NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.5981 8.3049 120.3471 55.0048 33.6418 175.2592 2 N 4.3022 8.7972 122.5574 51.6032 39.4635 173.2483 3 T 4.5739 7.8823 111.6512 60.3282 72.5847 173.9504 4 P 4.1842 0.0000 0.0000 66.0278 31.1619 178.6578 5 E 3.8756 8.0298 117.9537 59.4165 29.3646 178.5511 6 H 4.0567 8.2271 118.1556 59.6164 29.9705 177.2041 7 M 3.3252 7.5748 120.3721 58.4863 31.6358 179.0100 8 T 3.8177 8.0474 115.7631 66.3154 68.5191 176.5520 9 A 3.9336 8.1696 123.1273 55.2897 18.3590 179.8218 10 V 3.4780 7.9290 116.8680 66.0418 31.5375 178.3468 11 V 3.3991 7.7604 117.9298 66.1850 31.3241 178.0675 12 Q 3.9076 8.0866 117.7230 58.7188 28.4300 178.8234 13 R 3.8289 8.2129 120.1040 59.5184 30.2173 177.6130 14 Y 4.1156 8.3526 119.8181 60.9713 38.7131 178.4942 15 V 3.4359 7.9840 118.6127 65.9980 31.6435 177.8786 16 A 3.9771 8.1535 120.2812 54.8956 18.1548 179.4142 17 A 3.8818 8.6104 119.7207 55.3533 18.3597 179.7870 18 L 3.8881 7.7344 117.3858 58.1430 41.4478 179.6446 19 N 4.4027 8.0858 115.0756 55.6441 38.5594 176.4563 20 A 4.4099 7.7879 119.9247 51.3294 19.1736 177.5067 21 G 3.8425 7.4654 104.7870 46.8429 0.0000 175.4457 22 D 4.5914 8.1438 121.3997 51.8103 38.6464 175.4583 23 L 4.0242 7.9237 125.7336 58.1526 42.4235 177.7052 24 D 4.5121 8.2118 118.1345 57.4243 40.5427 178.9652 25 G 3.6688 8.0995 106.6726 47.0661 0.0000 175.7447 26 I 3.9078 7.5627 121.8068 64.3300 37.2585 178.5739 27 V 3.7707 7.9089 118.8456 65.9912 31.1533 177.6295 28 A 4.1791 8.1905 119.2447 54.3270 18.4559 178.9289 29 L 3.9582 8.0598 117.4324 55.5855 41.7768 176.7014 30 F 4.8756 7.4900 116.8758 55.1751 40.9184 175.6992 31 A 4.2353 8.3976 126.5254 52.1582 18.9448 178.6552 32 D 4.5336 9.0868 119.2961 56.1618 41.0223 178.0585 33 D 5.0152 7.8609 116.2137 52.6516 39.8898 175.9777 34 A 4.6262 7.6866 121.9792 53.4869 19.8299 177.3616 35 T 4.9901 8.7420 108.3320 59.8532 72.6831 173.0178 36 V 4.6163 8.5282 123.5241 61.1045 34.3834 173.7612 37 E 4.7172 9.1548 129.3290 54.5539 31.5690 174.3260 38 D 4.9215 8.1983 127.2222 52.3039 43.7217 172.9254 39 P 4.8173 0.0000 0.0000 61.3836 33.5259 175.6956 40 V 3.8145 8.1707 120.5523 64.8419 31.6548 175.7140 41 G 3.9718 9.2276 115.3669 45.4053 0.0000 173.9972 42 S 4.3834 7.3008 113.4899 57.1345 64.0144 173.3028 43 E 4.1039 8.3619 122.1433 54.9865 29.9557 174.3696 44 P 4.5835 0.0000 0.0000 63.0547 32.3254 175.6463 45 R 4.6260 8.5882 122.3244 55.0081 31.8637 175.5960 46 S 4.9076 8.5434 117.1158 57.6748 66.3640 174.7849 47 G 4.2419 9.1896 107.1846 45.9095 0.0000 174.4651 48 T 3.8360 8.6910 116.6870 66.6278 68.4160 176.6907 49 A 3.9965 7.9375 121.4462 55.2453 18.5732 179.3467 50 A 3.9778 7.9520 118.8011 55.3481 18.3531 179.8269 51 I 3.6824 7.8316 118.3011 64.3725 37.1591 178.4527 52 R 4.0065 8.4857 119.9987 59.6910 29.9038 178.4674 53 E 3.9728 8.4246 118.3418 59.0295 29.3942 178.8134 54 F 3.9707 8.6379 121.2975 61.8107 39.5091 176.9814 55 Y 3.9827 8.4437 116.1041 60.7065 37.4128 178.0960 56 A 4.0035 8.1364 121.3459 55.3185 18.9334 178.8497 57 N 4.2839 8.1060 115.6418 56.7325 38.8268 176.9680 58 S 4.0620 7.6356 113.7281 59.9895 63.1019 175.1854 59 L 4.5009 7.0142 121.1425 54.4822 41.6936 177.1510 60 K 3.9616 7.6237 120.8770 58.6243 32.2196 177.2175 61 L 4.8137 7.2816 116.1702 51.6484 44.2719 174.4037 62 P 4.3125 0.0000 0.0000 63.1921 31.7716 175.7401 63 L 5.1212 8.4237 122.0591 53.0020 44.2802 175.5222 64 A 4.8901 8.9515 124.4686 50.2250 21.3729 175.4556 65 V 5.0100 9.7122 124.0027 61.0755 33.9060 174.6530 66 E 4.8919 9.0851 125.6495 54.2379 32.6760 175.1920 67 L 4.7778 8.7801 123.3559 55.1863 42.1281 176.8067 68 T 4.6429 8.7199 112.8865 61.6862 69.7464 173.5901 69 Q 