NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 G 3.9504 8.3549 109.7059 45.4135 0.0000 175.3447 17 I 3.5717 7.4411 122.7625 63.1822 37.5555 176.0410 18 T 3.8511 7.7060 116.8468 62.8582 69.6983 173.8725 19 G 3.9763 7.2907 112.1599 43.8319 0.0000 171.4167 20 T 4.3641 7.3904 116.8985 62.1792 69.5918 174.9499 21 W 5.2137 8.5872 124.6477 55.1465 33.8248 173.8695 22 Y 5.9598 10.0624 118.7707 55.4224 42.0280 174.8815 23 N 6.0483 9.0087 119.6870 50.3192 40.2544 175.4164 24 Q 4.2605 8.7406 116.2169 58.2960 28.4517 177.1589 25 L 4.3120 8.6461 118.1415 54.8313 42.3782 177.4532 26 G 3.9667 8.7718 106.9288 45.6933 0.0000 173.7876 27 S 4.6319 8.2029 114.9280 58.3837 64.7167 173.0405 28 T 4.8456 8.6631 119.1301 61.7493 71.2909 173.2536 29 F 4.8707 8.7751 128.4991 56.6036 41.6318 174.0488 30 I 4.2324 8.3283 129.0344 59.6010 38.5718 175.3337 31 V 4.3715 7.4953 127.2353 59.8886 34.5231 175.1309 32 T 4.6254 8.4505 118.2540 62.0282 72.6171 172.6391 33 A 4.8488 8.3553 129.4970 50.0241 19.9603 177.1077 34 G 3.7350 9.3842 112.0659 45.5803 0.0000 174.0545 35 A 4.1750 8.6185 124.0944 54.0258 18.5120 178.0922 36 D 4.6155 8.1785 113.8868 52.9797 39.9202 177.0167 37 G 3.0820 8.3754 107.9772 45.4188 0.0000 172.9703 38 A 4.9917 7.8708 120.4855 50.4297 21.6920 176.8830 39 L 5.3144 8.5709 118.8906 53.1850 45.5631 176.0332 40 T 4.7708 9.4486 113.1693 59.5637 72.7406 174.5928 41 G 4.6479 6.6826 107.0063 46.2152 0.0000 171.2049 42 T 5.3231 7.5590 115.1769 62.0393 72.8575 172.6489 43 Y 5.2111 9.2061 124.3699 56.0428 42.8122 173.3377 44 E 5.2684 9.1659 127.2414 54.5809 32.6562 174.1217 45 S 5.2171 9.2366 121.6345 57.1172 63.3398 173.9247 46 A 4.2839 8.7642 129.3727 53.8459 18.6608 177.2638 47 V 4.3719 7.2064 107.2985 60.3632 35.8506 175.5689 48 G 3.5897 8.4692 108.7102 44.7463 0.0000 173.8205 49 N 4.4765 7.9191 115.6025 51.3229 37.1224 173.8570 50 A 4.6914 7.6036 122.5337 51.4026 22.1728 175.7542 51 E 4.6774 9.0368 116.0998 56.3476 32.7209 177.1140 52 S 3.8020 8.5346 116.2825 57.7951 62.1083 170.1463 53 R 4.7951 8.3503 117.1852 56.2831 30.9842 175.8397 54 Y 4.8220 9.0034 119.3214 56.0619 42.1412 175.0709 55 V 4.4379 8.5623 122.5483 62.6707 32.8389 174.9672 56 L 5.3543 8.6943 126.2557 53.5552 44.2465 174.9805 57 T 4.9826 8.2517 112.7109 61.6021 71.3809 173.0113 58 G 4.7411 8.3746 111.5436 46.3569 0.0000 171.9272 59 R 5.6612 8.7504 117.7660 55.1093 34.9910 173.9780 60 Y 5.2533 8.6943 117.6062 55.5385 41.4153 174.2041 61 D 4.3227 8.7016 121.3699 54.6001 41.4549 175.8447 62 S 4.5444 8.3437 119.7517 58.0104 63.8989 175.1509 63 A 4.6687 7.9089 122.7558 51.0867 19.5427 173.9896 64 P 4.6758 0.0000 0.0000 60.8943 33.1092 176.8344 65 A 4.2012 8.3741 121.6562 52.8910 18.6844 177.4869 66 T 4.5504 8.3033 107.9636 61.4581 69.3603 175.3485 67 D 4.3710 7.9672 120.6525 54.4073 39.7936 176.8503 68 G 4.0640 7.6727 108.3292 45.5953 0.0000 174.1851 69 S 4.3674 8.2217 115.5899 57.8866 63.4397 174.0859 70 G 4.0326 8.3086 109.7179 46.2262 0.0000 172.9651 71 T 4.7960 8.9729 117.1471 61.7501 70.2067 174.9422 72 A 4.7560 8.7531 128.9933 52.2980 20.0996 175.8427 73 L 4.9773 8.7967 119.8153 55.6465 44.5744 173.7969 74 G 5.0627 9.0865 104.6546 45.7355 0.0000 172.3760 75 W 5.7766 8.0901 117.3525 55.7543 31.6908 173.1455 76 T 5.2238 9.2177 116.6169 61.9618 72.4781 173.5346 77 V 4.3940 8.7882 123.5073 61.2959 34.9354 173.5811 78 A 4.6752 8.3216 129.8555 49.5077 20.2053 177.7167 79 W 4.3073 9.2893 127.3468 56.3175 27.7105 176.7038 80 K 5.2144 8.0608 119.6258 54.7430 35.2517 174.4187 81 N 4.9354 9.1220 122.3953 51.7412 40.1089 174.4581 82 N 4.2411 8.5372 114.2722 55.9182 38.5573 175.5532 83 Y 4.5226 7.1140 113.7547 58.5791 39.4323 175.4529 84 R 4.4632 8.1736 114.5007 55.6737 32.3796 172.9936 85 N 5.2873 8.6823 116.1599 52.0414 41.0303 173.8304 86 A 4.1885 9.1108 128.8782 52.3980 20.2329 176.1559 87 H 4.1807 8.9942 113.4287 55.9160 26.1945 173.7285 88 S 5.2469 7.3906 112.1057 57.6571 66.7277 174.7940 89 A 4.8625 8.9407 121.7697 50.9366 22.9010 175.2400 90 T 4.9784 9.0353 116.8917 61.7237 72.6517 173.1528 91 T 4.8690 8.5275 115.2750 59.6018 72.0125 172.6267 92 W 4.7849 8.5778 125.4054 54.8693 31.2534 174.7691 93 S 4.8346 8.6538 120.4975 56.6912 64.6318 173.2812 