NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.5550 8.1627 120.3301 54.2895 35.0458 174.6707 2 D 4.4263 7.7453 120.3885 53.0429 41.6325 174.1675 3 A 4.8029 7.2953 117.6410 51.6807 21.3124 176.7016 4 V 4.0007 7.5053 118.5802 61.9796 33.2319 177.0185 5 A 3.9810 8.4909 123.9381 55.1910 18.6539 179.5190 6 V 4.0295 7.7163 107.1465 61.6746 32.0815 174.7984 7 Y 5.0098 7.8758 123.7844 57.7022 38.6628 175.2208 8 H 4.4554 9.4862 124.7430 54.8015 30.5883 177.4556 9 G 3.5016 6.0445 107.9049 46.2884 0.0000 176.1112 10 K 4.5511 8.4528 117.9827 55.2245 30.9858 176.2329 11 I 4.3885 7.0541 112.4881 59.1404 40.3040 177.0182 12 S 4.5223 8.1891 116.8432 57.9540 65.0870 175.2423 13 R 3.8963 8.5108 122.5439 59.7095 29.8375 178.7388 14 E 4.3472 8.0324 118.1399 59.1915 29.6256 179.1169 15 T 3.9962 7.8675 116.7098 66.2926 68.6137 176.9642 16 G 3.6023 8.1810 107.7640 47.7881 0.0000 175.5834 17 E 4.0206 8.2086 121.0558 59.0135 29.4788 179.5373 18 K 3.9812 7.9827 118.3475 59.5644 31.9769 179.0820 19 L 3.9757 7.6358 117.7078 58.1399 41.6427 179.5591 20 L 4.1753 7.8368 118.1471 57.8027 41.4824 179.5708 21 L 4.1053 8.2711 118.8229 57.4273 41.2271 179.3830 22 A 3.9941 7.8907 120.6500 55.3602 18.4011 179.4604 23 T 3.9240 7.4421 105.9881 62.8290 68.6943 175.5220 24 G 3.8809 7.5731 107.6706 45.6447 0.0000 172.6701 25 L 4.6926 7.4924 119.5596 52.1515 43.8603 176.0445 26 D 4.8677 8.6989 123.8400 55.9958 41.4550 176.8834 27 G 4.1751 9.6918 112.7037 44.9231 0.0000 173.4209 28 S 5.2140 8.1507 115.4284 58.7158 64.3584 173.0278 29 Y 6.1215 9.0131 119.7411 55.5797 41.8116 173.4286 30 L 5.0761 8.5333 119.2596 54.5902 44.7405 173.9078 31 L 5.4337 9.4503 121.5797 53.4544 45.2428 175.4359 32 R 5.0457 8.8917 121.3530 54.6673 33.6677 173.7621 33 D 5.0666 8.8814 118.8739 53.7408 41.7285 177.0653 34 S 4.3819 8.4148 116.0211 58.4086 63.3536 174.8909 35 E 4.1585 8.9192 124.1229 57.9561 29.5243 177.9394 36 S 4.5093 7.5464 109.6086 58.3378 66.7287 174.0782 37 V 4.2643 7.4707 121.1828 60.2532 32.7645 172.9937 38 P 4.1740 0.0000 0.0000 63.8323 31.6782 177.0044 39 G 3.8830 8.7321 109.4227 45.5271 0.0000 172.9772 40 V 4.6345 7.0970 119.7101 61.0823 34.1958 174.1601 41 Y 5.2751 9.5729 124.2976 56.4161 42.3789 174.1997 42 C 5.2811 9.2413 118.7729 58.0791 31.3888 173.0120 43 L 4.8085 9.3483 127.5854 54.3514 43.2375 174.8314 44 C 5.4645 9.2022 124.7797 58.0846 30.9158 173.1789 45 V 5.1414 9.0872 123.4398 61.0293 34.8122 173.8927 46 L 5.0516 8.9173 130.1018 54.7919 43.8550 174.9744 47 Y 5.0942 9.5538 127.8446 56.8722 41.9849 174.5276 48 H 4.2551 9.8613 126.9416 56.9489 26.8536 176.0791 49 G 3.8539 8.5857 105.8587 45.2947 0.0000 172.8463 50 Y 4.6208 7.9195 116.3546 56.0641 41.0121 174.7316 51 I 4.8144 8.1229 123.1312 60.1099 38.4012 174.9482 52 Y 4.0196 9.4592 127.1038 57.7245 39.0218 174.9245 53 T 5.0290 8.3082 121.1902 62.0364 70.7924 173.2519 54 Y 4.6454 9.0815 124.8112 56.1464 40.8847 175.2078 55 R 4.8651 8.6418 122.9106 55.7225 32.0263 175.4871 56 V 5.2591 9.3853 124.0684 61.4227 34.9875 174.3399 57 S 5.1780 9.1972 120.2088 57.7899 66.6918 173.3156 58 Q 5.1402 8.6102 119.4978 54.3972 30.6236 175.3217 59 T 4.5254 7.7428 111.2013 59.5577 71.5140 174.9563 60 E 3.8738 8.6639 118.7788 59.8709 29.3464 178.1532 61 T 3.9231 7.7041 106.1645 61.7286 68.8280 174.5062 62 G 3.6823 7.8116 110.3948 46.3362 0.0000 173.3206 63 S 4.9010 7.3416 112.9522 56.4010 65.2950 173.4343 64 W 5.2226 9.7638 123.5340 56.5376 31.1504 175.2495 65 S 5.2003 9.0549 114.8630 57.4476 65.7548 173.0117 66 A 5.2046 8.6723 127.6803 50.1726 20.6640 176.5141 67 E 4.0038 9.1079 122.8784 57.2281 30.0204 176.5970 68 T 4.6657 8.4360 122.6079 61.2483 71.4895 174.1022 69 A 4.1934 8.3165 127.3016 51.0203 19.1765 175.4555 70 P 4.4006 0.0000 0.0000 64.6938 31.4373 176.8879 71 G 3.9515 9.1249 110.5027 44.9422 0.0000 173.0872 72 V 