NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3200 8.3044 118.1909 55.2034 32.4905 174.6714 2 H 4.2855 8.6829 121.1456 54.9313 29.8899 172.9247 3 L 4.7783 7.7756 126.9534 52.4746 45.5727 176.9003 4 T 4.1016 8.2923 112.6103 60.9904 70.8258 173.9736 5 P 4.2158 0.0000 0.0000 65.6560 31.3756 178.9320 6 E 3.9542 8.0405 117.0323 59.5565 29.4932 179.0958 7 E 3.9630 8.1072 118.5323 58.9487 29.4343 179.1318 8 K 3.7385 8.0792 119.8379 59.7644 32.2391 178.8153 9 S 4.0840 8.1898 112.9754 61.1355 62.2572 176.0326 10 A 3.9704 7.8872 123.3821 55.0245 18.1665 179.7960 11 V 3.3315 7.6375 116.6544 66.4408 31.4042 178.1679 12 T 3.9281 7.6024 113.7901 66.7188 68.2270 176.0334 13 A 4.1726 8.2530 122.5737 55.2071 18.4544 179.5080 14 L 3.8260 7.9174 118.4842 57.9415 42.2883 178.9050 15 W 4.2378 8.7609 128.2424 59.8912 30.4223 177.7606 16 G 3.8218 7.8237 103.1927 46.4440 0.0000 174.6914 17 K 4.4458 7.7140 118.8509 55.3258 32.9993 176.4856 18 V 3.5239 6.7523 120.3899 62.0926 32.0517 175.7646 19 N 4.4673 8.2150 125.6159 52.1587 38.8617 175.2212 20 V 3.4188 8.0972 127.9379 66.4279 31.6433 176.7822 21 D 4.2850 8.1260 117.5855 57.4977 40.5972 178.1453 22 E 3.8294 8.4295 119.0993 59.5863 29.6620 179.3506 23 V 3.5623 7.7855 118.1432 65.8462 31.5151 178.1264 24 G 3.5970 8.1156 105.5829 47.8517 0.0000 175.9655 25 G 3.6919 8.0934 108.2564 47.1721 0.0000 175.4957 26 E 3.9049 8.4579 121.5468 59.0881 29.7155 178.8333 27 A 4.0218 8.3842 121.0717 55.1623 18.5547 179.3567 28 L 3.8990 8.2688 119.0910 58.0820 42.2060 179.4081 29 G 3.5586 8.3394 105.8197 48.0501 0.0000 175.9933 30 R 3.9284 8.1687 120.9629 58.3560 29.9110 178.9631 31 L 3.9547 7.7885 120.3840 58.3400 41.6604 179.1681 32 L 3.9062 7.7769 118.6294 57.3162 41.1948 179.7168 33 V 3.5993 7.2193 117.4396 65.6717 31.7669 177.9846 34 V 3.5429 7.7550 117.0134 64.2019 32.8010 175.5475 35 Y 3.8465 7.2799 116.2815 53.8032 37.8610 173.7273 36 P 4.4117 0.0000 0.0000 64.4546 31.6814 177.5266 37 W 4.3103 7.9970 114.4832 58.8950 27.5556 177.6293 38 T 4.1527 7.5250 110.4808 63.6314 68.3429 176.0482 39 Q 4.3259 8.2331 121.7529 57.9107 28.4848 178.0161 40 R 3.7335 7.3633 117.1247 58.4999 29.2722 177.7398 41 F 4.5105 6.9330 115.0964 57.0822 39.6033 175.6136 42 F 4.6365 7.8349 118.5973 56.7845 40.2051 177.1503 43 E 4.0468 8.4107 122.8362 59.4533 29.4451 178.9982 44 S 4.5278 8.0659 110.4987 59.1865 63.4899 174.6512 45 F 4.5539 8.3805 119.8492 58.6114 40.0435 176.1846 46 G 4.0267 7.4802 105.6480 44.3388 0.0000 