94 G 4.9753 8.4152 112.2691 47.0637 0.0000 171.7997 95 Q 5.2927 8.2555 117.1462 54.8570 32.8111 173.2816 96 Y 4.8857 9.5942 123.0127 56.5250 40.9086 174.3588 97 V 4.3451 8.4048 126.0033 61.0319 34.6544 175.3304 98 G 4.0327 8.6824 115.0134 44.7589 0.0000 170.9198 99 G 3.8701 9.0514 104.5691 43.2514 0.0000 173.3157 100 A 4.0185 8.7023 121.7247 54.6873 18.0531 177.5262 101 E 4.4267 7.8614 116.8956 54.2017 29.1614 173.6934 102 A 4.6040 8.2435 126.1355 51.5327 19.5037 176.5806 103 R 5.2476 9.2662 120.5795 54.7991 35.7291 174.2392 104 I 4.9231 8.8464 121.9125 59.8403 40.1879 174.3539 105 N 5.3491 8.7803 125.7696 52.1767 40.3777 174.6386 106 T 5.3102 9.1764 113.1551 60.1565 73.1718 172.6329 107 Q 5.1137 9.0194 120.9166 53.8646 32.3771 174.8098 108 W 5.3669 8.0123 118.4940 54.6236 32.3810 173.8019 109 L 5.2012 8.7405 120.4030 52.8973 44.6317 175.2749 110 L 4.9971 9.2927 126.5579 53.7907 44.4506 174.8627 111 T 5.1196 8.8457 123.9327 62.0198 70.9075 174.0229 112 S 5.1541 8.8074 122.3074 56.4029 65.4846 174.3572 113 G 3.8695 8.4764 111.1906 46.6452 0.0000 173.0366 114 T 4.8137 8.3276 114.3337 59.6220 72.3628 173.1322 115 T 4.2701 8.0499 111.4793 60.7732 69.7659 175.4762 116 E 3.9561 8.6804 121.0750 59.3407 29.6746 178.8079 117 A 4.1706 7.6065 120.8086 54.6558 18.7702 177.8395 118 N 4.8328 8.0252 111.2489 53.0479 39.0742 176.9064 119 A 4.2316 8.1969 123.5732 54.3398 18.6766 180.3177 120 F 4.3964 8.4486 110.3092 58.8367 38.0918 175.8183 121 K 4.2741 6.9205 120.8271 56.2841 32.7735 177.2671 122 S 4.3648 7.8629 115.7886 60.4989 63.8829 173.3495 123 T 5.0635 7.6081 117.0464 61.7781 71.1565 173.3874 124 L 4.7737 9.0586 127.3460 53.4094 43.9319 176.1454 125 V 4.5045 7.2108 120.3793 59.3413 34.6726 175.5743 126 G 3.2886 5.9662 106.5472 46.1791 0.0000 171.1772 127 H 5.4185 8.2088 114.5557 54.3334 31.6453 172.7409 128 D 5.2988 9.3148 119.7683 52.9358 45.1944 174.6731 129 T 5.0447 10.2490 118.5327 61.8824 71.6550 172.9092 130 F 5.6471 9.6948 125.8520 56.1626 41.7493 175.0648 131 T 5.6692 9.4792 112.4979 60.4129 73.1907 174.3530 132 K 4.1974 8.6000 119.6225 56.5784 32.3489 176.7080 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 16 G 8.35 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 17 I 7.44 3.57 1.38 0.00 0.00 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.66 -0.04 0.57 0.00 0.00 18 T 7.71 3.85 4.13 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 1.10 0.00 0.00 19 G 7.29 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 0.00 0.00 0.00 20 T 7.39 4.36 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 0.68 0.00 0.00 21 W 8.59 5.21 0.00 3.33 3.31 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 0.00 22 Y 10.06 5.96 0.00 2.96 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 23 N 9.01 6.05 0.00 2.41 1.88 0.00 0.00 6.48 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 24 Q 8.74 4.26 0.00 2.21 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.94 0.00 0.00 0.00 0.00 0.00 2.36 2.37 0.00 25 L 8.65 4.31 0.00 1.94 1.81 0.99 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 26 G 8.77 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 0.00 0.00 0.00 27 S 8.20 4.63 0.00 4.09 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 28 T 8.66 4.85 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 1.00 0.00 0.00 29 F 8.78 4.87 0.00 2.61 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 30 I 8.33 4.23 1.72 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 1.09 0.37 0.74 0.00 0.00 31 V 7.50 4.37 0.67 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 0.40 0.00 0.00 0.26 0.00 0.00 32 T 8.45 4.63 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 1.13 0.00 0.00 33 A 8.36 4.85 0.74 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 0.00 0.00 34 G 9.38 3.74 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 0.00 0.00 0.00 35 A 8.62 4.18 1.31 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 0.00 0.00 0.00 36 D 8.18 4.62 0.00 2.77 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 37 G 8.38 3.08 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 0.00 0.00 0.00 38 A 7.87 4.99 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 39 L 8.57 5.31 