NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 H 4.6538 8.4293 116.1976 55.1660 30.3309 173.2561 2 C 4.1161 7.6592 114.1017 56.9234 30.1177 172.1912 3 D 4.5774 8.3624 118.5687 55.0224 40.2066 175.4013 4 L 4.0717 8.0238 120.4759 57.1605 42.2449 175.7246 5 P 4.5596 0.0000 0.0000 62.2472 32.3461 175.3931 6 C 4.2389 8.4270 113.4623 57.9835 30.5388 174.9638 7 G 3.8854 8.2224 107.5924 45.3998 0.0000 172.9081 8 V 4.2585 7.1732 119.0949 61.0682 32.4909 174.4028 9 Y 4.6973 8.0764 123.7632 56.5558 42.0111 174.7316 10 D 3.8032 7.9323 119.2346 51.7372 43.6013 174.5231 11 P 4.0986 0.0000 0.0000 64.6018 31.2153 178.0568 12 A 3.9666 8.6429 120.7491 55.1167 18.0389 179.6549 13 Q 3.7811 7.9941 116.4220 59.0674 28.7603 178.8750 14 A 4.0449 7.7613 121.2662 54.9811 18.4268 179.4086 15 R 3.8367 8.2021 117.4618 59.7533 30.3165 178.7540 16 I 3.7083 8.1308 119.9214 64.5766 37.0757 178.3630 17 E 4.0262 8.0779 119.3100 59.2741 29.2856 179.2524 18 A 4.0822 8.2553 120.9163 55.0365 18.3768 179.5586 19 E 3.9769 8.5182 117.7781 59.6299 29.3957 179.7137 20 S 4.1463 7.9367 114.9513 61.2982 62.8441 176.7411 21 V 3.5589 7.7110 121.0745 65.9948 31.2138 178.0754 22 K 4.1351 8.0821 119.0657 59.4577 32.0641 178.5482 23 A 4.2749 8.0979 122.4659 54.7470 18.1819 179.7248 24 I 3.7523 8.0925 118.5243 64.5943 36.9826 178.6833 25 Q 4.0236 8.0544 118.9750 58.9832 28.4703 178.6669 26 E 4.0173 8.5231 119.9004 59.4032 29.4475 179.6347 27 K 4.1717 8.2676 118.5337 59.7753 31.7318 179.4048 28 M 4.4132 8.6743 119.1072 58.3228 31.5918 178.6572 29 A 4.1777 8.0988 120.1564 53.9439 18.5192 177.9502 30 A 4.5119 7.4877 117.5672 51.6939 19.3420 176.3670 31 N 4.5656 7.7583 115.7582 53.6301 39.8251 173.0333 32 D 4.7706 8.4972 123.8425 53.9246 41.5939 176.3136 33 D 4.4570 8.2483 118.2541 54.0979 42.5547 176.2585 34 L 3.9386 8.6597 128.5302 59.0411 42.1363 179.1263 35 H 4.1442 8.3197 115.3457 58.6075 28.6775 177.5271 36 F 4.1267 8.7304 122.7131 61.3317 39.2378 177.1871 37 Q 3.9550 8.5950 118.1153 58.9293 28.4770 178.9753 38 I 3.6374 7.9258 120.8169 64.4894 37.1313 178.6772 39 R 3.8192 8.0303 118.6488 59.2113 29.8100 178.9969 40 A 3.7008 8.0524 120.7386 55.3150 18.2747 179.8799 41 T 3.7457 7.9037 114.2384 66.6010 68.5521 177.0715 42 V 3.5419 7.7861 120.1249 66.2379 31.5352 178.2371 43 I 4.0064 7.8584 121.0211 63.6177 36.9133 178.3393 44 K 3.8947 8.3764 121.0269 59.3214 31.9841 178.4542 45 E 3.9161 8.2056 119.6509 59.3989 29.2254 178.9100 46 Q 3.9724 7.8898 117.5553 59.1389 28.7681 179.0060 47 R 4.0413 8.2780 118.9727 58.9824 29.9968 178.9698 48 A 3.9992 8.1919 120.8809 54.9589 18.2843 179.2857 49 E 3.8591 8.1828 117.9330 59.4133 29.6693 179.0915 50 L 3.9156 7.9234 118.6834 57.6486 41.6538 179.3235 51 A 4.0570 8.2188 120.8181 55.1197 18.2419 179.8178 52 K 3.9075 8.3070 117.1935 59.7799 32.1042 178.9973 53 H 4.1446 8.4142 118.5630 59.7120 29.8644 176.9682 54 H 4.2212 8.2861 118.0018 58.9503 28.4836 177.8613 55 L 4.0951 8.0428 120.7844 57.8892 41.4790 179.1913 56 D 4.5531 8.5261 119.2844 57.4100 40.6788 179.1009 57 V 3.7405 8.0642 118.8264 65.9515 31.4713 178.0948 58 L 3.9311 8.0096 118.6785 57.4885 41.2456 179.3586 59 W 4.6270 8.4899 127.4746 60.7164 30.8419 177.8181 60 S 4.0048 8.8284 113.1970 60.4116 62.8566 175.1406 61 D 4.6964 8.3029 121.0232 55.8616 41.8142 177.4012 62 Y 3.4879 7.4699 118.3261 60.0738 39.0411 175.6401 63 F 4.0721 7.8766 118.1972 57.2562 39.5597 174.8736 64 K 4.6154 7.8541 122.8314 53.2069 35.8132 175.1852 