NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.2432 8.3144 119.9987 56.4699 33.8659 174.2830 2 E 4.1338 8.2661 119.9228 53.5915 30.4050 174.0157 3 T 4.1432 8.7470 118.9141 61.1980 72.0424 174.6967 4 A 3.9700 8.7933 125.2392 55.7011 18.2780 179.8308 5 A 3.9431 8.1217 118.1384 55.5534 18.3721 179.6125 6 A 4.0625 7.6908 118.5462 54.9538 18.6093 179.7299 7 K 4.1321 8.3885 119.9376 58.9483 32.1348 178.9309 8 F 4.0792 8.4575 121.1318 61.2653 39.4598 176.8769 9 E 4.0765 8.4005 118.3030 59.6814 29.0984 179.4875 10 R 3.9142 8.1754 117.6276 59.2101 30.2201 177.8932 11 Q 4.1027 7.7045 116.0778 57.0227 29.4288 175.9278 12 H 4.6244 8.0091 114.3954 54.1418 31.0053 173.2197 13 M 4.8882 7.8844 118.2411 53.8528 34.4039 176.3416 14 D 4.6186 9.0968 122.5123 53.7495 41.7875 175.6417 15 S 4.3441 8.6456 121.2037 60.7131 63.6268 176.7599 16 S 4.3078 8.3009 114.3912 60.5658 62.5985 174.4277 17 T 4.6905 7.2095 105.9725 59.6344 70.9788 173.9268 18 S 4.4691 8.2353 115.5347 58.1697 63.9249 173.4466 19 A 3.9016 6.7805 121.1986 51.3733 21.2385 175.5359 20 A 3.4052 8.7457 124.5068 51.3697 18.7577 178.1698 21 S 4.1897 8.6715 119.1598 60.7731 63.5263 174.4130 22 S 4.8293 7.6384 114.6313 54.9913 65.9510 174.6941 23 S 4.2368 8.6288 114.6425 60.5708 62.9899 174.4122 24 N 4.6766 7.7944 117.6034 53.7129 39.4237 175.4630 25 Y 4.1001 8.1071 119.2315 62.2556 38.7441 177.7594 26 C 4.1854 8.1625 116.4092 59.7454 38.4675 175.9083 27 N 4.4035 8.1648 118.8246 55.9003 38.0955 177.4661 28 Q 3.7556 7.7848 118.6555 59.4593 29.0720 177.6335 29 M 3.7538 7.4846 122.4709 57.4062 32.1123 177.9572 30 M 3.9896 7.8528 117.7408 57.8944 32.2074 177.8991 31 K 4.1240 7.5387 121.8045 58.2404 32.5667 178.7763 32 S 4.2021 8.4174 114.6192 60.7222 62.7570 175.6150 33 R 4.2960 7.9568 119.6778 55.4286 30.0737 175.7853 34 N 4.3504 8.0181 115.9612 54.6262 36.2131 175.3576 35 L 4.4208 8.0098 116.6768 55.4287 41.7193 178.1158 36 T 5.3707 7.3384 108.5329 60.4615 69.0378 176.3281 37 K 4.1728 8.3558 125.6743 59.6803 32.4055 177.2206 38 D 4.7534 7.8742 114.6712 53.7802 43.6869 175.1869 39 R 4.0378 7.2231 113.1592 54.8404 31.9015 174.3560 40 C 4.9075 8.5252 117.1753 56.0426 41.0315 173.5499 41 K 4.2717 8.4365 127.2190 55.3550 32.0546 174.8163 42 P 4.5872 0.0000 0.0000 65.2225 32.4889 176.4534 43 V 5.0231 7.6603 118.2198 61.0773 34.7587 174.3924 44 N 4.8407 8.9859 124.4753 52.6166 42.6821 172.9304 45 T 4.8622 7.9906 121.3339 61.6134 72.2009 172.5656 46 F 5.0311 8.8610 124.6563 55.7884 41.4418 174.7236 47 V 4.6095 9.0814 124.2350 61.1897 33.3062 175.4850 48 H 5.7635 8.5681 125.4954 53.9856 26.8881 172.0164 49 E 4.7578 7.5965 117.5497 53.7348 34.5167 176.1830 50 S 4.4292 8.3606 114.0907 58.1404 65.2316 174.4820 51 L 3.9472 8.7048 124.8884 58.7620 41.7395 179.4527 52 A 4.0091 7.9382 119.9538 55.2603 18.2017 179.2248 53 D 4.3516 7.8115 116.3764 57.0740 41.1399 178.9404 54 V 3.7993 8.0291 118.8863 65.9504 31.7303 177.7603 55 Q 3.8149 8.5760 117.9707 59.3302 28.6110 179.2389 56 A 3.9141 7.7937 120.7396 55.2495 18.1384 179.5008 57 V 3.5864 7.6369 116.6499 66.6616 31.2584 177.3275 58 C 3.6552 7.8868 114.2643 58.5726 39.9465 174.5531 59 S 4.6828 7.7617 116.0050 58.1457 63.8733 174.4395 60 Q 4.1333 7.4036 120.7988 55.5732 28.3830 178.5525 61 K 4.2762 8.4532 132.4187 57.2690 32.5577 174.7285 62 N 4.6319 8.8160 127.4257 53.7523 39.8607 174.2462 63 V 4.6146 8.6306 118.3060 59.3715 36.9967 174.4272 64 A 4.2182 8.3604 124.5392 51.9718 19.1392 178.5028 65 C 4.5673 8.8467 119.8174 56.2019 41.0013 175.2457 66 K 3.6132 8.5433 121.3484 59.1076 31.6667 177.8774 67 N 4.6863 8.0209 113.5257 52.3336 37.5913 175.5196 68 G 4.0244 8.3487 107.9459 45.6363 0.0000 174.3750 69 Q 4.2381 7.9505 