NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.2374 8.3044 120.3446 55.6338 33.2173 174.4880 2 H 4.4178 8.7623 126.5262 54.3037 29.6523 172.1737 3 L 4.8224 7.7287 126.3435 52.4053 46.0620 176.9515 4 T 4.1706 8.2578 111.2819 60.6908 71.0545 173.8247 5 P 4.2046 0.0000 0.0000 66.0730 31.2974 178.7084 6 E 3.9938 8.0553 115.6734 59.4006 29.6026 178.9895 7 E 3.9155 7.7528 118.4356 58.9616 29.4809 179.1220 8 K 3.8153 8.0570 119.7107 59.5349 32.1689 178.8224 9 S 4.1292 8.2196 114.0988 60.6773 62.1662 175.9668 10 A 4.0247 8.1254 123.6252 54.9798 18.1069 179.7901 11 V 3.5636 7.9281 117.0791 66.4670 31.1045 178.4819 12 T 4.0487 8.2412 109.5575 64.4804 68.4585 176.4687 13 A 4.0420 8.2437 123.3634 55.0565 18.7189 179.0788 14 L 3.9015 7.8257 118.9148 57.9945 42.1876 178.9652 15 W 4.3508 8.6448 128.4207 60.1534 30.4205 177.9969 16 G 3.8308 8.0990 104.3549 46.6961 0.0000 174.6546 17 K 4.4321 7.8635 118.6950 55.3986 32.9827 176.4924 18 V 3.6578 6.9251 120.3884 61.8814 32.1936 175.5674 19 N 4.4910 8.2859 125.2857 52.5824 39.2086 175.6665 20 V 3.4830 8.1435 128.6997 66.0029 31.7164 177.4476 21 D 4.3175 8.0660 118.1959 57.2324 40.7865 178.1158 22 E 3.8433 8.2948 119.7497 59.4614 29.6428 179.1311 23 V 3.6446 8.0615 118.6708 65.4510 31.4972 178.2028 24 G 3.7101 8.4607 106.2436 47.8746 0.0000 175.9282 25 G 3.6263 8.1881 108.9328 47.1761 0.0000 175.4077 26 E 3.8824 8.2455 121.3831 58.9942 29.6647 178.8506 27 A 3.9218 8.3026 121.2672 55.1110 18.6138 179.4260 28 L 3.9860 8.1269 119.1139 58.1070 42.1158 179.4343 29 G 3.5593 8.1276 105.8440 47.8732 0.0000 176.0206 30 R 3.9166 8.2081 120.6336 58.4331 30.0036 178.6329 31 L 3.9748 8.0233 120.5164 58.5390 42.1119 179.3185 32 L 4.0806 7.7233 119.3025 56.6892 41.2328 179.7076 33 V 3.5498 7.3107 117.8911 65.7714 31.6609 177.9094 34 V 3.5626 7.8243 117.0283 64.1696 32.8272 175.6105 35 Y 3.8573 7.2787 115.7287 54.4143 37.8726 174.2115 36 P 4.7219 0.0000 0.0000 64.0502 31.9885 177.7998 37 W 4.4588 8.0588 115.5692 59.1837 27.6986 177.5637 38 T 4.3052 7.7138 110.1404 63.4532 68.2581 176.0139 39 Q 4.0984 8.5024 122.2425 58.0978 28.4980 177.9949 40 R 3.7408 7.5691 116.6620 58.6060 29.2538 177.8892 41 F 4.3119 7.0392 116.3212 57.5987 39.4996 175.9713 42 F 4.4136 7.8623 118.3901 56.8679 39.5196 177.2426 43 E 4.1068 8.3229 122.3175 58.9754 29.4347 178.1021 44 S 4.5933 8.0829 111.3253 58.8303 63.3886 174.4832 45 F 4.6871 8.4072 119.4052 57.9651 39.9791 176.6331 46 G 3.9975 8.1324 106.2986 44.4766 0.0000 174.0897 47 D 4.5553 8.5692 125.1141 54.0953 41.3234 175.9120 48 L 4.8825 8.3353 126.6646 54.4289 42.8765 177.9973 49 S 4.2846 8.9265 117.5354 60.7888 63.1924 174.6807 50 T 4.7370 7.4356 109.5093 58.0383 73.0200 172.6671 51 P 4.1933 0.0000 0.0000 66.1478 31.3379 178.5940 52 D 4.3215 8.1095 116.6035 57.3508 40.5340 178.6268 53 A 3.9840 7.6527 119.7540 54.9828 18.6455 179.5605 54 V 3.6744 8.0590 116.9831 66.6666 31.4780 178.2988 55 M 4.1791 8.2830 117.3572 57.5709 31.8218 178.0108 56 G 4.0519 7.6351 103.2141 43.2211 0.0000 173.0354 57 N 4.5145 7.8198 121.9155 52.3623 39.4935 174.1584 58 P 4.2877 0.0000 0.0000 65.6971 31.4165 178.7419 59 K 3.7013 8.8657 119.0070 58.9045 31.7914 179.3266 60 V 3.7084 7.9431 118.1158 65.9134 31.5108 177.6812 61 K 3.8380 8.1105 119.0221 59.6538 32.0220 178.5691 62 A 4.0017 8.0026 120.9085 55.2968 18.1641 179.1316 63 H 4.3072 8.4939 117.0423 59.4105 30.0052 177.6270 64 G 3.7012 8.4976 107.9726 47.7383 0.0000 175.5740 65 K 3.9910 7.9808 121.7388 59.1522 32.3373 178.9161 66 K 3.9768 7.9881 119.9986 59.4566 32.1552 179.0251 67 V 3.6097 8.0768 118.8568 66.0846 31.6069 177.7805 68 L 4.3679 