65 P 4.4419 0.0000 0.0000 65.9476 31.0967 177.0897 66 P 4.2662 0.0000 0.0000 65.8399 31.0986 178.4648 67 H 4.3335 7.9537 115.1280 58.9649 28.6435 177.9092 68 F 4.3117 7.7045 118.8608 60.0757 38.5032 177.3227 69 E 4.0966 8.0504 118.7619 59.4156 29.5923 178.6721 70 S 4.2345 8.0461 113.9934 60.0227 64.1135 174.0977 71 Y 4.7217 7.9572 119.7642 54.6643 37.7665 174.1361 72 P 4.5351 0.0000 0.0000 63.9004 31.8570 177.7826 73 E 4.4452 8.0958 116.1525 56.5444 30.7675 177.5563 74 L 3.8989 8.3288 122.8133 58.7287 42.0631 178.2516 75 H 4.3751 8.3711 115.5108 59.5094 28.7125 177.7210 76 T 3.8172 7.9348 116.8110 66.3345 68.3244 176.2485 77 L 3.7881 8.1635 122.5141 58.2611 42.1708 179.3245 78 V 3.5512 7.9477 118.2682 65.8988 31.4622 177.4487 79 N 4.0443 8.0649 116.8540 56.6638 38.6888 176.7667 80 E 3.7326 8.3893 120.2074 58.9010 29.3842 179.2073 81 A 3.8890 7.5100 120.8662 55.3352 18.5228 180.2112 82 V 3.6055 7.7582 110.8903 64.3475 31.5705 179.0508 83 K 3.9938 8.0726 118.2051 59.1580 31.8357 179.2711 84 A 4.1023 8.1254 121.4498 55.0336 18.2686 179.7055 85 L 4.0246 7.8798 117.6789 57.9650 41.4939 179.8174 86 S 4.1299 8.1365 115.0678 61.4857 62.4997 176.5890 87 A 3.9896 7.8674 122.5284 55.0320 18.4264 179.2738 88 A 4.1775 7.9826 120.7171 54.5363 18.1666 179.9875 89 K 3.9576 7.8431 116.3739 59.2169 32.1367 178.3201 90 A 4.5446 7.3370 118.4459 51.0790 19.1175 176.6048 91 S 4.6164 7.2780 112.5363 58.1137 65.6142 174.0060 92 T 4.3728 8.3255 113.5154 61.2746 69.6404 173.7937 93 D 4.5247 8.1861 124.1800 53.2389 41.5089 174.9447 94 P 4.4274 0.0000 0.0000 65.6911 31.2083 178.2880 95 A 4.0337 8.6860 120.3281 55.2266 17.6951 179.7605 96 T 3.9853 8.2490 108.7547 64.8892 68.9238 177.2439 97 G 3.7635 8.0650 109.5119 47.0408 0.0000 175.3470 98 Q 3.9992 8.2950 121.9844 58.6732 29.0976 178.1269 99 K 3.7754 8.1248 120.6967 59.2963 32.1300 178.6828 100 A 4.1755 7.8512 121.1929 55.2742 18.3687 179.6025 101 L 3.9643 7.9368 117.4889 58.0507 41.5050 179.5558 102 D 4.3444 8.3950 119.2181 57.5219 40.7284 178.4546 103 Y 4.2842 7.8565 117.1589 61.1778 37.8624 178.4527 104 I 3.8115 8.2696 120.7935 64.3100 37.1466 178.3437 105 A 4.1292 8.1439 121.7319 55.2531 18.3110 179.7524 106 Q 4.0307 7.9418 116.6296 59.1407 28.7526 178.9835 107 I 3.8068 7.9323 120.9961 64.2225 37.1297 177.8853 108 D 4.4004 8.6610 119.4574 57.2186 41.1694 178.2025 109 K 4.0704 8.1824 120.0637 59.8048 32.2607 178.8342 110 I 3.6122 7.6640 119.6531 64.0296 36.6683 177.9409 111 F 4.0856 8.4651 121.0504 61.4704 39.3487 177.1599 112 W 4.1190 8.2209 118.1183 59.5960 28.6612 178.4817 113 E 4.1144 8.1752 118.6687 59.3625 28.6910 179.0376 114 T 4.0928 7.6655 108.4751 63.7730 69.1272 176.4421 115 K 4.0414 7.2544 120.5569 57.2119 32.5598 177.3184 116 K 3.9988 7.4754 119.2306 57.4918 32.8242 176.8713 117 A 4.1801 8.4454 124.5879 52.6800 18.6415 176.3339 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 H 8.43 4.65 0.00 3.27 3.35 0.00 5.48 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2 C 7.66 4.12 0.00 3.11 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 3 D 8.36 4.58 0.00 2.88 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 4 L 8.02 4.07 0.00 1.59 1.74 0.91 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 5 P 0.00 4.56 0.00 2.29 2.10 0.00 3.81 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.98 0.00 6 C 8.43 4.24 0.00 3.00 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 7 G 8.22 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 V 7.17 4.26 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 0.87 0.00 0.00 0.90 0.00 0.00 9 Y 8.08 4.70 0.00 2.79 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 0.00 0.00 0.00 0.00 10 D 7.93 3.80 0.00 2.59 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 11 P 0.00 4.10 0.00 2.28 1.91 0.00 3.08 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 1.48 1.14 0.00 12 A 8.64 3.97 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 13 Q 7.99 3.78 0.00 1.81 1.