119.7850 55.7847 29.3872 176.6948 70 T 4.1960 8.4582 117.3947 64.4769 68.7830 174.4977 71 N 4.9650 7.8386 119.4842 52.8974 38.6077 174.8073 72 C 5.1617 7.4266 115.0811 56.6823 41.2726 172.6098 73 Y 5.3262 8.9629 118.6049 56.2100 41.6741 174.3300 74 Q 5.7321 9.0643 120.2521 53.0580 31.8154 175.1264 75 S 4.4115 8.6963 116.3255 58.8938 63.1523 174.1514 76 Y 4.5061 9.1567 121.1568 60.5004 37.8353 176.3012 77 S 4.7798 7.9169 113.4550 56.9242 65.5253 172.5313 78 T 4.6020 8.0658 109.8312 60.5698 70.5493 174.0232 79 M 4.9281 8.9662 122.8077 53.2358 36.4188 174.8675 80 S 4.8180 9.0868 117.5457 58.5153 63.7309 173.0411 81 I 5.1634 9.1205 120.1746 59.8224 41.5107 173.9164 82 T 4.9434 9.1112 122.2360 61.9522 70.6671 173.4880 83 D 4.8491 8.7943 127.4406 54.2653 42.7111 175.1372 84 C 5.7386 9.2059 119.3223 55.2273 42.2660 173.2388 85 R 5.6077 8.9870 120.4969 54.1479 32.3351 174.6720 86 E 4.8294 8.8597 120.3857 55.4675 30.7888 176.8196 87 T 4.2297 8.2334 112.7224 60.6652 70.1320 175.6746 88 G 3.6021 8.5438 110.8773 48.5241 0.0000 174.6266 89 S 4.4450 7.8487 111.6415 58.1687 63.5008 174.0684 90 S 4.1657 7.7007 116.6697 58.2904 62.7494 173.7535 91 K 4.3094 8.2920 127.6855 55.1969 33.8930 174.3220 92 Y 4.2715 8.7537 127.8288 57.9595 38.9095 174.4223 93 P 3.1403 0.0000 0.0000 63.0993 32.2400 176.6292 94 N 4.7175 7.7503 118.2051 51.2807 37.1122 173.4410 95 C 4.2186 8.0851 115.9716 57.1533 41.8004 173.2612 96 A 5.1696 8.8310 126.7316 50.3629 21.1538 174.8157 97 Y 5.1349 9.0149 118.9385 55.9856 42.1192 174.8619 98 K 4.5596 9.4258 123.6657 55.3625 34.2578 175.0499 99 T 5.0647 8.5958 124.2189 62.5814 70.1018 174.1392 100 T 4.6391 8.8125 123.0574 61.6778 71.9154 172.6092 101 Q 5.0608 8.7302 127.1033 54.4195 30.8665 174.2608 102 A 4.6358 9.0891 126.8133 50.8173 23.4753 174.6502 103 N 5.2390 8.7633 119.1857 52.1229 39.6443 173.3809 104 K 4.6527 8.6033 124.8501 55.5733 37.0939 174.6408 105 H 4.7513 9.1264 117.7085 55.8993 29.8102 175.2770 106 I 4.7377 8.3596 116.2046 59.8189 40.3114 174.6273 107 I 4.6931 8.6439 125.4838 59.8322 39.5880 175.0964 108 V 4.6138 8.3831 120.1079 59.3703 35.1568 174.6569 109 A 5.1329 8.4895 124.3694 50.7369 21.2772 175.4591 110 C 5.2222 8.6263 117.7540 55.2783 37.9422 173.5628 111 E 4.8467 8.8279 120.0236 56.3704 34.3016 175.3456 112 G 4.1446 9.8134 107.9544 44.6020 0.0000 171.6893 113 N 5.0319 8.1778 116.2587 50.6428 40.2762 172.2851 114 P 4.3005 0.0000 0.0000 62.8043 31.9582 175.9557 115 Y 4.8561 8.3662 121.9137 56.7569 38.6664 174.3280 116 V 4.4388 7.9710 126.7654 59.6630 34.8829 172.9904 117 P 4.3972 0.0000 0.0000 63.2805 30.8782 175.9625 118 V 4.4553 8.5579 121.6903 62.9608 33.7006 174.5704 119 H 5.0663 8.0376 118.1280 55.3668 33.3311 171.4645 120 F 4.7787 8.5894 126.3079 56.8793 40.0312 174.2374 121 D 4.8091 7.9551 125.5177 55.3374 43.1133 175.5690 122 A 4.6497 6.5471 117.2510 51.5807 22.2400 175.0762 123 S 5.3142 8.7595 113.1743 57.0714 66.8863 174.5329 124 V 4.1322 8.6807 119.3915 62.4030 31.3298 173.5910 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 8.31 4.24 0.00 1.87 1.92 0.00 1.43 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.31 1.51 7.81 2 E 8.27 4.13 0.00 2.11 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 2.36 2.37 0.00 3 T 8.75 4.14 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 4 A 8.79 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 5 A 8.12 3.94 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 6 A 7.69 4.06 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 7 K 8.39 4.13 0.00 1.97 1.97 0.00 1.70 0.00 0.00 1.70 0.00 0.00 2.87 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.44 1.65 7.81 8 F 8.46 4.08 0.00 3.13 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 9 E 8.40 4.08 0.00 2.31 2.06 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 2.47 2.52 0.00 10 R 8.18 3.91 0.00 1.78 1.94 0.00 3.44 0.00 0.00 3.22 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.67 0.00 11 Q 7.70 4.10 0.00 1.54 1.