NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 E 4.3335 8.3033 121.7389 56.2595 30.9907 173.5457 2 Q 4.7064 8.5347 125.7675 54.3069 29.4556 174.1332 3 L 4.8344 8.5850 125.1287 53.8144 44.3759 176.0155 4 T 4.5929 9.7054 112.3644 59.8894 71.0457 175.3956 5 K 3.4938 8.8422 122.4771 60.0999 31.7146 178.9620 6 C 4.5012 7.8296 115.3339 59.3852 38.1111 175.8002 7 E 3.8787 8.0147 119.8925 59.1410 28.9129 179.3165 8 V 3.4308 7.6198 117.8540 66.1317 31.2828 177.6573 9 F 3.6929 7.4633 115.8248 60.8329 39.1168 177.6809 10 R 4.1005 7.8349 117.3904 59.5162 29.7451 179.0189 11 E 4.0457 8.5249 117.9295 58.7611 29.6561 178.5317 12 L 4.4088 7.8073 117.5929 54.2376 41.8619 177.8878 13 K 3.8046 7.6921 122.5069 59.9749 31.8226 178.3535 14 D 4.4421 8.0947 116.3099 56.6651 41.1376 177.3700 15 L 4.1715 8.1249 119.1745 55.6643 42.2987 176.6485 16 K 3.9669 7.7083 118.8760 57.8351 32.3868 177.0410 17 G 4.0474 9.1012 113.5452 46.0927 0.0000 172.7206 18 Y 4.0690 8.5151 122.9214 58.6130 39.0379 176.1753 19 G 3.8637 8.6614 114.6178 46.1157 0.0000 174.3614 20 G 3.8885 8.1217 106.5493 45.0494 0.0000 174.2803 21 V 4.1595 7.4004 120.5422 59.9754 32.8153 176.2578 22 S 4.8037 8.7971 118.8038 57.2898 64.4671 175.2308 23 L 3.9502 8.6195 121.0725 57.7316 41.3198 178.0554 24 P 4.4606 0.0000 0.0000 65.6455 31.2180 178.5061 25 E 3.8964 7.9988 117.3906 59.0322 29.2529 179.2928 26 W 4.3743 7.7829 118.6352 59.5788 29.0567 178.6801 27 V 3.5678 8.1639 118.8688 65.9104 30.9688 177.3948 28 C 2.4500 7.6624 118.0944 59.2026 39.8876 175.5134 29 T 3.7760 8.0061 117.9069 66.9859 68.0641 176.7639 30 T 3.9186 8.2503 111.3634 64.1636 68.7059 176.4494 31 F 3.4065 7.7119 124.3121 61.4313 39.2037 176.8074 32 H 4.0143 7.6846 113.6567 58.2444 28.5008 177.8146 33 T 4.2079 7.4097 117.6153 65.7444 68.9127 175.7199 34 S 4.4141 7.7305 111.2962 56.7527 64.4932 174.5581 35 G 3.4707 8.1657 108.3699 46.8291 0.0000 173.8936 36 Y 3.7202 7.7388 113.7092 58.4007 35.4756 168.2082 37 D 5.1752 7.6898 120.7923 52.9134 41.6130 177.0478 38 T 4.2221 8.7851 116.9474 63.0327 69.0831 175.5522 39 Q 4.6164 8.9618 120.5374 55.5002 29.5095 175.3594 40 A 4.1559 7.5960 120.9317 52.7486 19.5681 177.4007 41 I 4.6439 8.0803 121.0400 59.8872 41.3351 173.8412 42 V 4.2575 8.7707 130.0073 61.2269 33.7896 173.6973 43 Q 4.7861 8.6573 129.6162 54.6047 30.5177 174.4714 44 N 4.9986 8.6718 124.5070 51.1035 41.5931 174.1255 45 N 4.4362 8.8733 116.6506 56.9107 38.9892 175.2496 46 D 4.6932 8.1041 115.2787 54.6275 42.5136 176.1615 47 S 5.0450 7.6769 111.9361 56.8073 66.0651 172.3864 48 T 5.1717 8.9955 116.0780 62.0912 73.0831 172.9271 49 E 5.3116 9.3805 124.2002 54.8502 32.4915 174.3938 50 Y 4.9006 9.2128 120.8375 57.3540 41.5246 177.6724 51 G 4.2231 9.0838 111.9749 44.3177 0.0000 173.6268 52 L 4.0238 8.4555 118.5916 57.1951 41.8605 178.3761 53 F 4.4831 7.9521 113.7518 56.8482 40.0049 175.1495 54 Q 3.5182 7.7672 119.3386 57.0348 26.4560 174.0034 55 I 4.3522 8.0686 119.2884 60.9778 38.4634 177.3744 56 N 6.0306 9.4791 124.4729 51.6861 39.2281 174.9654 57 N 5.1399 8.9196 116.9908 53.1494 37.9619 175.6270 58 K 4.2160 8.9008 121.1246 58.6886 33.3453 178.2613 59 I 4.0364 7.8363 118.4271 61.6082 39.3217 178.4127 60 W 4.5346 7.7577 120.6286 58.6884 29.2991 173.5503 61 C 5.6425 7.9004 110.8396 53.6237 46.5596 172.9843 62 K 4.5314 8.7119 121.1158 55.7212 33.6461 174.8798 63 D 5.2776 8.3405 124.5126 52.8284 45.0412 175.3278 64 D 4.5816 8.7799 118.5199 56.3825 41.5587 178.3783 65 Q 4.1090 8.2747 119.3303 58.6475 29.8380 175.9354 66 N 5.0748 7.7276 114.6688 50.5590 38.5191 173.1027 67 P 4.4300 0.0000 