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.76 0.00 0.00 0.00 0.00 0.00 2.21 2.19 0.00 14 A 7.76 4.04 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 15 R 8.20 3.84 0.00 1.88 2.09 0.00 3.12 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.69 0.00 16 I 8.13 3.71 1.86 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 1.52 1.03 0.91 0.00 0.00 17 E 8.08 4.03 0.00 1.98 2.21 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 2.54 2.55 0.00 18 A 8.26 4.08 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 19 E 8.52 3.98 0.00 2.20 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 2.34 2.57 0.00 20 S 7.94 4.15 0.00 4.10 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 21 V 7.71 3.56 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.98 0.00 0.00 22 K 8.08 4.14 0.00 1.89 1.80 0.00 1.77 0.00 0.00 1.66 0.00 0.00 3.20 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.45 1.61 7.81 23 A 8.10 4.27 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 24 I 8.09 3.75 2.02 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.87 0.90 0.00 0.00 25 Q 8.05 4.02 0.00 2.30 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.80 0.00 0.00 0.00 0.00 0.00 2.39 2.63 0.00 26 E 8.52 4.02 0.00 2.22 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 2.34 2.52 0.00 27 K 8.27 4.17 0.00 2.17 2.10 0.00 1.73 0.00 0.00 1.69 0.00 0.00 2.98 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.84 1.75 7.81 28 M 8.67 4.41 0.00 2.11 2.31 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.90 2.55 0.00 29 A 8.10 4.18 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 30 A 7.49 4.51 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 N 7.76 4.57 0.00 2.35 2.47 0.00 0.00 6.97 8.35 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 32 D 8.50 4.77 0.00 2.67 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 33 D 8.25 4.46 0.00 2.80 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 34 L 8.66 3.94 0.00 1.79 1.65 0.89 1.01 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 35 H 8.32 4.14 0.00 3.46 3.40 0.00 5.87 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 36 F 8.73 4.13 0.00 3.18 3.27 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 0.00 37 Q 8.60 3.95 0.00 2.30 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.59 0.00 0.00 0.00 0.00 0.00 2.72 2.61 0.00 38 I 7.93 3.64 1.98 0.00 0.00 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 1.48 0.76 0.88 0.00 0.00 39 R 8.03 3.82 0.00 1.78 1.87 0.00 3.15 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.87 0.00 40 A 8.05 3.70 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 T 7.90 3.75 4.33 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 1.18 0.00 0.00 42 V 7.79 3.54 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 0.93 0.00 0.00 43 I 7.86 4.01 1.80 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.89 0.88 0.00 0.00 44 K 8.38 3.89 0.00 1.82 1.96 0.00 1.74 0.00 0.00 1.56 