NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3828 8.2893 118.1907 55.0137 32.8408 175.0069 2 T 4.1100 7.7092 110.0163 61.3954 70.6053 172.2233 3 R 4.6357 10.1129 122.5937 54.3957 33.7831 176.7985 4 R 4.7299 8.6846 123.6093 55.9091 32.0909 176.0287 5 V 4.6988 9.1144 122.6898 61.0461 34.4676 174.2223 6 A 4.8153 9.0883 131.1427 51.8043 19.9697 175.9220 7 I 5.0250 9.1409 122.9141 59.5106 40.5905 175.1100 8 G 4.5875 9.3588 113.3680 44.8502 0.0000 171.2849 9 T 5.8495 8.4373 110.8377 59.3731 72.4670 172.4555 10 D 4.9606 8.1373 120.9248 52.2861 42.0438 176.2787 11 H 4.2408 8.9391 112.6635 58.6699 29.1935 175.7583 12 P 4.2126 0.0000 0.0000 65.0583 31.4196 177.4781 13 A 4.2544 7.5825 120.2491 52.7400 19.1888 178.7728 14 F 4.1446 8.1142 118.3572 60.9171 39.6256 176.8833 15 A 3.8838 7.5260 122.2932 54.5027 18.3197 178.0465 16 I 4.3060 7.5550 107.5199 60.8067 38.1262 177.2755 17 H 4.0938 7.8684 120.4984 59.2173 28.1035 177.3598 18 E 3.5751 7.2890 120.7361 58.8256 29.1843 178.6074 19 N 3.6508 7.7195 116.0552 56.1589 38.6108 177.1272 20 L 3.8467 7.6039 119.9718 57.7439 41.7434 179.5584 21 I 3.6321 7.3963 119.5947 64.3662 37.0174 178.1336 22 L 3.8952 7.6393 120.8933 58.5276 41.6494 178.7049 23 Y 4.3626 7.6167 115.7406 60.8740 38.0462 178.2461 24 V 3.7061 7.8267 119.2783 66.0617 31.7225 178.2394 25 K 4.0968 7.9452 117.6715 59.6421 31.6739 179.2101 26 E 4.1019 8.4031 117.6179 59.0065 29.3963 178.9058 27 A 4.1777 7.7699 119.8162 52.1924 18.8385 177.1004 28 G 4.6267 7.0425 107.7163 44.5970 0.0000 173.7260 29 D 4.5116 8.3078 121.6724 56.6233 40.8712 177.7377 30 E 3.9818 8.0765 116.1792 57.4964 30.0882 175.6615 31 F 5.1773 7.9030 119.6061 56.1425 40.4792 175.4016 32 V 4.4839 8.9035 125.1559 60.2680 33.2543 172.9697 33 P 4.9512 0.0000 0.0000 62.8297 32.5078 176.2024 34 V 4.3297 9.1398 123.4066 61.1881 33.4322 173.4026 35 Y 4.7190 8.5881 130.2921 57.4023 39.7069 174.9212 36 C 4.7506 8.6526 122.8715 59.3631 30.3635 174.7696 37 G 3.6166 5.6961 108.2591 42.7210 0.0000 171.6222 38 P 4.5759 0.0000 0.0000 62.5000 32.0298 176.0035 39 K 4.5954 8.3347 116.2378 56.4508 33.1914 175.8430 40 T 3.9603 6.8025 107.0895 59.5102 71.8267 173.1970 41 A 4.2324 7.9026 121.7550 51.8019 18.9471 177.2156 42 E 3.9030 7.4430 117.9554 56.0197 30.1391 176.7276 43 S 3.6154 8.5753 119.6658 59.0678 62.5767 173.6131 44 V 4.5455 8.0010 119.0260 59.8765 35.7759 174.1309 45 D 4.8430 8.4752 120.2794 52.8459 41.7063 176.9596 46 Y 4.4079 8.8438 124.3424 60.2341 37.5055 176.9240 47 P 4.3933 0.0000 0.0000 65.2520 31.4029 178.2175 48 D 4.1899 7.9826 117.9375 57.3451 40.8147 178.7170 49 F 4.1654 8.1614 117.3417 59.8065 39.1706 177.6356 50 A 4.0699 8.6153 121.0967 55.2940 18.1598 179.4866 51 S 3.9975 8.3578 111.8743 61.5047 62.3143 176.1824 52 R 3.8120 7.6819 120.7471 59.5509 29.8283 178.6543 53 V 3.5911 7.7246 117.1733 65.9422 31.5576 177.7427 54 A 4.0366 8.4705 120.9378 55.3347 18.1500 179.4547 55 E 3.9580 8.5878 117.4340 59.8046 29.5281 179.5164 56 M 4.0624 7.8490 118.8970 58.2820 32.0168 179.0373 57 V 3.7238 7.9451 118.1233 66.0141 31.5508 177.9469 58 A 4.0219 8.1618 119.6109 55.1569 18.3661 179.1534 59 R 4.0957 8.2044 113.8441 56.0947 30.3003 177.1406 60 K 3.9915 7.7744 117.0307 57.3463 30.1238 176.9200 61 E 4.1289 8.2866 121.3186 58.6642 29.5185 177.6447 62 V 4.5938 7.3067 109.2806 59.2761 35.5454 174.9057 63 E 4.0511 8.6303 122.6791 58.3884 30.1031 176.5648 64 F 5.5125 8.2453 115.9812 55.6415 43.8798 174.2332 65 G 4.5789 9.5278 107.3474 44.5030 0.0000 171.8517 66 V 4.9192 9.1607 121.8265 60.7342 34.5944 174.2948 67 L 5.4347 9.1152 127.3148 52.8788 45.5316 175.3296 68 A 5.5977 9.2351 124.3114 49.4393 22.3699 174.8161 69 C 5.7184 7.6942 116.6790 55.8754 33.1080 173.9211 70 G 3.8204 8.9744 104.5941 49.5722 0.0000 175.6591 71 