8.2949 119.7447 57.4412 41.8724 178.9886 69 G 3.7628 8.3808 106.0582 47.8493 0.0000 175.6174 70 A 4.1123 7.8670 121.8464 54.6881 18.6989 179.0821 71 F 4.2661 8.5618 119.2921 61.5803 39.5489 177.1416 72 S 3.9874 8.9491 112.9589 61.8069 62.3924 176.0447 73 D 4.5366 8.5307 121.3466 57.0361 40.4445 178.9762 74 G 3.5071 7.9842 106.4785 47.3712 0.0000 175.6261 75 L 3.7780 7.2288 119.6429 56.7892 41.5953 178.4881 76 A 4.1535 7.4863 118.8211 53.1313 19.7386 176.6981 77 H 4.8813 7.9686 114.5005 54.8489 29.4721 175.2667 78 L 4.0058 7.7590 119.4291 57.2099 42.1026 178.4011 79 D 4.6804 7.8969 115.8205 53.7480 40.6507 175.8915 80 N 5.0019 7.9424 118.6657 51.9025 39.4553 175.1093 81 L 4.0337 7.8398 122.4895 57.8031 41.8283 179.2676 82 K 4.0320 8.1413 118.1504 59.6709 31.8373 179.4378 83 G 3.6155 7.6717 104.0877 48.0770 0.0000 175.5463 84 T 3.8052 7.6924 117.2308 65.5118 68.5883 175.7984 85 F 4.7627 7.8120 116.6427 56.9066 39.4003 177.2276 86 A 4.0722 7.5916 121.7936 55.8988 18.1264 180.3678 87 T 3.8477 7.8657 113.3619 66.8388 68.6347 176.8586 88 L 4.0834 8.0055 120.3798 57.5623 41.6507 179.3946 89 S 4.3171 8.3680 113.5443 61.5814 62.4428 176.0239 90 E 3.8895 8.1362 121.2103 59.3134 29.1827 179.0909 91 L 3.9550 8.1673 120.4397 58.6353 42.1514 178.8340 92 H 4.2646 8.4686 115.9151 58.4362 28.5890 177.2339 93 C 3.5715 7.6446 120.8293 62.2920 31.2047 175.3515 94 D 4.3260 8.3562 119.9100 56.1719 40.5351 177.3931 95 K 4.3019 7.7122 116.6023 57.5390 33.8127 177.2654 96 L 4.1321 7.6804 116.7444 54.9042 42.3824 176.2370 97 H 4.0076 7.1367 113.9018 56.6956 26.3445 175.6685 98 V 3.9898 7.8775 118.8709 60.8961 32.0712 174.7022 99 D 4.3158 8.9297 127.3381 54.1820 41.3974 175.3875 100 P 3.1048 0.0000 0.0000 64.4175 31.7686 177.9677 101 E 3.8978 8.3252 119.1537 59.1507 29.2186 178.3060 102 N 4.2812 8.0896 116.8830 56.3587 38.5390 177.2505 103 F 4.4606 7.3408 119.0690 60.6397 38.9413 177.9898 104 R 4.0273 7.9315 117.3829 59.0751 29.9671 178.8840 105 L 3.8169 7.8825 118.9660 57.5533 41.5516 179.2086 106 L 4.0857 8.3686 120.8365 58.0552 42.0247 179.1501 107 G 3.7307 8.2562 105.6503 47.8436 0.0000 175.7387 108 K 4.0490 8.1072 120.9686 59.3166 32.0923 179.7182 109 V 3.6816 7.9453 118.5256 65.6493 31.3366 177.8161 110 L 3.8811 8.3887 120.7403 58.1215 41.9512 179.0997 111 V 3.5468 7.9398 118.1425 66.1918 31.3717 177.6974 112 C 4.0761 8.0005 116.2228 62.8403 27.8992 176.3249 113 V 3.5119 7.8664 119.7473 65.9747 31.1057 178.0236 114 L 3.8931 7.9499 118.6903 57.6315 41.3372 179.4456 115 A 3.7034 7.2997 120.6793 55.1955 18.0794 179.1949 116 H 4.1215 8.0925 115.9764 59.6440 30.0186 176.7245 117 H 3.9123 8.2932 119.3568 58.4423 30.1480 176.3413 118 F 4.7094 8.4414 117.4097 56.0467 40.1921 177.2974 119 G 3.8916 8.7731 109.1509 45.9956 0.0000 177.4001 120 K 4.2912 8.8632 122.4840 59.1844 32.3469 177.7275 121 E 4.0765 8.0722 119.4013 58.2287 29.9951 177.0221 122 F 4.5367 8.2778 123.5371 57.1938 37.8097 175.3720 123 T 4.1965 7.2987 115.6243 60.1732 71.3141 173.5744 124 P 4.1595 0.0000 0.0000 65.5815 31.3340 177.2628 125 P 4.1939 0.0000 0.0000 65.4225 31.2476 178.8878 126 V 3.5811 7.4079 116.9147 65.6387 31.3744 177.8781 127 Q 3.5228 7.8951 119.5578 58.9697 29.0289 177.9569 128 A 4.0030 8.1219 121.6816 55.2863 18.4506 179.4917 129 A 3.9178 7.9851 119.0215 55.6458 18.4028 179.5445 130 Y 3.8789 8.3256 115.2416 61.1482 37.8980 178.7916 131 Q 4.1193 8.8947 119.5431 58.8978 28.7288 178.9183 132 K 3.9687 7.9795 119.0827 59.4369 32.0053 179.6050 133 V 3.4897 7.6683 118.1889 66.1782 31.4453 178.6083 134 V 3.8038 8.3255 112.2600 64.1829 31.2531 178.5098 135 A 4.1060 8.2591 