0.00 0.00 2.93 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.42 1.44 7.81 45 E 8.21 3.92 0.00 2.30 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 0.00 2.29 2.38 0.00 46 Q 7.89 3.97 0.00 2.27 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.59 0.00 0.00 0.00 0.00 0.00 2.36 2.62 0.00 47 R 8.28 4.04 0.00 1.82 2.10 0.00 3.28 0.00 0.00 3.17 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.79 0.00 48 A 8.19 4.00 1.37 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 0.00 0.00 49 E 8.18 3.86 0.00 2.20 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.38 0.00 50 L 7.92 3.92 0.00 1.95 1.68 0.93 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 51 A 8.22 4.06 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 K 8.31 3.91 0.00 1.98 1.87 0.00 1.66 0.00 0.00 1.56 0.00 0.00 2.87 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.45 1.64 7.81 53 H 8.41 4.14 0.00 3.21 3.41 0.00 5.79 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 H 8.29 4.22 0.00 3.36 3.28 0.00 5.67 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 L 8.04 4.10 0.00 1.89 1.76 0.94 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 56 D 8.53 4.55 0.00 2.89 2.87 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 57 V 8.06 3.74 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.91 0.00 0.00 58 L 8.01 3.93 0.00 2.09 1.70 0.78 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 59 W 8.49 4.63 0.00 3.44 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 60 S 8.83 4.00 0.00 4.03 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 61 D 8.30 4.70 0.00 2.97 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 62 Y 7.47 3.49 0.00 1.43 2.45 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 63 F 7.88 4.07 0.00 2.97 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 0.00 0.00 0.00 64 K 7.85 4.62 0.00 1.34 1.50 0.00 1.59 0.00 0.00 1.67 0.00 0.00 2.80 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.21 1.10 7.81 65 P 0.00 4.44 0.00 2.14 2.17 0.00 3.55 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.26 0.00 66 P 0.00 4.27 0.00 2.00 2.05 0.00 3.34 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.12 0.00 67 H 7.95 4.33 0.00 2.88 3.16 0.00 5.64 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 F 7.70 4.31 0.00 3.20 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 69 E 8.05 4.10 0.00 1.99 2.16 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 2.31 2.37 0.00 70 S 8.05 4.23 0.00 3.87 3.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 Y 7.96 4.72 0.00 3.02 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 P 0.00 4.54 0.00 2.21 2.22 0.00 3.43 0.00 0.00 4.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.93 0.00 73 E 8.10 4.45 0.00 2.19 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 2.37 2.30 0.00 74 L 8.33 3.90 0.00 1.82 1.91 0.53 0.04 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 75 H 8.37 4.38 0.00 3.25 3.33 0.00 5.68 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 T 7.93 3.82 4.39 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 1.20 0.00 0.00 77 L 8.16 3.79 0.00 1.85 1.84 1.07 1.21 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 78 V 7.95 3.55 1.98 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 0.92 0.00 0.00 1.11 0.00 0.00 79 N 8.06 4.04 0.00 2.70 2.74 0.00 0.00 7.23 7.25 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 80 E 8.39 3.73 0.00 1.47 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 