4.2807 7.1469 119.3284 61.0140 32.8867 175.1594 73 H 4.2068 8.7212 124.3863 55.6561 29.0697 175.7049 74 K 4.1653 8.4046 123.6905 56.2277 32.6701 176.4739 75 R 4.3639 7.9474 119.3942 54.5099 33.0286 174.8775 76 Y 5.0301 7.8901 118.9805 56.3549 40.7735 175.2056 77 F 4.9576 9.0462 119.8670 56.0743 43.2999 176.3771 78 R 4.0276 9.1381 124.4894 58.5305 30.4065 177.1575 79 K 4.6962 7.9073 116.8504 54.2065 34.4740 177.0665 80 I 3.2197 7.4133 122.9953 63.6612 37.6660 178.3121 81 K 3.9357 7.8043 119.0999 59.4243 32.5457 178.1684 82 N 4.4561 8.1169 117.1322 54.6294 38.4823 177.0118 83 L 2.4400 7.0213 121.5982 57.2165 42.3982 178.5524 84 I 3.7143 7.2592 119.2491 64.3595 37.0958 178.2012 85 S 4.1362 7.6166 115.2503 61.7866 62.3454 176.6488 86 A 3.7664 7.4139 122.5841 54.6555 17.9087 178.6183 87 F 4.7146 7.4199 114.0811 57.6871 38.9886 177.4067 88 Q 4.3214 7.7453 117.8585 56.3343 29.1147 176.5682 89 K 4.2568 7.0693 117.2145 54.7009 32.9287 174.9496 90 P 4.3648 0.0000 0.0000 62.7050 32.3725 175.0046 91 D 4.2665 8.2291 115.5700 55.7900 39.3381 173.6767 92 Q 4.4159 8.0411 113.5489 55.6856 29.5449 177.0852 93 G 4.0264 8.4394 106.5297 44.9306 0.0000 173.4625 94 I 4.3428 6.9982 111.8172 58.3830 40.0755 175.8392 95 V 3.3550 7.7932 114.7664 64.4057 31.3902 177.0550 96 I 4.1465 6.7661 115.3628 58.7287 40.5389 172.0218 97 P 4.3570 0.0000 0.0000 62.4327 31.3897 176.1702 98 L 3.8741 8.4169 122.8037 55.7761 41.7217 177.3022 99 Q 4.0968 9.5418 122.0104 56.7901 31.8709 175.2628 100 Y 4.7028 7.8497 118.7429 55.1325 39.7473 173.1119 101 P 3.4408 0.0000 0.0000 62.4803 32.1194 176.8588 102 V 4.0656 8.0702 126.1678 61.2169 30.6515 175.1852 103 E 4.3989 8.3555 125.6522 55.4731 30.6428 176.8455 104 K 3.8680 8.1179 121.9918 56.7221 32.1872 176.7155 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 M 8.16 4.55 0.00 2.28 2.08 0.00 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.73 2.60 0.00 2 D 7.75 4.43 0.00 2.20 2.13 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 3 A 7.30 4.80 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 4 V 7.51 4.00 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 0.86 0.00 0.00 0.93 0.00 0.00 5 A 8.49 3.98 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 6 V 7.72 4.03 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 0.54 0.00 0.00 1.08 0.00 0.00 7 Y 7.88 5.01 0.00 2.88 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 8 H 9.49 4.46 0.00 3.02 3.24 0.00 5.99 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 G 6.04 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.45 4.55 0.00 1.76 1.81 0.00 1.78 0.00 0.00 1.91 0.00 0.00 2.94 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.48 1.40 7.81 11 I 7.05 4.39 1.87 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 1.47 0.60 0.93 0.00 0.00 12 S 8.19 4.52 0.00 4.16 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 13 R 8.51 3.90 0.00 2.05 1.97 0.00 3.09 0.00 0.00 3.22 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.65 0.00 14 E 8.03 4.35 0.00 2.22 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 2.36 2.25 0.00 15 T 7.87 4.00 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 16 G 8.18 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 17 E 8.21 4.02 0.00 2.17 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 0.00 2.33 2.58 0.00 18 K 7.98 3.98 0.00 1.97 1.84 0.00 1.69 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.59 1.62 7.81 19 L 7.64 3.98 0.00 1.59 1.72 0.84 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 20 L 7.84 4.18 0.00 1.76 1.77 1.04 0.44 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 21 L 8.27 4.11 0.00 1.86 1.69 0.91 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 22 A 7.89 3.99 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 23 T 7.44 3.92 4.15 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 