4.6056 7.9132 119.7017 54.6324 32.8804 173.4971 70 E 4.0926 8.5830 117.3313 56.6136 29.9083 177.0700 71 V 3.9130 8.1736 120.5557 63.2091 32.6608 175.0905 72 R 4.7796 8.9626 125.8073 54.5273 32.3509 175.2691 73 A 5.1683 8.4271 125.2124 50.6141 22.0979 175.6105 74 V 4.3100 9.3196 120.6150 61.4311 36.1928 175.5381 75 A 3.7737 9.1765 126.1680 53.5796 17.4884 178.2846 76 N 5.2204 9.1170 117.1561 52.3559 39.9769 174.5854 77 E 5.5308 8.7442 116.1563 55.0804 34.8614 175.0601 78 A 5.3371 9.2396 122.0071 50.5922 23.3110 175.0351 79 A 5.3095 9.2315 120.9317 50.4977 23.1098 175.2826 80 F 5.2336 8.7992 113.9830 55.6524 41.9207 172.8862 81 A 5.4197 8.7363 122.3378 50.7702 21.6192 175.6361 82 F 5.3240 8.4213 114.9904 56.5344 42.1917 172.7334 83 T 4.6951 8.9998 108.5562 59.7631 72.0929 172.9637 84 V 4.9845 8.7231 123.7705 61.3319 34.4060 174.3227 85 S 5.3483 9.0831 123.7262 56.8981 66.3874 173.0851 86 F 5.2479 8.2519 117.4852 56.1815 41.8396 172.5493 87 E 5.0661 8.9117 118.8131 54.5136 32.5161 173.5463 88 Y 4.8876 9.0319 126.3665 57.2904 41.9339 174.9531 89 Q 3.2159 9.2793 126.1614 57.0173 26.3615 174.4883 90 G 3.9537 8.2239 101.2264 45.9970 0.0000 173.2801 91 R 4.4892 7.8916 120.5228 54.0493 31.7555 174.5983 92 K 4.9040 8.3754 124.4402 55.3512 34.4371 175.5977 93 T 4.7306 8.3445 120.3973 61.5853 72.9770 173.2070 94 V 4.6712 8.7976 123.9817 61.2923 34.6967 174.1879 95 V 4.5595 8.7838 128.4029 61.3576 33.7085 174.5199 96 A 4.5687 8.5022 128.7231 48.5257 19.2163 173.7855 97 P 4.8184 0.0000 0.0000 61.5997 34.7866 174.1567 98 I 4.9223 8.5671 120.3880 60.0535 40.0510 175.1821 99 N 5.2802 8.6883 124.6831 51.7761 41.5481 173.3491 100 H 5.0341 8.9707 120.8956 54.4813 33.0432 172.2059 101 F 5.5650 9.1340 124.4429 55.8115 41.7907 174.4177 102 R 5.1496 8.7013 122.8375 54.6889 32.5566 174.5913 103 F 5.2626 9.2130 124.1651 55.7389 42.2285 175.2462 104 N 4.8100 9.0700 120.4223 51.3921 39.1805 176.1167 105 G 3.6791 8.5415 105.9287 48.2270 0.0000 174.3070 106 A 4.1947 8.1149 120.5828 52.1917 18.8182 177.9072 107 G 4.4798 8.6612 104.8900 45.5523 0.0000 174.0619 108 K 4.4503 8.2034 119.1702 54.7173 33.7320 175.9772 109 V 3.4357 7.7384 121.9450 62.9132 31.8720 176.8101 110 V 4.2420 8.5388 120.9722 61.9597 33.2676 175.7450 111 S 5.1264 7.4911 114.7605 57.3533 65.9137 172.5022 112 M 5.6104 9.2887 126.7581 53.9236 35.3779 174.2383 113 R 5.1586 9.2047 123.7927 54.3378 34.2900 174.1180 114 A 5.1831 9.0231 125.6139 49.5384 21.4528 175.1420 115 L 4.9057 9.0599 126.5690 54.4391 43.3791 175.2671 116 F 5.1625 8.0347 119.5552 56.3399 40.6698 173.6227 117 G 4.1945 9.0835 109.3676 43.7104 0.0000 172.6368 118 E 4.0491 8.8055 118.3072 59.1827 29.6822 179.5775 119 K 3.9218 8.1441 116.8749 59.2610 32.2944 176.9015 120 N 4.8932 8.7164 115.0570 52.8583 39.8165 174.2022 121 I 4.7579 7.6264 120.5022 59.9218 39.3108 174.7398 122 H 5.0925 9.3217 122.9196 53.4710 33.4378 172.7845 123 A 4.4753 8.8574 121.2881 51.6889 19.3753 177.9838 124 G 4.2319 7.9694 105.6608 46.3140 0.0000 173.8169 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 8.30 4.60 0.00 1.98 2.03 0.00 0.00 0.00 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.68 0.00 2 N 8.80 4.30 0.00 2.68 2.51 0.00 0.00 6.69 6.17 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 3 T 7.88 4.57 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 1.17 0.00 0.00 4 P 0.00 4.18 0.00 2.24 2.31 0.00 3.65 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.03 0.00 5 E 8.03 3.88 0.00 2.04 2.01 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 2.37 2.40 0.00 6 H 8.23 4.06 0.00 3.16 3.33 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 7 M 7.57 3.33 0.00 1.71 1.80 