175.2501 47 D 4.5654 8.5873 126.7345 53.9162 41.0770 175.4453 48 L 4.9076 8.3518 125.3570 54.3781 43.5150 177.7903 49 S 4.2650 8.1893 115.6440 60.6586 63.2172 174.8832 50 T 4.7151 7.4437 109.6236 58.2564 72.8924 172.8656 51 P 4.2017 0.0000 0.0000 65.9530 31.3711 178.6623 52 D 4.3304 8.0887 116.8126 57.3839 40.5737 178.5809 53 A 4.0027 7.7293 120.0201 55.0662 18.5241 179.6647 54 V 3.6933 8.2045 117.0949 66.5591 31.4939 178.3521 55 M 4.2422 8.5783 117.3811 57.3275 31.7543 177.9499 56 G 4.0957 7.6429 103.8050 43.4089 0.0000 173.1807 57 N 4.6229 7.5339 121.1844 51.9332 40.0202 173.8673 58 P 4.2442 0.0000 0.0000 66.1473 31.3154 178.7036 59 K 3.6423 8.2622 118.1671 58.8546 31.7041 179.5277 60 V 3.7998 7.8734 118.1770 65.9484 31.5999 178.1459 61 K 3.9817 7.9959 117.5948 59.2512 31.7605 179.1314 62 A 3.9758 8.1018 121.1272 55.6540 18.3908 179.2431 63 H 4.3818 8.5622 116.8193 59.1164 29.8075 177.4469 64 G 4.0297 8.3858 107.9788 48.1859 0.0000 175.8331 65 K 3.9679 7.9456 120.7543 58.5818 31.8738 179.3969 66 K 3.9764 7.7703 120.5522 59.1991 32.1638 178.9568 67 W 4.2837 8.3719 116.9509 59.6760 28.2572 178.0665 68 L 3.1529 6.2841 121.1170 56.9921 41.2823 179.1979 69 G 3.6261 7.9165 105.6879 47.7057 0.0000 175.6220 70 A 4.1448 7.7493 122.0235 54.7605 18.7878 179.0860 71 F 4.3200 8.6533 119.6354 61.4788 39.4277 177.2704 72 S 3.8596 8.6461 112.9829 61.6393 62.2067 175.9978 73 D 4.5395 8.3235 121.2569 56.9198 40.3571 179.0022 74 G 3.5444 7.7896 106.2613 47.4812 0.0000 175.6274 75 L 3.7665 7.2574 119.6214 56.4649 41.6022 178.2928 76 A 4.2816 7.2493 119.0186 52.5584 19.5253 176.5913 77 H 4.8649 8.2538 115.5773 54.7374 29.7957 175.5213 78 L 3.9341 7.9973 119.9578 57.5822 41.8241 178.7636 79 D 4.5175 7.9070 116.7974 56.2089 41.6676 176.5632 80 N 5.0170 8.0395 117.7702 51.4947 40.1742 174.4332 81 L 4.0759 7.9986 122.9266 57.2156 41.9790 178.6380 82 K 4.0393 8.1331 118.1431 59.6489 31.8572 179.2849 83 G 3.6478 8.1418 103.8411 48.2939 0.0000 175.2589 84 T 3.8013 7.6340 116.9425 65.3887 68.5445 175.8563 85 F 4.7882 7.9680 117.0984 56.9576 39.3086 177.1564 86 A 4.0788 7.6244 122.8629 55.8874 18.1529 180.5112 87 T 3.8361 7.8817 113.2208 66.9529 68.6019 176.8165 88 L 4.1649 8.0353 120.2876 57.6665 41.6354 179.4335 89 S 4.2970 8.6009 113.6879 61.5553 62.3221 176.0253 90 E 3.9337 8.2622 121.3064 59.1750 29.1561 179.1501 91 L 3.9026 8.0380 120.2474 58.6972 42.2002 178.9087 92 H 4.1943 8.5613 116.0145 58.7554 28.6713 176.9829 93 C 3.6288 7.6218 120.4406 