120.9829 55.0676 18.1964 179.8735 136 G 3.5305 8.3551 104.5744 47.8846 0.0000 176.1331 137 V 3.3540 8.1067 120.7488 65.5031 31.5070 177.9110 138 A 3.9111 8.0958 120.5838 55.3377 18.0253 179.3476 139 N 4.2825 8.2700 113.7859 56.4329 38.7225 177.1840 140 A 4.1594 8.1414 122.2300 55.2089 18.2793 179.6595 141 L 3.8516 7.7682 115.9637 56.8547 41.8620 178.5248 142 A 4.4233 7.6817 119.2426 53.0466 18.9909 178.4322 143 H 4.2683 7.8291 116.6624 58.5325 29.9172 175.7885 144 K 4.4629 8.0125 117.6558 56.1952 32.1342 176.2928 145 Y 4.2346 8.0972 117.6567 58.5729 38.4192 175.7171 146 H 4.3906 8.3845 116.9407 56.4020 28.0007 173.6237 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 4.24 0.00 2.18 2.02 0.00 0.00 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.46 0.00 2 H 8.76 4.42 0.00 3.22 3.20 0.00 5.72 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 3 L 7.73 4.82 0.00 1.54 1.44 0.81 0.96 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 4 T 8.26 4.17 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 1.20 0.00 0.00 5 P 0.00 4.20 0.00 2.15 2.14 0.00 3.56 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 2.10 2.14 0.00 6 E 8.06 3.99 0.00 2.14 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 2.34 2.33 0.00 7 E 7.75 3.92 0.00 2.17 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 2.30 2.28 0.00 8 K 8.06 3.82 0.00 1.76 1.75 0.00 1.57 0.00 0.00 1.51 0.00 0.00 2.81 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.37 1.35 7.81 9 S 8.22 4.13 0.00 3.93 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 10 A 8.13 4.02 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 11 V 7.93 3.56 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 0.60 0.00 0.00 0.55 0.00 0.00 12 T 8.24 4.05 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 1.28 0.00 0.00 13 A 8.24 4.04 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 14 L 7.83 3.90 0.00 1.84 1.86 0.06 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 0.00 0.00 0.00 0.00 0.00 0.00 15 W 8.64 4.35 0.00 3.82 3.21 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 0.00 16 G 8.10 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 0.00 0.00 0.00 17 K 7.86 4.43 0.00 2.11 2.10 0.00 1.87 0.00 0.00 1.71 0.00 0.00 2.93 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.48 1.63 7.81 18 V 6.93 3.66 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 -0.02 0.00 0.00 0.70 0.00 0.00 19 N 8.29 4.49 0.00 2.71 2.59 0.00 0.00 6.85 7.71 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 20 V 8.14 3.48 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 1.26 0.00 0.00 0.96 0.00 0.00 21 D 8.07 4.32 0.00 2.85 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 22 E 8.29 3.84 0.00 1.99 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 2.23 2.26 0.00 23 V 8.06 3.64 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 0.92 0.00 0.00 0.64 0.00 0.00 24 G 8.46 3.71 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 0.00 0.00 0.00 25 G 8.19 3.63 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 0.00 26 E 8.25 3.88 0.00 2.14 2.09 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 2.26 2.32 0.00 27 A 8.30 3.92 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 28 L 8.13 3.99 0.00 1.76 1.64 0.89 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 29 G 8.13 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 0.00 0.00 0.00 30 R 8.21 3.92 0.00 1.90 1.92 0.00 3.09 0.00 0.00 3.02 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.65 0.00 31 L 8.02 3.97 0.00 1.87 1.90 0.98 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 32 L 7.72 4.08 0.00 