0.0000 65.1992 31.9594 177.8691 68 H 4.7471 8.0448 113.6714 55.3565 28.7461 174.9938 69 S 4.2519 7.6791 114.8773 58.6042 62.5248 174.9454 70 S 4.0521 8.3167 118.6231 59.4671 63.4786 173.6689 71 N 4.2369 8.2012 120.6133 54.1228 37.5978 175.2248 72 I 3.7686 7.7701 120.5182 64.8408 37.6801 177.1107 73 C 4.5578 8.6386 114.8807 56.3567 40.7421 173.0078 74 N 4.0776 8.4614 118.0023 53.3703 37.2941 172.7947 75 I 4.2121 8.1550 117.8467 59.8847 42.2059 172.9419 76 S 4.5330 8.1565 120.2007 57.8078 63.1235 175.5655 77 C 3.6085 8.6501 125.9982 60.0289 40.8454 175.7339 78 D 4.3278 7.5620 118.6742 54.9243 38.9685 177.5963 79 K 4.1875 7.5102 119.0681 57.6677 31.7962 177.5903 80 F 5.4277 8.0066 118.2224 57.4774 39.2121 176.4391 81 L 4.9899 8.1290 117.5945 53.7261 42.4526 176.2291 82 D 4.7256 7.8316 118.5458 52.9435 40.8065 175.5260 83 D 4.5857 8.4610 116.7847 54.2894 41.2105 176.3681 84 D 4.6179 7.5379 119.2044 53.1557 40.5862 175.9702 85 L 4.7461 8.2014 127.1937 54.6615 41.6860 178.7963 86 T 3.8512 8.2860 118.8610 66.8442 68.5314 176.3741 87 D 4.4447 8.1036 120.5284 56.3511 39.4975 178.0189 88 D 4.2530 8.2475 119.8546 57.4561 40.9963 178.4592 89 I 3.2914 7.7198 120.0677 64.5829 36.6481 178.1780 90 M 3.8785 7.8607 118.7788 58.6742 31.9964 177.5310 91 C 4.2886 7.9681 118.5433 59.4878 42.6644 175.5908 92 V 3.2012 7.5422 120.1508 65.8754 30.9136 178.2076 93 K 3.6526 7.7506 118.0823 59.0497 31.6338 179.5885 94 K 4.0147 7.4459 117.7480 59.3666 31.9861 179.4115 95 I 2.9847 7.4301 120.1154 64.0525 36.6906 178.3755 96 L 4.1298 8.2403 120.1224 57.9940 41.2745 179.3985 97 D 4.4649 7.9941 117.5279 57.4682 40.9027 178.7090 98 K 4.2441 8.3249 117.9364 58.3844 32.2807 177.8932 99 V 4.1204 8.2959 116.7504 64.7123 33.4602 174.7447 100 G 4.0882 8.1857 104.0467 44.6081 0.0000 174.3095 101 I 4.0067 8.4816 118.5597 63.9838 38.0456 176.9552 102 N 4.7146 8.1753 114.5303 53.9828 38.1860 175.2354 103 Y 3.9588 7.9221 121.1560 59.4737 39.2137 175.6628 104 W 4.4094 8.3649 120.6070 55.0423 29.1243 176.9372 105 L 4.0500 8.4390 124.9811 57.5744 40.9183 179.3484 106 A 4.0482 8.1011 120.4278 55.2441 18.2582 178.5702 107 H 4.2800 8.2970 117.1301 59.2246 29.7244 177.1403 108 K 3.8233 8.2617 121.7998 59.0252 32.1588 178.1841 109 A 4.0759 7.8625 119.7415 54.3673 18.4988 178.6713 110 L 4.6551 8.8370 115.8941 54.2460 43.5326 176.4673 111 C 5.0575 8.3498 117.2819 56.7588 40.5905 175.1611 112 S 4.3418 8.1331 117.0176 59.3671 63.8817 174.0543 113 E 4.5816 7.2728 115.8677 54.9056 32.8444 175.1403 114 K 4.0693 8.7717 115.2772 57.4086 30.4280 176.5937 115 L 4.4719 7.4643 114.2256 55.9824 41.9248 179.0129 116 D 4.5166 8.8528 122.1806 57.2675 40.8609 178.7124 117 Q 3.8363 7.7989 115.4996 58.0825 28.6288 176.7042 118 W 4.8432 7.3599 115.8587 56.8109 29.2938 176.2510 119 L 4.5600 7.6292 119.3849 54.2314 42.1879 176.1698 120 C 4.4584 7.8662 118.4706 56.8324 44.8537 173.3885 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 E 8.30 4.33 0.00 2.14 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 2.50 2.43 0.00 2 Q 8.53 4.71 0.00 2.11 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.32 6.74 0.00 0.00 0.00 0.00 0.00 2.35 2.43 0.00 3 L 8.59 4.83 0.00 1.47 1.52 0.86 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 4 T 9.71 4.59 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 5 K 8.84 3.49 0.00 1.97 1.95 0.00 1.83 0.00 0.00 2.13 0.00 0.00 2.95 0.00 0.00 3.29 0.00 0.00 0.00 0.00 1.78 1.89 7.81 6 C 7.83 4.50 0.00 3.12 3.09 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 7 E 8.01 3.88 0.00 2.12 1.96 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 