.63 0.00 0.00 1.66 0.00 0.00 2.99 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.41 1.37 7.81 69 T 8.09 4.08 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 1.17 0.00 0.00 70 S 7.97 4.27 0.00 4.00 3.88 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 71 L 7.77 4.90 0.00 1.81 1.54 0.84 1.22 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 72 P 0.00 4.31 0.00 2.27 2.28 0.00 3.41 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 2.05 2.23 0.00 73 D 8.03 4.51 0.00 2.69 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 L 7.79 4.42 0.00 1.73 1.72 0.97 1.10 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 75 I 7.19 4.04 1.96 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.70 0.89 0.00 0.00 76 T 8.57 4.45 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 77 G 8.86 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 78 G 8.30 4.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 W 9.79 4.89 0.00 3.37 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 A 8.30 4.52 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 81 P 0.00 4.88 0.00 2.10 2.19 0.00 3.67 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.97 0.00 82 Q 8.46 4.82 0.00 0.96 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.72 0.00 0.00 0.00 0.00 0.00 2.28 2.34 0.00 83 V 8.35 4.46 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 0.99 0.00 0.00 0.83 0.00 0.00 84 Y 9.19 5.12 0.00 3.14 2.90 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 85 I 8.57 5.02 2.09 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.98 0.86 0.00 0.00 86 G 9.21 4.49 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 87 M 8.21 4.19 0.00 1.84 0.94 0.00 0.00 0.00 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.11 0.00 88 K 9.01 4.68 0.00 1.62 1.52 0.00 1.84 0.00 0.00 1.62 0.00 0.00 2.76 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.01 1.29 7.81 89 V 8.34 4.45 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 0.83 0.00 0.00 0.98 0.00 0.00 90 G 8.92 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 91 S 9.03 4.25 0.00 3.85 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 T 8.07 3.97 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 1.33 0.00 0.00 93 N 8.59 4.42 0.00 2.63 2.67 0.00 0.00 6.90 7.57 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 94 S 7.50 4.57 0.00 3.96 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 95 D 7.59 4.70 0.00 2.58 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 96 Q 7.93 5.10 0.00 1.94 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.60 6.80 0.00 0.00 0.00 0.00 0.00 2.38 2.36 0.00 97 T 8.53 4.74 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 1.22 0.00 0.00 98 W 8.59 5.48 0.00 3.54 3.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 T 8.70 4.15 4.57 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 1.43 0.00 0.00 100 D 8.14 3.95 0.00 2.75 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 0.00 101 G 7.93 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 0.00 0.00 0.00 102 S 8.70 4.43 0.00 3.93 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 0.00 103 S 8.27 4.98 0.00 4.12 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 0.00 104 V 8.39 4.44 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 0.94 0.00 0.00 0.84 0.00 0.00 105 D 8.59 5.01 0.00 2.98 2.89 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 0.00 106 Y 8.06 4.73 0.00 3.16 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 0.00 107 D 8.02 4.52 0.00 2.59 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 0.00 0.00 0.00 0.00 108 G 5.90 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 0.00 0.00 0.00 109 W 7.04 4.77 0.00 3.14 3.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 V 9.24 3.63 2.37 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 0.55 0.00 0.00 0.99 0.00 0.00 111 S 8.33 4.10 0.00 3.85 3.78 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 0.00 112 G 9.41 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 0.00 0.00 0.00 113 E 8.20 4.53 0.00 2.36 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 0.00 2.57 2.88 0.00 114 P 0.00 4.33 0.00 1.78 1.16 0.00 2.98 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.88 0.00 115 N 8.30 4.45 0.00 2.74 2.95 0.00 0.00 6.79 7.40 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 0.00 116 N 8.76 4.76 0.00 2.26 2.09 0.00 0.00 6.89 8.20 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 0.00 117 G 7.68 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 0.00 118 P 0.00 4.91 0.00 2.15 2.03 0.00 3.50 0.00 0.00 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.93 0.00 119 N 8.33 4.11 0.00 2.88 2.90 0.00 0.00 6.95 6.85 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 0.00 120 S 7.60 4.63 0.00 3.88 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 0.00 121 R 8.78 4.88 0.00 1.79 1.23 0.00 2.21 0.00 0.00 2.25 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 1.39 0.00 122 G 8.79 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 0.00 0.00 0.00 0.00 123 A 8.83 5.11 1.05 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 0.00 124 I 8.62 4.29 1.82 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 1.43 0.70 0.88 0.00 0.00 125 A 8.76 5.03 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 A 9.14 4.10 1.22 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 0.00 0.00 127 G 8.65 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 0.00 0.00 0.00 128 D 9.03 4.42 0.00 2.68 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 0.00 129 Y 8.14 4.14 0.00 3.07 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 0.00 130 S 7.83 3.63 0.00 3.68 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 0.00 131 R 9.05 3.83 0.00 1.99 2.00 0.00 2.89 0.00 0.00 3.28 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.73 0.00 132 G 7.90 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 0.00 133 F 7.60 4.52 0.00 3.17 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 W 8.89 5.51 0.00 2.85 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 A 9.26 5.74 1.64 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 0.00 136 D 9.28 5.69 0.00 2.80 2.92 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 0.00 137 V 8.82 4.64 2.59 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 0.91 0.00 0.00 1.36 0.00 0.00 138 Y 8.95 4.87 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 0.00 139 S 9.10 4.21 0.00 3.99 4.14 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.18 4.80 0.00 2.89 3.03 0.00 0.00 6.03 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 0.00 141 N 8.44 4.29 0.00 3.12 2.27 0.00 0.00 6.77 6.43 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 0.00 142 N 8.17 4.98 0.00 2.45 2.75 0.00 0.00 6.74 7.45 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 0.00 143 F 8.99 5.08 0.00 2.62 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 K 8.64 4.77 0.00 1.69 1.79 0.00 1.56 0.00 0.00 1.71 0.00 0.00 2.94 0.00 0.00 3.24 0.00 0.00 0.00 0.00 1.70 1.35 7.81 145 Y 8.25 5.51 0.00 3.14 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 0.00 146 I 8.52 5.01 1.93 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.68 1.00 0.00 0.00 147 C 9.38 5.64 0.00 3.19 3.28 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 0.00 148 Q 9.19 5.37 0.00 1.80 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.93 0.00 0.00 0.00 0.00 0.00 2.51 2.32 0.00 149 L 8.62 4.35 0.00 1.13 1.28 -0.07 0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 150 P 0.00 4.07 0.00 1.96 1.99 0.00 3.51 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 1.96 2.18 0.00 151 C 8.49 4.40 0.00 2.86 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 0.00 152 V 7.86 4.55 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 0.70 0.00 0.00 0.76 0.00 0.00 153 H 8.03 4.73 0.00 3.14 3.11 0.00 5.53 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 0.00 154 Y 8.12 4.34 0.00 3.06 2.85 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 0.00 155 T 8.50 4.48 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 1.19 0.00 0.00 156 L 8.29 4.67 0.00 1.66 1.70 0.93 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 157 E 7.82 4.12 0.00 1.96 1.83 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 2.33 2.44 0.00