1.83 1.67 0.69 0.49 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 33 V 7.31 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 0.70 0.00 0.00 0.93 0.00 0.00 34 V 7.82 3.56 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 -0.14 0.00 0.00 0.76 0.00 0.00 35 Y 7.28 3.86 0.00 2.56 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 36 P 0.00 4.72 0.00 2.24 2.10 0.00 3.88 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.09 0.00 37 W 8.06 4.46 0.00 3.53 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 38 T 7.71 4.31 4.42 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 1.11 0.00 0.00 39 Q 8.50 4.10 0.00 2.22 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.81 0.00 0.00 0.00 0.00 0.00 2.41 2.50 0.00 40 R 7.57 3.74 0.00 1.70 1.99 0.00 2.92 0.00 0.00 2.52 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.50 0.00 41 F 7.04 4.31 0.00 1.65 2.27 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 42 F 7.86 4.41 0.00 2.78 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 0.00 0.00 0.00 43 E 8.32 4.11 0.00 1.95 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 2.21 0.00 44 S 8.08 4.59 0.00 4.11 4.08 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 45 F 8.41 4.69 0.00 3.19 3.14 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 46 G 8.13 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 0.00 0.00 0.00 47 D 8.57 4.56 0.00 2.65 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 48 L 8.34 4.88 0.00 1.65 1.62 0.99 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 49 S 8.93 4.28 0.00 3.95 4.08 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 50 T 7.44 4.74 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 1.21 0.00 0.00 51 P 0.00 4.19 0.00 2.15 2.12 0.00 3.59 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.16 0.00 52 D 8.11 4.32 0.00 2.75 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 53 A 7.65 3.98 1.46 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 0.00 0.00 0.00 0.00 0.00 0.00 54 V 8.06 3.67 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 1.05 0.00 0.00 0.96 0.00 0.00 55 M 8.28 4.18 0.00 1.98 2.09 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.91 0.00 56 G 7.64 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 57 N 7.82 4.51 0.00 2.95 2.83 0.00 0.00 6.93 7.30 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 58 P 0.00 4.29 0.00 2.25 2.26 0.00 3.73 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.03 0.00 59 K 8.87 3.70 0.00 1.65 0.74 0.00 1.59 0.00 0.00 1.61 0.00 0.00 2.82 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.05 1.22 7.81 60 V 7.94 3.71 2.24 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 1.08 0.00 0.00 1.02 0.00 0.00 61 K 8.11 3.84 0.00 2.01 1.77 0.00 1.66 0.00 0.00 1.63 0.00 0.00 2.97 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.42 1.44 7.81 62 A 8.00 4.00 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 63 H 8.49 4.31 0.00 3.54 3.56 0.00 5.80 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 G 8.50 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.98 3.99 0.00 1.96 2.10 0.00 1.66 0.00 0.00 1.82 0.00 0.00 2.92 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.47 7.81 66 K 7.99 3.98 0.00 2.04 1.91 0.00 1.79 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.50 1.50 7.81 67 V 8.08 3.61 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 0.98 0.00 0.00 0.91 0.00 0.00 68 L 8.29 4.37 0.00 2.04 1.81 0.80 1.16 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 69 G 8.38 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 70 A 7.87 4.11 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 