2.32 2.31 0.00 8 V 7.62 3.43 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 0.95 0.00 0.00 0.45 0.00 0.00 9 F 7.46 3.69 0.00 3.17 3.17 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 10 R 7.83 4.10 0.00 2.01 1.99 0.00 3.31 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 1.79 1.84 0.00 11 E 8.52 4.05 0.00 1.83 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 0.00 2.36 2.54 0.00 12 L 7.81 4.41 0.00 1.56 1.42 0.67 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 13 K 7.69 3.80 0.00 2.08 1.83 0.00 1.58 0.00 0.00 1.69 0.00 0.00 3.11 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.47 1.59 7.81 14 D 8.09 4.44 0.00 2.60 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 L 8.12 4.17 0.00 1.60 1.50 -0.44 0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 16 K 7.71 3.97 0.00 1.77 1.96 0.00 1.99 0.00 0.00 1.78 0.00 0.00 3.08 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.53 1.52 7.81 17 G 9.10 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 Y 8.52 4.07 0.00 3.11 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 19 G 8.66 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 20 G 8.12 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 21 V 7.40 4.16 1.68 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 0.75 0.00 0.00 -0.00 0.00 0.00 22 S 8.80 4.80 0.00 4.09 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 23 L 8.62 3.95 0.00 1.63 0.86 0.99 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 24 P 0.00 4.46 0.00 2.31 2.42 0.00 3.61 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.70 0.00 25 E 8.00 3.90 0.00 1.89 1.76 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 2.42 2.31 0.00 26 W 7.78 4.37 0.00 3.40 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 27 V 8.16 3.57 2.30 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 1.33 0.00 0.00 0.58 0.00 0.00 28 C 7.66 2.45 0.00 1.24 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 29 T 8.01 3.78 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 1.08 0.00 0.00 30 T 8.25 3.92 4.10 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 0.97 0.00 0.00 31 F 7.71 3.41 0.00 2.90 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 32 H 7.68 4.01 0.00 3.29 3.32 0.00 5.70 0.00 0.00 0.00 0.00 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 T 7.41 4.21 4.41 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 1.28 0.00 0.00 34 S 7.73 4.41 0.00 4.00 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 35 G 8.17 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 0.00 0.00 0.00 36 Y 7.74 3.72 0.00 3.33 3.01 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 37 D 7.69 5.18 0.00 2.79 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 T 8.79 4.22 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 1.24 0.00 0.00 39 Q 8.96 4.62 0.00 2.02 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.83 0.00 0.00 0.00 0.00 0.00 2.33 2.43 0.00 40 A 7.60 4.16 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 I 8.08 4.64 1.80 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 1.05 0.31 0.91 0.00 0.00 42 V 8.77 4.26 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 0.82 0.00 0.00 0.93 0.00 0.00 43 Q 8.66 4.79 0.00 2.