0.00 1.82 1.55 0.72 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 40 T 9.45 4.77 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 1.21 0.00 0.00 41 G 6.68 4.65 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 0.00 0.00 0.00 42 T 7.56 5.32 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 1.20 0.00 0.00 43 Y 9.21 5.21 0.00 2.99 2.78 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 44 E 9.17 5.27 0.00 2.08 1.80 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 2.32 2.56 0.00 45 S 9.24 5.22 0.00 4.19 3.80 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 46 A 8.76 4.28 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 47 V 7.21 4.37 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 0.76 0.00 0.00 0.88 0.00 0.00 48 G 8.47 3.59 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 N 7.92 4.48 0.00 2.57 2.62 0.00 0.00 6.65 7.96 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 50 A 7.60 4.69 1.08 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 0.00 0.00 51 E 9.04 4.68 0.00 2.07 1.95 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 2.34 2.18 0.00 52 S 8.53 3.80 0.00 3.82 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 53 R 8.35 4.80 0.00 1.76 1.90 0.00 3.21 0.00 0.00 3.24 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.69 0.00 54 Y 9.00 4.82 0.00 3.12 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 55 V 8.56 4.44 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 0.95 0.00 0.00 56 L 8.69 5.35 0.00 2.07 1.82 0.84 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 57 T 8.25 4.98 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 1.27 0.00 0.00 58 G 8.37 4.74 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 0.00 0.00 0.00 59 R 8.75 5.66 0.00 1.77 1.88 0.00 3.43 0.00 0.00 3.25 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.74 0.00 60 Y 8.69 5.25 0.00 3.13 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 61 D 8.70 4.32 0.00 2.79 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 62 S 8.34 4.54 0.00 3.89 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 63 A 7.91 4.67 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 64 P 0.00 4.68 0.00 2.27 2.17 0.00 3.84 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.07 0.00 65 A 8.37 4.20 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 66 T 8.30 4.55 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 1.24 0.00 0.00 67 D 7.97 4.37 0.00 2.80 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 68 G 7.67 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 0.00 0.00 0.00 69 S 8.22 4.37 0.00 3.94 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 70 G 8.31 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 71 T 8.97 4.80 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 1.45 0.00 0.00 72 A 8.75 4.76 1.31 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 0.00 0.00 0.00 73 L 8.80 4.98 0.00 1.92 1.92 1.24 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 74 G 9.09 5.06 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 0.00 75 W 8.09 5.78 0.00 3.56 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 76 T 9.22 5.22 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 1.21 0.00 0.00 77 V 8.79 4.39 1.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.63 0.00 0.00 0.95 0.00 0.00 78 A 8.32 4.68 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 79 W 9.29 4.31 0.00 3.17 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 80 K 8.06 5.21 0.00 1.99 1.74 0.00 1.81 0.00 0.00 1.80 0.00 0.00 3.07 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.38 1.46 7.81 81 N 9.12 4.94 0.00 2.68 2.38 0.00 0.00 6.62 7.82 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 82 N 8.54 4.24 0.00 2.24 2.17 0.00 0.00 6.71 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 83 Y 7.11 4.52 0.00 3.11 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 84 R 8.17 4.46 0.00 2.00 2.10 0.00 3.09 0.00 0.00 3.37 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.61 0.00 85 N 8.68 5.29 0.00 2.67 2.63 0.00 0.00 6.92 7.96 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 86 A 9.11 4.19 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 87 H 8.99 