S 4.5991 8.2405 111.6724 56.7818 64.9799 174.9832 72 G 3.9717 8.1377 109.6124 46.0715 0.0000 175.7615 73 I 3.7146 7.7933 121.0390 64.3118 37.0401 178.2823 74 G 3.0059 7.6686 105.9728 47.9627 0.0000 175.2552 75 M 4.1762 7.7604 121.1213 58.1349 31.8444 178.9240 76 S 4.1262 8.0989 114.3335 61.3464 62.8873 176.6919 77 I 3.7519 7.7575 122.3526 64.1315 37.4026 177.8722 78 A 4.1823 8.3142 121.3919 55.2399 18.2706 179.5311 79 A 4.0033 8.3531 119.5402 55.4158 18.2979 179.4603 80 N 4.4914 7.7676 113.1232 55.5139 38.6525 177.2268 81 K 4.2203 7.7129 118.9202 57.0913 32.5542 176.8761 82 V 4.0420 7.3885 120.7409 60.6230 32.1139 173.5324 83 P 4.6479 0.0000 0.0000 64.1940 31.6791 176.6849 84 G 3.9567 9.6886 111.5790 45.1092 0.0000 173.7351 85 V 4.1550 7.2013 119.2344 62.0096 32.5215 175.7288 86 R 4.6836 9.6609 125.8416 54.3414 32.0294 173.0796 87 A 5.1599 9.6068 125.5910 50.2066 20.6653 175.8679 88 A 4.5984 9.0960 125.6587 49.9251 21.3552 175.4422 89 L 4.5821 8.6217 125.6530 55.5154 42.4921 175.7468 90 C 5.1131 8.7623 124.6562 58.2329 30.5739 173.9353 91 H 4.8590 8.6030 115.5157 54.5581 29.5594 172.7934 92 D 4.5138 7.3207 119.3587 51.8801 42.8845 175.2387 93 H 4.0433 8.7036 118.0564 59.5857 29.6016 176.2670 94 Y 3.9781 8.2113 120.9332 60.9044 38.6979 177.8665 95 T 3.7884 8.7647 110.9818 64.6224 68.6427 176.0123 96 A 4.0345 7.9048 123.4616 54.9064 18.3408 179.4636 97 A 3.7528 7.9572 119.1456 55.7215 18.4528 179.9009 98 M 3.7632 7.9856 117.7060 58.1328 31.7948 178.9898 99 S 4.2060 8.3190 114.9525 61.3711 62.9182 176.9567 100 R 3.8678 7.4617 120.8227 58.8641 30.2603 178.7663 101 I 3.8755 7.8454 119.6485 64.5436 36.8962 177.8692 102 H 4.2596 8.4045 115.1574 57.5698 29.2789 176.0578 103 N 4.5943 8.1396 112.7364 52.4881 39.3310 174.0709 104 D 4.1559 7.9946 116.8402 54.4897 39.6199 173.5589 105 A 4.2882 8.0750 121.0092 52.6768 19.2858 177.7018 106 N 5.3012 9.0897 118.0506 52.9175 39.7144 174.3873 107 I 5.3006 7.9784 120.9167 59.5219 41.3875 174.2702 108 V 4.2472 8.0755 126.2509 59.9444 33.5441 174.4384 109 C 5.3503 8.8863 122.3157 58.0891 31.2994 173.4067 110 V 4.7227 8.7580 115.0362 59.6097 36.4555 174.4246 111 G 4.3779 8.2957 109.1527 43.7226 0.0000 174.3732 112 E 4.0562 9.2677 127.9546 58.9160 29.8862 177.9152 113 R 4.2597 8.1525 116.8226 57.2252 30.7162 177.0244 114 T 4.3697 7.7659 107.4746 62.0696 70.5260 174.3036 115 T 4.5853 7.8567 118.5658 60.8126 70.7737 175.0023 116 G 3.8075 8.4598 112.8074 44.6632 0.0000 174.7885 117 V 3.7295 8.3085 115.0460 64.2899 31.6121 178.8409 118 E 3.8870 8.0592 117.9089 58.9237 29.3497 179.2572 119 V 3.5599 7.6321 118.1773 65.7687 31.6067 177.8400 120 I 3.6458 7.8430 119.7402 64.2831 36.9130 178.1610 121 R 2.9729 7.8167 119.7380 59.2020 29.6439 178.1183 122 E 3.8254 7.8347 118.8760 59.1798 29.5026 178.7721 123 I 3.6420 8.0629 120.1868 64.4431 37.2108 178.4582 124 I 3.6235 7.8596 120.6528 64.4068 36.9531 178.5511 125 I 3.5601 7.7410 120.5498 64.6908 36.9415 178.6485 126 T 3.7897 8.0295 116.6226 66.4744 68.0449 176.3553 127 F 3.9162 8.1841 121.6101 61.4415 39.4767 176.9241 128 L 3.3037 7.5705 117.0201 57.4744 41.3303 179.1173 129 Q 4.3253 7.8327 116.7809 57.0464 28.9409 176.4330 130 T 4.2150 7.1621 117.6963 61.9019 69.0814 173.0065 131 P 4.6294 0.0000 0.0000 61.6644 32.6069 175.6830 132 F 5.0799 8.8091 121.5449 57.5374 39.9392 175.7320 133 S 3.8994 8.0269 122.3361 59.4041 62.9284 175.7280 134 G 3.4490 5.3800 106.4728 45.6201 0.0000 173.8531 135 E 4.0359 7.2863 119.6937 55.4357 31.3195 177.0051 136 E 3.8992 8.8055 123.8230 59.8293 29.6331 179.7699 137 R 3.9130 7.8403 115.1877 59.6022 29.4339 178.3750 138 H 4.3482 7.9036 116.4147 58.5746 28.8452 177.5941 139 V 3.7488 7.9856 120.1469 66.1016 31.3743 177.9488 140 R 3.8996 8.1710 118.2900 59.6496 29.9306 178.7209 