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 0.81 0.00 8 T 8.05 3.82 4.34 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 1.16 0.00 0.00 9 A 8.17 3.93 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 10 V 7.93 3.48 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 0.91 0.00 0.00 0.80 0.00 0.00 11 V 7.76 3.40 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 -0.09 0.00 0.00 0.64 0.00 0.00 12 Q 8.09 3.91 0.00 2.22 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.59 0.00 0.00 0.00 0.00 0.00 2.32 2.50 0.00 13 R 8.21 3.83 0.00 2.08 1.92 0.00 3.10 0.00 0.00 3.08 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.62 0.00 14 Y 8.35 4.12 0.00 3.10 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 15 V 7.98 3.44 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 0.97 0.00 0.00 0.91 0.00 0.00 16 A 8.15 3.98 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 17 A 8.61 3.88 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 18 L 7.73 3.89 0.00 1.73 1.68 0.41 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 19 N 8.09 4.40 0.00 2.84 2.88 0.00 0.00 7.00 7.12 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 20 A 7.79 4.41 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 21 G 7.47 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 0.00 0.00 0.00 22 D 8.14 4.59 0.00 2.75 2.67 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 0.00 0.00 0.00 0.00 23 L 7.92 4.02 0.00 1.81 1.68 1.05 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 24 D 8.21 4.51 0.00 2.76 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 25 G 8.10 3.67 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 I 7.56 3.91 1.84 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.76 0.33 0.00 0.00 27 V 7.91 3.77 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 1.07 0.00 0.00 1.04 0.00 0.00 28 A 8.19 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 29 L 8.06 3.96 0.00 1.32 1.28 0.92 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 30 F 7.49 4.88 0.00 3.12 2.91 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 31 A 8.40 4.24 1.30 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 0.00 0.00 32 D 9.09 4.53 0.00 2.73 2.75 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 33 D 7.86 5.02 0.00 2.76 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 A 7.69 4.63 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.74 4.99 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 1.19 0.00 0.00 36 V 8.53 4.62 1.59 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 0.33 0.00 0.00 0.71 0.00 0.00 37 E 9.15 4.72 0.00 1.99 1.77 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 2.28 2.30 0.00 38 D 8.20 4.92 0.00 2.69 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 0.00 0.00 0.00 0.00 39 P 0.00 4.82 0.00 1.61 1.09 0.00 3.76 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.75 0.00 40 V 8.17 3.81 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 0.70 0.00 0.00 0.94 0.00 0.00 41 G 9.23 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 42 S 7.30 4.38 0.00 3.99 3.90 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 43 E 8.36 4.10 0.00 1.91 1.86 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 2.27 2.32 0.00 44 P 0.00 4.58 0.00 2.06 1.99 0.00 3.77 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.97 0.00 45 R 8.59 4.63 0.00 1.61 1.79 0.00 3.15 0.00 0.00 3.05 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.41 0.00 46 S 8.54 4.91 0.00 3.90 3.73 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 47 G 9.19 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 0.00 0.00 0.00 0.00 48 T 8.69 3.84 