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.47 0.00 0.00 0.00 0.00 0.00 2.21 2.44 0.00 12 H 8.01 4.62 0.00 1.81 2.73 0.00 5.58 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 M 7.88 4.89 0.00 1.99 2.20 0.00 0.00 0.00 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.73 2.74 0.00 14 D 9.10 4.62 0.00 2.72 2.46 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 15 S 8.65 4.34 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 16 S 8.30 4.31 0.00 3.98 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 17 T 7.21 4.69 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 1.22 0.00 0.00 18 S 8.24 4.47 0.00 3.96 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 19 A 6.78 3.90 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 A 8.75 3.41 0.69 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 0.00 0.00 21 S 8.67 4.19 0.00 4.02 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 22 S 7.64 4.83 0.00 3.99 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 23 S 8.63 4.24 0.00 4.03 4.06 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 24 N 7.79 4.68 0.00 2.89 2.84 0.00 0.00 6.62 7.44 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 25 Y 8.11 4.10 0.00 3.09 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 C 8.16 4.19 0.00 3.13 3.14 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 27 N 8.16 4.40 0.00 2.92 2.89 0.00 0.00 6.63 7.69 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 28 Q 7.78 3.76 0.00 2.16 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.85 0.00 0.00 0.00 0.00 0.00 2.53 2.25 0.00 29 M 7.48 3.75 0.00 1.13 1.05 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.96 0.00 30 M 7.85 3.99 0.00 1.90 1.83 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 1.97 0.00 31 K 7.54 4.12 0.00 2.16 1.89 0.00 1.72 0.00 0.00 1.78 0.00 0.00 2.97 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.40 1.43 7.81 32 S 8.42 4.20 0.00 3.98 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 33 R 7.96 4.30 0.00 1.84 2.17 0.00 3.40 0.00 0.00 3.14 7.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 2.05 0.00 34 N 8.02 4.35 0.00 2.95 2.95 0.00 0.00 6.90 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 35 L 8.01 4.42 0.00 1.65 1.62 0.69 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 36 T 7.34 5.37 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 1.42 0.00 0.00 37 K 8.36 4.17 0.00 1.92 1.91 0.00 1.73 0.00 0.00 1.72 0.00 0.00 2.99 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.48 1.50 7.81 38 D 7.87 4.75 0.00 2.51 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 39 R 7.22 4.04 0.00 1.88 1.77 0.00 2.98 0.00 0.00 3.31 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.59 0.00 40 C 8.53 4.91 0.00 3.13 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 41 K 8.44 4.27 0.00 1.87 1.75 0.00 1.75 0.00 0.00 1.67 0.00 0.00 3.03 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.46 1.38 7.81 42 P 0.00 4.59 0.00 2.19 2.46 0.00 3.73 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 1.99 0.00 43 V 7.66 5.02 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.98 0.00 0.00 44 N 8.99 4.84 0.00 2.65 2.29 0.00 0.00 6.78 6.54 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 45 T 7.99 4.86 2.77 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 0.93 0.00 0.00 46 F 8.86 5.03 0.00 2.96 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 V 9.08 4.61 