1.23 0.00 0.00 24 G 7.57 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 0.00 0.00 0.00 25 L 7.49 4.69 0.00 1.52 1.28 0.06 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 26 D 8.70 4.87 0.00 2.88 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 27 G 9.69 4.18 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 0.00 0.00 0.00 28 S 8.15 5.21 0.00 4.02 4.15 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 29 Y 9.01 6.12 0.00 3.21 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 30 L 8.53 5.08 0.00 1.69 1.71 0.94 -0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 31 L 9.45 5.43 0.00 1.82 1.70 0.99 0.75 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 32 R 8.89 5.05 0.00 2.10 2.04 0.00 3.02 0.00 0.00 3.19 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.68 0.00 33 D 8.88 5.07 0.00 2.76 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 34 S 8.41 4.38 0.00 3.98 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 35 E 8.92 4.16 0.00 2.00 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 2.32 2.30 0.00 36 S 7.55 4.51 0.00 3.84 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 37 V 7.47 4.26 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 0.98 0.00 0.00 0.93 0.00 0.00 38 P 0.00 4.17 0.00 2.06 1.96 0.00 3.78 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.07 0.00 39 G 8.73 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 0.00 0.00 0.00 40 V 7.10 4.63 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 1.02 0.00 0.00 0.94 0.00 0.00 41 Y 9.57 5.28 0.00 3.04 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 42 C 9.24 5.28 0.00 2.92 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 43 L 9.35 4.81 0.00 1.77 1.66 1.01 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 44 C 9.20 5.46 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 45 V 9.09 5.14 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 1.07 0.00 0.00 1.06 0.00 0.00 46 L 8.92 5.05 0.00 1.96 1.67 1.07 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 47 Y 9.55 5.09 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 48 H 9.86 4.26 0.00 3.03 3.22 0.00 5.73 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 G 8.59 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 0.00 0.00 0.00 0.00 50 Y 7.92 4.62 0.00 3.10 2.50 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.12 4.81 1.88 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.49 0.97 0.00 0.00 52 Y 9.46 4.02 0.00 3.17 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 53 T 8.31 5.03 4.16 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 1.23 0.00 0.00 54 Y 9.08 4.65 0.00 2.88 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 55 R 8.64 4.87 0.00 1.84 1.93 0.00 3.10 0.00 0.00 3.29 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.66 0.00 56 V 9.39 5.26 2.33 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 1.17 0.00 0.00 1.04 0.00 0.00 57 S 9.20 5.18 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 58 Q 8.61 5.14 0.00 1.53 1.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.80 0.00 0.00 0.00 0.00 0.00 1.16 1.16 0.00 59 T 7.74 4.53 4.15 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 1.23 0.00 0.00 60 E 8.66 3.87 0.00 2.05 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 0.00 2.21 2.20 0.00 61 T 7.70 3.92 4.16 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 1.13 0.00 0.00 62 G 7.81 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 63 S 7.34 4.90 0.00 4.05 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 64 W 9.76 5.22 0.00 3.54 3.33 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 65 S 9.05 5.20 0.00 3.90 3.79 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 66 A 8.67 5.20 1.27 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 0.00 0.00 67 