141 R 3.9740 8.1388 117.7346 59.3100 30.0500 179.0858 142 I 3.6931 8.2451 120.0896 64.4029 37.0101 178.0838 143 E 3.9672 8.4275 120.1718 59.2274 29.4370 179.0540 144 K 3.9908 8.1610 118.6207 59.2663 32.0494 179.3686 145 I 3.7039 7.7967 120.2785 64.4103 36.9769 178.3063 146 R 4.1571 8.2446 120.6005 58.8403 29.8243 178.3383 147 A 3.9932 8.2094 120.7011 55.1393 18.1273 179.5820 148 I 3.6710 7.6026 117.3246 64.5898 37.0440 178.0730 149 E 4.1370 8.2525 119.0424 59.4915 29.1189 179.2663 150 A 4.0701 8.0999 119.8738 55.2217 18.5652 179.6045 151 S 4.1657 8.1743 111.0712 60.6672 63.0158 174.1625 152 H 4.5052 7.8486 124.3970 55.8868 28.8332 173.8322 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 8.29 4.38 0.00 2.12 2.20 0.00 0.00 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.52 0.00 2 T 7.71 4.11 4.38 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 1.18 0.00 0.00 3 R 10.11 4.64 0.00 1.71 2.21 0.00 2.95 0.00 0.00 2.69 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.40 0.00 4 R 8.68 4.73 0.00 1.83 1.91 0.00 3.09 0.00 0.00 3.52 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.66 0.00 5 V 9.11 4.70 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 1.26 0.00 0.00 6 A 9.09 4.82 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 7 I 9.14 5.03 2.13 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.91 1.09 0.00 0.00 8 G 9.36 4.59 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 9 T 8.44 5.85 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 1.32 0.00 0.00 10 D 8.14 4.96 0.00 2.97 3.02 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 0.00 0.00 0.00 0.00 11 H 8.94 4.24 0.00 3.52 3.75 0.00 5.46 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 P 0.00 4.21 0.00 2.35 2.31 0.00 3.63 0.00 0.00 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 1.85 0.00 13 A 7.58 4.25 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 14 F 8.11 4.14 0.00 3.18 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 15 A 7.53 3.88 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 16 I 7.55 4.31 1.82 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 1.44 0.82 0.88 0.00 0.00 17 H 7.87 4.09 0.00 3.30 3.53 0.00 5.46 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 E 7.29 3.58 0.00 1.69 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 2.01 1.71 0.00 19 N 7.72 3.65 0.00 2.63 2.18 0.00 0.00 7.15 6.74 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 20 L 7.60 3.85 0.00 1.79 1.71 0.96 0.74 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 I 7.40 3.63 1.84 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.00 0.87 0.00 0.00 22 L 7.64 3.90 0.00 1.58 1.55 0.92 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 23 Y 7.62 4.36 0.00 2.92 2.85 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 24 V 7.83 3.71 2.28 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 1.13 0.00 0.00 1.03 0.00 0.00 25 K 7.95 4.10 0.00 2.06 1.89 0.00 1.72 0.00 0.00 1.66 0.00 0.00 2.97 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.51 1.65 7.81 26 E 8.40 4.10 0.00 2.19 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 0.00 2.40 2.59 0.00 27 A 7.77 4.18 0.94 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 0.00 0.00 28 G 7.04 4.63 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 29 D 8.31 4.51 0.00 2.69 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 30 E 8.08 3.98 0.00 1.84 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 1.47 1.67 0.00 31 F 7.90 5.18 0.00 3.29 3.10 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 0.00 32 V 8.90 4.48 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 1.13 0.00 0.00 0.97 0.00 0.00 33 P 0.00 4.95 0.00 2.19 2.11 0.00 3.83 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.01 0.00 34 V 9.14 4.33 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 0.98 0.00 0.00 1.00 0.00 0.00 35 Y 8.59 4.72 0.00 3.16 2.92 0.00 0.00 0.00 0.00 0.00 0.00 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 C 8.65 4.75 0.00 2.83 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 37 G 5.70 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 38 P 0.00 4.58 0.00 2.05 1.67 0.00 3.55 0.00 0.00 2.