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 1.23 0.00 0.00 1.10 0.00 0.00 48 H 8.57 5.76 0.00 3.03 3.36 0.00 5.62 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 E 7.60 4.76 0.00 1.95 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 2.27 0.00 50 S 8.36 4.43 0.00 4.07 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 51 L 8.70 3.95 0.00 1.82 1.76 1.00 1.11 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 52 A 7.94 4.01 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.81 4.35 0.00 2.84 2.77 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 54 V 8.03 3.80 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 1.23 0.00 0.00 1.06 0.00 0.00 55 Q 8.58 3.81 0.00 2.10 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.50 0.00 0.00 0.00 0.00 0.00 2.31 2.54 0.00 56 A 7.79 3.91 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 57 V 7.64 3.59 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 1.11 0.00 0.00 0.94 0.00 0.00 58 C 7.89 3.66 0.00 2.85 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 59 S 7.76 4.68 0.00 3.77 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 60 Q 7.40 4.13 0.00 1.82 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 7.02 0.00 0.00 0.00 0.00 0.00 1.30 1.87 0.00 61 K 8.45 4.28 0.00 2.10 1.80 0.00 1.70 0.00 0.00 1.66 0.00 0.00 2.84 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.72 1.69 7.81 62 N 8.82 4.63 0.00 2.91 2.74 0.00 0.00 6.99 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 63 V 8.63 4.61 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 0.75 0.00 0.00 0.83 0.00 0.00 64 A 8.36 4.22 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 65 C 8.85 4.57 0.00 3.10 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 66 K 8.54 3.61 0.00 1.73 1.90 0.00 1.71 0.00 0.00 1.77 0.00 0.00 3.13 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.49 1.54 7.81 67 N 8.02 4.69 0.00 2.80 2.89 0.00 0.00 6.30 7.00 0.00 0.00 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 G 8.35 4.02 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 0.00 0.00 0.00 69 Q 7.95 4.24 0.00 2.05 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.86 6.90 0.00 0.00 0.00 0.00 0.00 2.35 2.45 0.00 70 T 8.46 4.20 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 1.18 0.00 0.00 71 N 7.84 4.96 0.00 2.92 3.04 0.00 0.00 6.11 7.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 C 7.43 5.16 0.00 2.96 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 Y 8.96 5.33 0.00 2.72 2.84 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 74 Q 9.06 5.73 0.00 2.17 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.97 0.00 0.00 0.00 0.00 0.00 2.22 2.14 0.00 75 S 8.70 4.41 0.00 3.93 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 76 Y 9.16 4.51 0.00 2.99 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 77 S 7.92 4.78 0.00 4.00 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 78 T 8.07 4.60 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 1.07 0.00 0.00 79 M 8.97 4.93 0.00 1.95 2.02 0.00 0.00 0.00 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.48 0.00 80 S 9.09 4.82 0.00 3.93 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 81 I 9.12 5.16 1.87 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 1.41 1.01 1.01 0.00 0.00 82 T 9.11 4.94 4.46 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 1.26 0.00 0.00 83 D 8.79 4.85 0.00 2.65 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 84 C 9.21 5.74 0.00 2.89 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.99 5.61 0.00 1.87 2.05 0.00 2.98 0.00 0.00 3.27 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.72 0.00 86 E 8.86 4.83 0.00 1.57 