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 1.23 0.00 0.00 49 A 7.94 4.00 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 50 A 7.95 3.98 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 51 I 7.83 3.68 1.82 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.55 0.58 0.00 0.00 52 R 8.49 4.01 0.00 1.89 2.02 0.00 3.12 0.00 0.00 3.19 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.74 0.00 53 E 8.42 3.97 0.00 2.26 1.99 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 2.34 2.35 0.00 54 F 8.64 3.97 0.00 3.05 3.07 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 0.00 0.00 0.00 55 Y 8.44 3.98 0.00 3.16 3.03 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 56 A 8.14 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 57 N 8.11 4.28 0.00 2.82 2.74 0.00 0.00 7.03 6.43 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 58 S 7.64 4.06 0.00 3.79 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 59 L 7.01 4.50 0.00 1.64 1.70 0.94 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 60 K 7.62 3.96 0.00 1.64 1.81 0.00 1.53 0.00 0.00 1.61 0.00 0.00 3.08 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.42 1.42 7.81 61 L 7.28 4.81 0.00 1.52 1.61 0.98 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 62 P 0.00 4.31 0.00 2.09 2.03 0.00 3.71 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.14 0.00 63 L 8.42 5.12 0.00 1.55 1.64 0.97 0.79 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 64 A 8.95 4.89 1.25 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 0.00 0.00 0.00 65 V 9.71 5.01 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 1.13 0.00 0.00 1.02 0.00 0.00 66 E 9.09 4.89 0.00 2.12 2.05 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 2.22 2.30 0.00 67 L 8.78 4.78 0.00 1.61 1.72 0.91 1.03 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 68 T 8.72 4.64 4.29 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 1.34 0.00 0.00 69 Q 7.91 4.61 0.00 2.09 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.99 0.00 0.00 0.00 0.00 0.00 2.31 2.38 0.00 70 E 8.58 4.09 0.00 2.09 1.99 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 2.31 2.34 0.00 71 V 8.17 3.91 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 0.80 0.00 0.00 0.87 0.00 0.00 72 R 8.96 4.78 0.00 2.01 1.85 0.00 3.33 0.00 0.00 3.23 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.63 0.00 73 A 8.43 5.17 1.15 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 0.00 0.00 74 V 9.32 4.31 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 0.65 0.00 0.00 0.94 0.00 0.00 75 A 9.18 3.77 1.24 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 0.00 0.00 0.00 76 N 9.12 5.22 0.00 2.71 3.04 0.00 0.00 6.56 7.66 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 77 E 8.74 5.53 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 2.34 2.35 0.00 78 A 9.24 5.34 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 79 A 9.23 5.31 1.24 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 0.00 0.00 0.00 80 F 8.80 5.23 0.00 3.04 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 81 A 8.74 5.42 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 82 F 8.42 5.32 0.00 3.43 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 83 T 9.00 4.70 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 1.17 0.00 0.00 84 V 8.72 4.98 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 1.21 0.00 0.00 1.04 0.00 0.00 85 S 9.08 5.35 0.00 3.88 3.67 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 0.00 0.00 0.00 0.00 86 F 8.25 5.25 0.00 3.11 3.15 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 87 E 8.91 5.07 0.00 1.98 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 