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.50 0.00 39 K 8.33 4.60 0.00 1.75 1.92 0.00 1.74 0.00 0.00 1.82 0.00 0.00 3.13 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.50 1.49 7.81 40 T 6.80 3.96 4.02 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 0.00 0.00 0.00 1.10 0.00 0.00 41 A 7.90 4.23 1.38 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 0.00 0.00 42 E 7.44 3.90 0.00 1.87 1.78 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 2.28 2.21 0.00 43 S 8.58 3.62 0.00 3.71 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 44 V 8.00 4.55 2.40 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 0.92 0.00 0.00 0.99 0.00 0.00 45 D 8.48 4.84 0.00 2.84 2.43 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 46 Y 8.84 4.41 0.00 3.31 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 47 P 0.00 4.39 0.00 1.98 2.01 0.00 3.14 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.38 0.00 48 D 7.98 4.19 0.00 2.62 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 0.00 0.00 0.00 49 F 8.16 4.17 0.00 3.13 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 50 A 8.62 4.07 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 51 S 8.36 4.00 0.00 3.88 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 52 R 7.68 3.81 0.00 1.80 2.03 0.00 3.04 0.00 0.00 3.24 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.61 0.00 53 V 7.72 3.59 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 1.05 0.00 0.00 0.97 0.00 0.00 54 A 8.47 4.04 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 55 E 8.59 3.96 0.00 1.98 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 2.54 2.48 0.00 56 M 7.85 4.06 0.00 2.03 2.29 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 2.78 2.75 0.00 57 V 7.95 3.72 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 1.07 0.00 0.00 1.02 0.00 0.00 58 A 8.16 4.02 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 59 R 8.20 4.10 0.00 1.83 1.98 0.00 3.29 0.00 0.00 3.22 7.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.73 0.00 60 K 7.77 3.99 0.00 1.91 1.89 0.00 1.69 0.00 0.00 1.68 0.00 0.00 2.95 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.33 1.53 7.81 61 E 8.29 4.13 0.00 2.11 2.02 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 0.00 2.35 2.28 0.00 62 V 7.31 4.59 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 0.76 0.00 0.00 0.97 0.00 0.00 63 E 8.63 4.05 0.00 1.88 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 1.47 1.83 0.00 64 F 8.25 5.51 0.00 3.14 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 65 G 9.53 4.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 V 9.16 4.92 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 1.04 0.00 0.00 0.89 0.00 0.00 67 L 9.12 5.43 0.00 1.55 1.52 0.96 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 68 A 9.24 5.60 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 69 C 7.69 5.72 0.00 3.05 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 70 G 8.97 3.82 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 0.00 0.00 0.00 71 S 8.24 4.60 0.00 3.89 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 72 G 8.14 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 73 I 7.79 3.71 1.77 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 1.42 0.63 0.87 0.00 0.00 74 G 7.67 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 0.00 0.00 0.00 