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.53 0.00 0.00 0.00 0.00 0.00 2.23 2.34 0.00 44 N 8.67 5.00 0.00 2.80 2.74 0.00 0.00 7.01 8.24 0.00 0.00 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 N 8.87 4.44 0.00 2.66 2.85 0.00 0.00 6.80 8.47 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 46 D 8.10 4.69 0.00 2.70 2.69 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 47 S 7.68 5.05 0.00 4.02 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 48 T 9.00 5.17 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 0.00 0.00 49 E 9.38 5.31 0.00 2.16 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 2.43 0.00 50 Y 9.21 4.90 0.00 3.12 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 G 9.08 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 0.00 0.00 0.00 0.00 52 L 8.46 4.02 0.00 1.38 1.18 0.82 0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 53 F 7.95 4.48 0.00 3.02 3.17 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 54 Q 7.77 3.52 0.00 2.38 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.05 6.83 0.00 0.00 0.00 0.00 0.00 2.46 2.63 0.00 55 I 8.07 4.35 1.67 0.00 0.00 0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.75 1.05 0.00 0.00 56 N 9.48 6.03 0.00 3.01 3.28 0.00 0.00 6.48 6.96 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 57 N 8.92 5.14 0.00 2.90 3.30 0.00 0.00 6.39 7.13 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 58 K 8.90 4.22 0.00 1.86 1.86 0.00 1.64 0.00 0.00 1.65 0.00 0.00 2.90 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.46 1.59 7.81 59 I 7.84 4.04 0.77 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 1.04 1.45 -0.58 0.00 0.00 60 W 7.76 4.53 0.00 3.69 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 61 C 7.90 5.64 0.00 3.07 3.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 K 8.71 4.53 0.00 1.84 1.64 0.00 1.55 0.00 0.00 1.54 0.00 0.00 2.78 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.37 1.51 7.81 63 D 8.34 5.28 0.00 2.81 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 64 D 8.78 4.58 0.00 2.74 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 65 Q 8.27 4.11 0.00 2.07 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 7.31 0.00 0.00 0.00 0.00 0.00 2.37 2.40 0.00 66 N 7.73 5.07 0.00 2.89 2.72 0.00 0.00 6.82 8.03 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 67 P 0.00 4.43 0.00 2.18 2.19 0.00 3.44 0.00 0.00 4.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.92 0.00 68 H 8.04 4.75 0.00 3.10 3.34 0.00 5.92 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 S 7.68 4.25 0.00 4.09 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 70 S 8.32 4.05 0.00 3.98 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 71 N 8.20 4.24 0.00 2.99 2.81 0.00 0.00 7.04 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 72 I 7.77 3.77 2.01 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.53 1.07 0.00 0.00 73 C 8.64 4.56 0.00 3.47 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 74 N 8.46 4.08 0.00 2.71 2.78 0.00 0.00 6.85 7.88 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 75 I 8.16 4.21 1.92 0.00 0.00 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.78 0.74 0.00 0.00 76 S 8.16 4.53 0.00 3.79 3.56 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 77 C 8.65 3.61 0.00 2.10 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 78 D 7.56 4.33 0.00 2.86 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 79 K 7.51 4.19 0.00 1.36 1.90 0.00 1.60 0.00 0.00 1.62 0.00 0.00 2.93 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.31 1.41 7.81 80 F 8.01 5.43 0.00 3.33 3.