4.18 0.00 3.36 3.37 0.00 5.65 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 88 S 7.39 5.25 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 89 A 8.94 4.86 1.18 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 90 T 9.04 4.98 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 -0.64 0.00 0.00 91 T 8.53 4.87 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 1.14 0.00 0.00 92 W 8.58 4.78 0.00 1.78 1.91 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 93 S 8.65 4.83 0.00 3.81 3.64 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 94 G 8.42 4.98 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 0.00 0.00 0.00 95 Q 8.26 5.29 0.00 2.26 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.08 6.89 0.00 0.00 0.00 0.00 0.00 2.36 2.39 0.00 96 Y 9.59 4.89 0.00 2.97 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 97 V 8.40 4.35 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 0.93 0.00 0.00 0.90 0.00 0.00 98 G 8.68 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 99 G 9.05 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 0.00 100 A 8.70 4.02 1.31 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 0.00 0.00 0.00 101 E 7.86 4.43 0.00 1.94 1.91 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 2.25 2.32 0.00 102 A 8.24 4.60 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 0.00 103 R 9.27 5.25 0.00 1.79 1.92 0.00 3.11 0.00 0.00 3.23 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.64 0.00 104 I 8.85 4.92 1.78 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 -0.22 1.06 0.00 0.00 105 N 8.78 5.35 0.00 2.67 2.80 0.00 0.00 6.06 8.02 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 0.00 106 T 9.18 5.31 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 1.47 0.00 0.00 107 Q 9.02 5.11 0.00 1.92 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.72 0.00 0.00 0.00 0.00 0.00 2.21 2.22 0.00 108 W 8.01 5.37 0.00 2.65 2.38 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 0.00 109 L 8.74 5.20 0.00 1.50 1.53 0.86 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 110 L 9.29 5.00 0.00 1.60 1.69 0.94 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 111 T 8.85 5.12 4.24 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 0.00 0.00 0.00 1.26 0.00 0.00 112 S 8.81 5.15 0.00 3.68 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 0.00 113 G 8.48 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 0.00 114 T 8.33 4.81 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 1.22 0.00 0.00 115 T 8.05 4.27 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 1.21 0.00 0.00 116 E 8.68 3.96 0.00 1.99 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 2.33 2.27 0.00 117 A 7.61 4.17 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 0.00 118 N 8.03 4.83 0.00 2.69 2.76 0.00 0.00 6.85 8.09 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 0.00 119 A 8.20 4.23 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 0.00 120 F 8.45 4.40 0.00 3.14 3.16 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 0.00 121 K 6.92 4.27 0.00 1.52 0.98 0.00 1.11 0.00 0.00 1.33 0.00 0.00 2.92 0.00 0.00 2.96 0.00 0.00 0.00 0.00 0.95 1.04 7.81 122 S 7.86 4.36 0.00 4.21 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 0.00 123 T 7.61 5.06 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 1.19 0.00 0.00 124 L 9.06 4.77 0.00 1.75 1.73 0.94 0.49 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 0.00 125 V 7.21 4.50 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 0.89 0.00 0.00 0.63 0.00 0.00 126 G 5.97 3.29 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 0.00 127 H 8.21 5.42 0.00 3.17 3.12 0.00 5.67 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 D 9.31 5.30 0.00 3.04 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 0.00 0.00 0.00 0.00 129 T 10.25 5.04 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 1.33 0.00 0.00 130 F 9.69 5.65 0.00 2.87 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 0.00 131 T 9.48 5.67 4.44 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 1.41 0.00 0.00 132 K 8.60 4.20 0.00 1.59 1.50 0.00 1.25 0.00 0.00 1.28 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.30 0.74 7.81