75 M 7.76 4.18 0.00 2.06 2.10 0.00 0.00 0.00 0.00 0.00 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.52 0.00 76 S 8.10 4.13 0.00 4.06 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 77 I 7.76 3.75 1.94 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 1.47 0.68 0.96 0.00 0.00 78 A 8.31 4.18 1.49 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 0.00 0.00 0.00 79 A 8.35 4.00 1.38 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 0.00 0.00 80 N 7.77 4.49 0.00 2.83 2.91 0.00 0.00 7.11 7.42 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 81 K 7.71 4.22 0.00 1.93 1.87 0.00 1.71 0.00 0.00 1.64 0.00 0.00 2.99 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.73 1.60 7.81 82 V 7.39 4.04 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 0.97 0.00 0.00 0.98 0.00 0.00 83 P 0.00 4.65 0.00 2.08 1.97 0.00 3.72 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.09 0.00 84 G 9.69 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 0.00 0.00 0.00 85 V 7.20 4.16 2.37 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 0.89 0.00 0.00 0.95 0.00 0.00 86 R 9.66 4.68 0.00 1.73 1.84 0.00 3.22 0.00 0.00 3.12 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.53 0.00 87 A 9.61 5.16 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 0.00 0.00 88 A 9.10 4.60 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 89 L 8.62 4.58 0.00 1.64 1.61 0.98 0.92 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 90 C 8.76 5.11 0.00 2.80 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 91 H 8.60 4.86 0.00 3.25 3.34 0.00 5.60 0.00 0.00 0.00 0.00 6.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 D 7.32 4.51 0.00 2.85 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 93 H 8.70 4.04 0.00 3.45 3.37 0.00 5.67 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 Y 8.21 3.98 0.00 3.14 3.10 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 0.00 95 T 8.76 3.79 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 1.29 0.00 0.00 96 A 7.90 4.03 1.47 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 97 A 7.96 3.75 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 98 M 7.99 3.76 0.00 1.70 1.73 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.48 0.00 99 S 8.32 4.21 0.00 4.18 4.35 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 0.00 100 R 7.46 3.87 0.00 1.98 1.99 0.00 2.76 0.00 0.00 2.25 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.49 0.00 101 I 7.85 3.88 1.77 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 1.49 1.20 0.92 0.00 0.00 102 H 8.40 4.26 0.00 3.20 3.29 0.00 5.66 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 N 8.14 4.59 0.00 2.92 2.85 0.00 0.00 7.06 8.06 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 0.00 104 D 7.99 4.16 0.00 1.58 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 0.00 0.00 0.00 105 A 8.08 4.29 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 0.00 0.00 0.00 0.00 0.00 0.00 106 N 9.09 5.30 0.00 3.03 3.03 0.00 0.00 6.60 7.15 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 0.00 107 I 7.98 5.30 1.92 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.76 0.95 0.00 0.00 108 V 8.08 4.25 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 0.41 0.00 0.00 0.52 0.00 0.00 109 C 8.89 5.35 0.00 2.78 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 0.00 110 V 8.76 4.72 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 0.82 0.00 0.00 0.97 0.00 0.00 111 G 8.30 4.38 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 0.00 0.00 0.00 112 E 9.27 4.06 0.00 1.90 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 2.42 0.00 113 R 8.15 4.26 0.00 1.97 1.95 0.00 3.15 0.00 0.00 3.26 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.54 0.00 114 T 7.77 4.37 