2.14 2.25 0.00 81 A 7.51 3.89 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 82 V 7.76 3.61 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 0.88 0.00 0.00 0.88 0.00 0.00 83 K 8.07 3.99 0.00 1.92 1.80 0.00 1.65 0.00 0.00 1.59 0.00 0.00 2.87 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.39 1.45 7.81 84 A 8.13 4.10 1.54 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 85 L 7.88 4.02 0.00 1.90 1.73 0.94 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 86 S 8.14 4.13 0.00 4.04 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 87 A 7.87 3.99 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 A 7.98 4.18 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 K 7.84 3.96 0.00 1.97 2.02 0.00 1.69 0.00 0.00 1.95 0.00 0.00 3.22 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.47 1.64 7.81 90 A 7.34 4.54 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 91 S 7.28 4.62 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 92 T 8.33 4.37 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 93 D 8.19 4.52 0.00 2.71 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 94 P 0.00 4.43 0.00 2.20 2.11 0.00 3.66 0.00 0.00 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.08 0.00 95 A 8.69 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 96 T 8.25 3.99 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 97 G 8.07 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 0.00 0.00 0.00 98 Q 8.29 4.00 0.00 2.18 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.75 0.00 0.00 0.00 0.00 0.00 2.34 2.54 0.00 99 K 8.12 3.78 0.00 1.97 1.96 0.00 1.71 0.00 0.00 1.74 0.00 0.00 3.25 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.48 1.28 7.81 100 A 7.85 4.18 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 0.00 101 L 7.94 3.96 0.00 1.90 1.74 0.93 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 102 D 8.39 4.34 0.00 2.57 2.54 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 0.00 103 Y 7.86 4.28 0.00 3.22 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 0.00 104 I 8.27 3.81 2.07 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 1.51 0.82 0.94 0.00 0.00 105 A 8.14 4.13 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 0.00 106 Q 7.94 4.03 0.00 2.37 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.76 0.00 0.00 0.00 0.00 0.00 2.43 2.58 0.00 107 I 7.93 3.81 2.10 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.83 1.09 0.00 0.00 108 D 8.66 4.40 0.00 2.93 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 0.00 109 K 8.18 4.07 0.00 1.96 2.02 0.00 1.74 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.50 1.57 7.81 110 I 7.66 3.61 1.83 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.65 -0.02 0.00 0.00 111 F 8.47 4.09 0.00 2.91 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 0.00 112 W 8.22 4.12 0.00 3.56 3.27 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 0.00 113 E 8.18 4.11 0.00 2.27 2.16 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 2.44 2.62 0.00 114 T 7.67 4.09 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 1.36 0.00 0.00 115 K 7.25 4.04 0.00 1.86 1.89 0.00 1.47 0.00 0.00 0.80 0.00 0.00 2.88 0.00 0.00 2.95 0.00 0.00 0.00 0.00 0.50 0.51 7.81 116 K 7.48 4.00 0.00 1.91 1.78 0.00 1.82 0.00 0.00 1.76 0.00 0.00 3.04 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.54 1.71 7.81 117 A 8.45 4.18 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