71 F 8.56 4.27 0.00 3.27 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 72 S 8.95 3.99 0.00 4.56 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 0.00 73 D 8.53 4.54 0.00 2.72 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 74 G 7.98 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.23 3.78 0.00 1.52 1.46 -0.40 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 76 A 7.49 4.15 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 77 H 7.97 4.88 0.00 3.06 3.11 0.00 5.82 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 L 7.76 4.01 0.00 1.53 1.63 0.76 0.93 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 79 D 7.90 4.68 0.00 2.73 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 80 N 7.94 5.00 0.00 2.74 2.64 0.00 0.00 7.15 6.40 0.00 0.00 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 7.84 4.03 0.00 1.75 1.81 0.85 0.76 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 82 K 8.14 4.03 0.00 1.75 1.82 0.00 1.58 0.00 0.00 1.64 0.00 0.00 2.52 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.37 1.46 7.81 83 G 7.67 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 0.00 0.00 0.00 84 T 7.69 3.81 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 0.52 0.00 0.00 85 F 7.81 4.76 0.00 3.17 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 86 A 7.59 4.07 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.87 3.85 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 1.22 0.00 0.00 88 L 8.01 4.08 0.00 2.02 1.85 1.14 0.92 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 89 S 8.37 4.32 0.00 4.05 4.12 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 0.00 0.00 0.00 90 E 8.14 3.89 0.00 2.18 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 2.33 2.58 0.00 91 L 8.17 3.95 0.00 1.76 1.86 0.91 1.05 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 92 H 8.47 4.26 0.00 3.70 3.70 0.00 5.86 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 C 7.64 3.57 0.00 1.23 2.48 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 94 D 8.36 4.33 0.00 2.66 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 95 K 7.71 4.30 0.00 1.83 1.78 0.00 1.74 0.00 0.00 1.68 0.00 0.00 2.97 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.31 1.34 7.81 96 L 7.68 4.13 0.00 1.71 1.60 0.67 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 97 H 7.14 4.01 0.00 3.57 3.43 0.00 5.64 0.00 0.00 0.00 0.00 8.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 7.88 3.99 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 0.23 0.00 0.00 0.47 0.00 0.00 99 D 8.93 4.32 0.00 2.78 2.61 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 3.10 0.00 1.93 1.85 0.00 3.38 0.00 0.00 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.54 0.00 101 E 8.33 3.90 0.00 2.03 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 2.32 2.41 0.00 102 N 8.09 4.28 0.00 2.50 2.74 0.00 0.00 6.90 8.46 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 F 7.34 4.46 0.00 3.11 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 0.00 104 R 7.93 4.03 0.00 1.99 1.97 0.00 3.12 0.00 0.00 3.34 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.75 0.00 105 L 7.88 3.82 0.00 1.73 1.34 0.81 -0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 106 L 8.37 4.09 0.00 1.79 1.90 0.93 1.14 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 0.00 107 G 8.26 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 0.00 0.00 0.00 108 K 8.11 4.05 0.00 2.04 1.96 0.00 1.69 0.00 0.00 1.54 0.00 0.00 3.04 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.52 1.48 7.81 109 V 7.95 3.68 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 