2.29 2.29 0.00 88 Y 9.03 4.89 0.00 3.13 2.94 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 9.28 3.22 0.00 1.77 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.19 0.00 0.00 0.00 0.00 0.00 1.16 1.52 0.00 90 G 8.22 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 91 R 7.89 4.49 0.00 1.84 1.94 0.00 3.11 0.00 0.00 3.18 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.54 0.00 92 K 8.38 4.90 0.00 1.68 1.59 0.00 1.63 0.00 0.00 1.78 0.00 0.00 2.83 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.41 1.41 7.81 93 T 8.34 4.73 2.75 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 1.01 0.00 0.00 94 V 8.80 4.67 2.05 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 0.90 0.00 0.00 0.86 0.00 0.00 95 V 8.78 4.56 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 0.24 0.00 0.00 0.97 0.00 0.00 96 A 8.50 4.57 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 P 0.00 4.82 0.00 2.03 2.04 0.00 2.34 0.00 0.00 3.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 1.29 0.00 98 I 8.57 4.92 1.89 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.68 0.90 0.00 0.00 99 N 8.69 5.28 0.00 1.44 2.17 0.00 0.00 5.96 8.42 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 0.00 100 H 8.97 5.03 0.00 3.12 3.11 0.00 5.54 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 0.00 101 F 9.13 5.56 0.00 2.89 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 0.00 0.00 0.00 0.00 102 R 8.70 5.15 0.00 1.98 1.78 0.00 3.08 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 1.57 1.84 0.00 103 F 9.21 5.26 0.00 2.82 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 N 9.07 4.81 0.00 2.94 3.00 0.00 0.00 6.91 6.48 0.00 0.00 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 G 8.54 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 0.00 106 A 8.11 4.19 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 0.00 107 G 8.66 4.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 K 8.20 4.45 0.00 1.78 1.73 0.00 1.66 0.00 0.00 1.58 0.00 0.00 2.89 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.42 1.51 7.81 109 V 7.74 3.44 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 0.07 0.00 0.00 -0.79 0.00 0.00 110 V 8.54 4.24 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 0.66 0.00 0.00 0.97 0.00 0.00 111 S 7.49 5.13 0.00 3.89 3.69 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 0.00 112 M 9.29 5.61 0.00 2.40 2.28 0.00 0.00 0.00 0.00 0.00 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.74 2.69 0.00 113 R 9.20 5.16 0.00 1.79 1.78 0.00 3.14 0.00 0.00 3.16 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.60 0.00 114 A 9.02 5.18 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 0.00 0.00 0.00 0.00 0.00 0.00 115 L 9.06 4.91 0.00 1.70 1.69 0.91 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 116 F 8.03 5.16 0.00 3.01 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 0.00 117 G 9.08 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 0.00 0.00 0.00 118 E 8.81 4.05 0.00 2.06 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 2.39 2.41 0.00 119 K 8.14 3.92 0.00 1.79 1.90 0.00 1.81 0.00 0.00 1.72 0.00 0.00 2.98 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.46 1.43 7.81 120 N 8.72 4.89 0.00 2.90 3.04 0.00 0.00 6.69 7.24 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 0.00 121 I 7.63 4.76 1.97 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.86 0.91 0.00 0.00 122 H 9.32 5.09 0.00 2.94 3.12 0.00 5.61 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 0.00 123 A 8.86 4.48 1.20 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 0.00 0.00 124 G 7.97 4.23 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 0.00