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 0.00 2.18 1.94 0.00 87 T 8.23 4.23 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 1.20 0.00 0.00 88 G 8.54 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 89 S 7.85 4.44 0.00 3.97 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 90 S 7.70 4.17 0.00 3.86 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 91 K 8.29 4.31 0.00 1.82 1.60 0.00 1.70 0.00 0.00 1.75 0.00 0.00 2.96 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.42 1.51 7.81 92 Y 8.75 4.27 0.00 2.95 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 93 P 0.00 3.14 0.00 1.74 1.30 0.00 3.53 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.67 0.00 94 N 7.75 4.72 0.00 2.64 2.73 0.00 0.00 6.96 8.08 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 95 C 8.09 4.22 0.00 3.20 3.19 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 96 A 8.83 5.17 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 Y 9.01 5.13 0.00 2.86 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 K 9.43 4.56 0.00 1.82 1.72 0.00 1.64 0.00 0.00 1.68 0.00 0.00 2.88 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.40 1.43 7.81 99 T 8.60 5.06 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 1.30 0.00 0.00 100 T 8.81 4.64 4.27 0.00 0.00 0.00 0.00 0.00 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 0.00 101 Q 8.73 5.06 0.00 1.92 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.76 0.00 0.00 0.00 0.00 0.00 2.15 2.34 0.00 102 A 9.09 4.64 1.21 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 0.00 0.00 103 N 8.76 5.24 0.00 2.70 2.75 0.00 0.00 6.79 6.68 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 0.00 104 K 8.60 4.65 0.00 2.09 1.91 0.00 1.40 0.00 0.00 1.69 0.00 0.00 2.89 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.38 1.49 7.81 105 H 9.13 4.75 0.00 3.26 3.32 0.00 5.60 0.00 0.00 0.00 0.00 6.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 I 8.36 4.74 1.95 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.67 1.16 0.00 0.00 107 I 8.64 4.69 1.80 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.45 0.84 0.00 0.00 108 V 8.38 4.61 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 0.62 0.00 0.00 0.82 0.00 0.00 109 A 8.49 5.13 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 0.00 110 C 8.63 5.22 0.00 1.82 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 0.00 0.00 0.00 0.00 111 E 8.83 4.85 0.00 1.85 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.26 0.00 112 G 9.81 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 0.00 0.00 0.00 113 N 8.18 5.03 0.00 2.62 2.70 0.00 0.00 6.90 7.69 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 0.00 114 P 0.00 4.30 0.00 2.22 2.05 0.00 3.82 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.96 0.00 115 Y 8.37 4.86 0.00 2.83 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 0.00 116 V 7.97 4.44 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 0.83 0.00 0.00 0.89 0.00 0.00 117 P 0.00 4.40 0.00 0.49 1.40 0.00 3.48 0.00 0.00 3.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.54 0.00 118 V 8.56 4.46 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 0.78 0.00 0.00 0.89 0.00 0.00 119 H 8.04 5.07 0.00 3.33 3.09 0.00 5.89 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 F 8.59 4.78 0.00 2.54 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 0.00 121 D 7.96 4.81 0.00 2.59 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 0.00 122 A 6.55 4.65 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 0.00 123 S 8.76 5.31 0.00 3.97 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 0.00 124 V 8.68 4.13 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.57 0.00 0.00 0.95 0.00 0.00