1.02 0.00 0.00 1.16 0.00 0.00 110 L 8.39 3.88 0.00 1.74 1.77 0.90 0.36 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 0.00 111 V 7.94 3.55 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 1.29 0.00 0.00 1.18 0.00 0.00 112 C 8.00 4.08 0.00 3.20 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 0.00 113 V 7.87 3.51 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 1.03 0.00 0.00 0.90 0.00 0.00 114 L 7.95 3.89 0.00 1.05 1.11 0.67 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 115 A 7.30 3.70 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 0.00 116 H 8.09 4.12 0.00 3.15 3.43 0.00 5.78 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 H 8.29 3.91 0.00 3.04 2.81 0.00 5.97 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 F 8.44 4.71 0.00 3.29 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 0.00 119 G 8.77 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 0.00 120 K 8.86 4.29 0.00 1.92 2.01 0.00 1.61 0.00 0.00 1.66 0.00 0.00 3.00 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.45 1.48 7.81 121 E 8.07 4.08 0.00 2.16 2.25 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 2.33 2.29 0.00 122 F 8.28 4.54 0.00 2.99 3.12 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 0.00 0.00 0.00 123 T 7.30 4.20 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 1.28 0.00 0.00 124 P 0.00 4.16 0.00 2.15 2.14 0.00 3.57 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.19 0.00 125 P 0.00 4.19 0.00 2.11 2.07 0.00 3.48 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 2.08 2.11 0.00 126 V 7.41 3.58 1.88 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 0.93 0.00 0.00 0.88 0.00 0.00 127 Q 7.90 3.52 0.00 1.69 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.53 0.00 0.00 0.00 0.00 0.00 2.42 2.58 0.00 128 A 8.12 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 0.00 129 A 7.99 3.92 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 0.00 130 Y 8.33 3.88 0.00 3.43 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 0.00 131 Q 8.89 4.12 0.00 2.21 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.80 0.00 0.00 0.00 0.00 0.00 2.76 2.62 0.00 132 K 7.98 3.97 0.00 1.98 1.84 0.00 1.65 0.00 0.00 1.57 0.00 0.00 2.90 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.47 1.63 7.81 133 V 7.67 3.49 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 0.93 0.00 0.00 0.75 0.00 0.00 134 V 8.33 3.80 2.20 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 1.00 0.00 0.00 1.14 0.00 0.00 135 A 8.26 4.11 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 0.00 136 G 8.36 3.53 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 0.00 137 V 8.11 3.35 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 0.59 0.00 0.00 0.74 0.00 0.00 138 A 8.10 3.91 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 0.00 139 N 8.27 4.28 0.00 2.80 2.90 0.00 0.00 7.06 7.14 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 0.00 140 A 8.14 4.16 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 0.00 141 L 7.77 3.85 0.00 1.05 0.76 -0.12 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 142 A 7.68 4.42 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 0.00 143 H 7.83 4.27 0.00 3.32 3.54 0.00 5.76 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 K 8.01 4.46 0.00 1.85 1.83 0.00 1.75 0.00 0.00 1.68 0.00 0.00 3.11 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.48 1.58 7.81 145 Y 8.10 4.23 0.00 3.07 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 0.00 146 H 8.38 4.39 0.00 3.21 3.24 0.00 5.75 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00