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 L 8.13 4.99 0.00 1.85 1.79 1.19 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 82 D 7.83 4.73 0.00 2.78 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 83 D 8.46 4.59 0.00 2.69 2.74 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 84 D 7.54 4.62 0.00 2.72 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 85 L 8.20 4.75 0.00 1.73 1.70 0.85 0.95 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 86 T 8.29 3.85 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 1.20 0.00 0.00 87 D 8.10 4.44 0.00 3.03 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 88 D 8.25 4.25 0.00 3.07 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 89 I 7.72 3.29 1.89 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 1.08 0.65 0.00 0.00 90 M 7.86 3.88 0.00 2.09 2.18 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.50 0.00 91 C 7.97 4.29 0.00 3.24 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 92 V 7.54 3.20 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 0.23 0.00 0.00 -0.56 0.00 0.00 93 K 7.75 3.65 0.00 1.69 1.38 0.00 1.44 0.00 0.00 1.23 0.00 0.00 2.24 0.00 0.00 2.49 0.00 0.00 0.00 0.00 0.30 0.96 7.81 94 K 7.45 4.01 0.00 1.99 1.92 0.00 1.76 0.00 0.00 1.74 0.00 0.00 2.99 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.48 1.61 7.81 95 I 7.43 2.98 1.61 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.36 -0.41 0.00 0.00 96 L 8.24 4.13 0.00 2.06 2.00 1.34 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 97 D 7.99 4.46 0.00 2.93 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 K 8.32 4.24 0.00 1.91 1.99 0.00 1.78 0.00 0.00 1.74 0.00 0.00 3.02 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.60 1.89 7.81 99 V 8.30 4.12 2.14 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 0.97 0.00 0.00 1.09 0.00 0.00 100 G 8.19 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 0.00 101 I 8.48 4.01 1.70 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.56 0.75 0.79 0.00 0.00 102 N 8.18 4.71 0.00 2.82 2.89 0.00 0.00 6.85 7.46 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 0.00 103 Y 7.92 3.96 0.00 2.77 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 W 8.36 4.41 0.00 3.76 3.09 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 0.00 105 L 8.44 4.05 0.00 1.66 1.70 0.85 0.88 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 0.00 106 A 8.10 4.05 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 0.00 107 H 8.30 4.28 0.00 3.17 3.49 0.00 5.61 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 0.00 108 K 8.26 3.82 0.00 2.07 1.84 0.00 1.68 0.00 0.00 2.37 0.00 0.00 3.03 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.42 1.37 7.81 109 A 7.86 4.08 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 0.00 110 L 8.84 4.66 0.00 1.42 1.73 0.61 0.89 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 0.00 111 C 8.35 5.06 0.00 2.76 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 0.00 112 S 8.13 4.34 0.00 3.82 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 0.00 113 E 7.27 4.58 0.00 2.11 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 0.00 2.25 2.29 0.00 114 K 8.77 4.07 0.00 2.02 1.97 0.00 1.75 0.00 0.00 1.96 0.00 0.00 2.89 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.39 1.45 7.81 115 L 7.46 4.47 0.00 1.83 1.86 1.03 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 116 D 8.85 4.52 0.00 2.63 2.69 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 0.00 117 Q 7.80 3.84 0.00 1.22 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.52 7.08 0.00 0.00 0.00 0.00 0.00 2.11 2.21 0.00 118 W 7.36 4.84 0.00 3.66 3.45 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 0.00 119 L 7.63 4.56 0.00 1.91 1.56 0.82 0.93 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 0.00 120 C 7.87 4.46 0.00 2.77 2.30 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