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 1.19 0.00 0.00 115 T 7.86 4.59 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 1.20 0.00 0.00 116 G 8.46 3.81 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 0.00 0.00 0.00 117 V 8.31 3.73 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 0.87 0.00 0.00 0.98 0.00 0.00 118 E 8.06 3.89 0.00 1.92 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 2.37 2.27 0.00 119 V 7.63 3.56 2.17 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 1.10 0.00 0.00 0.90 0.00 0.00 120 I 7.84 3.65 2.07 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 1.40 0.70 1.01 0.00 0.00 121 R 7.82 2.97 0.00 0.67 1.54 0.00 2.74 0.00 0.00 2.92 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.80 0.00 122 E 7.83 3.83 0.00 2.10 2.02 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 0.00 2.33 2.34 0.00 123 I 8.06 3.64 1.97 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.58 0.83 0.00 0.00 124 I 7.86 3.62 1.88 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.75 0.89 0.00 0.00 125 I 7.74 3.56 1.80 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.64 0.87 0.00 0.00 126 T 8.03 3.79 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 1.05 0.00 0.00 127 F 8.18 3.92 0.00 2.95 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 0.00 128 L 7.57 3.30 0.00 0.97 0.13 0.49 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 129 Q 7.83 4.33 0.00 2.04 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.80 0.00 0.00 0.00 0.00 0.00 2.47 2.45 0.00 130 T 7.16 4.21 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 1.18 0.00 0.00 131 P 0.00 4.63 0.00 2.20 2.08 0.00 3.75 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.96 0.00 132 F 8.81 5.08 0.00 3.04 3.04 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 0.00 133 S 8.03 3.90 0.00 4.07 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 0.00 134 G 5.38 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 0.00 0.00 0.00 135 E 7.29 4.04 0.00 1.89 1.75 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 2.25 2.19 0.00 136 E 8.81 3.90 0.00 2.00 1.94 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 2.38 2.40 0.00 137 R 7.84 3.91 0.00 2.03 2.12 0.00 2.96 0.00 0.00 3.25 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.48 0.00 138 H 7.90 4.35 0.00 3.54 3.87 0.00 5.65 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 V 7.99 3.75 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 1.06 0.00 0.00 1.24 0.00 0.00 140 R 8.17 3.90 0.00 1.94 2.10 0.00 3.16 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.69 0.00 141 R 8.14 3.97 0.00 2.10 2.00 0.00 3.35 0.00 0.00 3.22 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.76 0.00 142 I 8.25 3.69 1.98 0.00 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.68 0.83 0.00 0.00 143 E 8.43 3.97 0.00 2.16 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 0.00 2.32 2.41 0.00 144 K 8.16 3.99 0.00 2.05 1.86 0.00 1.74 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.47 1.64 7.81 145 I 7.80 3.70 2.05 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 1.42 0.94 0.92 0.00 0.00 146 R 8.24 4.16 0.00 1.89 2.16 0.00 3.35 0.00 0.00 3.26 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.51 0.00 147 A 8.21 3.99 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 0.00 148 I 7.60 3.67 2.07 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 1.55 0.77 0.97 0.00 0.00 149 E 8.25 4.14 0.00 2.26 2.02 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 0.00 2.34 2.49 0.00 150 A 8.10 4.07 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 0.00 151 S 8.17 4.17 0.00 3.94 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 0.00 152 H 7.85 4.51 0.00 3.18 3.21 0.00 5.69 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