E 9.11 4.00 0.00 2.19 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 2.37 2.36 0.00 68 T 8.44 4.67 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 1.28 0.00 0.00 69 A 8.32 4.19 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 70 P 0.00 4.40 0.00 2.20 2.10 0.00 3.77 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.99 0.00 71 G 9.12 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 72 V 7.15 4.28 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 0.85 0.00 0.00 0.95 0.00 0.00 73 H 8.72 4.21 0.00 3.14 3.25 0.00 5.95 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 K 8.40 4.17 0.00 1.63 1.14 0.00 1.74 0.00 0.00 1.67 0.00 0.00 3.00 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.32 1.41 7.81 75 R 7.95 4.36 0.00 1.73 1.45 0.00 3.08 0.00 0.00 3.17 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.56 0.00 76 Y 7.89 5.03 0.00 2.85 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 77 F 9.05 4.96 0.00 3.23 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 78 R 9.14 4.03 0.00 1.91 2.09 0.00 3.20 0.00 0.00 3.27 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.72 0.00 79 K 7.91 4.70 0.00 1.79 1.67 0.00 1.75 0.00 0.00 1.84 0.00 0.00 2.90 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.49 1.36 7.81 80 I 7.41 3.22 0.71 0.00 0.00 -0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.48 0.52 0.00 0.00 81 K 7.80 3.94 0.00 1.95 1.96 0.00 1.51 0.00 0.00 1.78 0.00 0.00 2.94 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.43 1.47 7.81 82 N 8.12 4.46 0.00 2.97 2.97 0.00 0.00 6.49 6.66 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 83 L 7.02 2.44 0.00 1.21 1.57 1.15 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 84 I 7.26 3.71 1.89 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.48 0.83 0.00 0.00 85 S 7.62 4.14 0.00 3.73 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 86 A 7.41 3.77 0.86 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 87 F 7.42 4.71 0.00 2.93 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 88 Q 7.75 4.32 0.00 2.04 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.66 6.91 0.00 0.00 0.00 0.00 0.00 2.24 2.52 0.00 89 K 7.07 4.26 0.00 1.80 1.67 0.00 1.61 0.00 0.00 1.70 0.00 0.00 3.00 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.40 1.29 7.81 90 P 0.00 4.36 0.00 2.15 2.03 0.00 3.87 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.92 0.00 91 D 8.23 4.27 0.00 2.72 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 92 Q 8.04 4.42 0.00 2.20 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.37 0.00 0.00 0.00 0.00 0.00 2.55 2.41 0.00 93 G 8.44 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 0.00 0.00 0.00 94 I 7.00 4.34 1.39 0.00 0.00 0.50 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 0.52 -0.30 0.00 0.00 95 V 7.79 3.35 1.10 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 0.06 0.00 0.00 0.47 0.00 0.00 96 I 6.77 4.15 1.20 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 1.36 0.39 0.86 0.00 0.00 97 P 0.00 4.36 0.00 2.01 2.06 0.00 3.67 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.05 0.00 98 L 8.42 3.87 0.00 1.13 0.13 0.29 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 99 Q 9.54 4.10 0.00 1.19 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.86 6.86 0.00 0.00 0.00 0.00 0.00 2.12 2.48 0.00 100 Y 7.85 4.70 0.00 3.01 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 0.00 101 P 0.00 3.44 0.00 1.87 1.80 0.00 3.76 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.93 0.00 102 V 8.07 4.07 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 0.76 0.00 0.00 0.90 0.00 0.00 103 E 8.36 4.40 0.00 1.87 1.84 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 2.40 2.26 0.00 104 K 8.12 3.87 0.00 1.33 1.52 0.00 1.64 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.32 1.15 7.81