62.0419 31.1740 175.3318 94 D 4.4167 8.2171 120.6391 56.4744 40.5624 177.5135 95 K 4.2693 7.7417 116.7077 57.2921 33.7257 177.2397 96 L 4.1524 7.7016 117.1110 54.7928 42.2769 176.1853 97 H 4.1453 7.1872 113.1215 56.6207 26.5720 175.1552 98 V 3.5646 7.9847 119.2044 61.2378 32.1112 174.8246 99 D 4.3647 8.8562 127.2422 53.8642 41.5853 174.9472 100 P 3.4248 0.0000 0.0000 65.3149 31.7511 177.9431 101 E 3.8769 8.3171 118.6774 59.4045 29.2878 178.5957 102 N 4.2498 8.0741 116.5741 56.2019 38.5062 177.2880 103 F 4.3795 7.3725 119.2222 60.5786 38.9319 177.9534 104 R 3.9953 7.9078 117.3371 59.1556 29.9957 178.8584 105 L 3.8223 7.6297 118.4758 57.6784 41.4712 179.3868 106 L 4.0085 8.0855 120.4449 57.8202 42.0599 179.2303 107 G 3.6500 8.0859 105.9121 47.9380 0.0000 175.5257 108 N 4.4983 8.2891 119.0667 55.9344 38.5144 177.7938 109 V 3.6512 7.9868 119.8413 65.7717 31.5792 177.6931 110 L 4.0018 8.3123 120.5415 58.3502 41.8939 179.2096 111 V 3.6565 7.7529 117.6938 66.2374 31.4302 177.8134 112 C 4.1600 8.1073 116.6011 62.6365 27.8444 176.2876 113 V 3.5284 7.9546 119.9451 65.9622 31.1185 178.0671 114 L 3.7731 7.8477 118.5589 57.6457 41.3248 179.4604 115 A 3.6342 7.2421 120.6147 55.2073 18.0832 179.1751 116 H 4.1101 8.0055 115.8970 59.5582 29.9676 176.7639 117 H 3.8433 8.1303 119.5402 58.6646 29.9151 176.5441 118 F 4.6571 8.4520 118.2913 56.8378 39.6588 177.1667 119 G 3.8825 8.8444 108.5990 46.0078 0.0000 177.3225 120 K 3.9997 8.8958 122.2193 59.2758 32.4135 177.8553 121 E 4.0961 7.9623 119.9180 58.2342 30.0105 176.9948 122 F 4.6386 8.0499 123.3084 57.0926 37.8190 175.3127 123 T 4.1953 7.4022 115.7604 60.2471 71.2801 173.4848 124 P 4.1684 0.0000 0.0000 65.5641 31.4336 177.2519 125 P 4.2229 0.0000 0.0000 65.3909 31.2641 178.8903 126 V 3.5788 7.3564 115.9590 65.7696 31.3546 177.8962 127 Q 3.4928 7.8929 119.3178 59.0177 29.0112 177.9083 128 A 4.0187 8.0986 121.6105 55.2966 18.4420 179.5070 129 A 3.9288 7.8909 118.5934 55.6235 18.4108 179.5682 130 Y 3.9956 8.1683 115.2169 61.1381 38.0598 178.5479 131 Q 4.1486 8.7858 119.7140 58.7411 28.7081 178.9250 132 K 4.0072 8.0162 119.2190 59.3321 32.0448 179.3887 133 V 3.5376 7.6613 118.1839 66.3328 31.4256 178.4714 134 V 3.8745 8.2857 111.9242 64.4870 31.3991 178.5491 135 A 4.1318 8.1587 120.3485 54.9931 18.2238 179.9482 136 G 3.5536 8.2676 104.5133 47.9073 0.0000 176.2135 137 V 3.4833 8.2770 120.9137 65.5728 31.4185 178.0024 138 A 3.8730 8.2408 120.7713 55.2684 18.0817 179.4283 139 N 4.3219 8.3509 114.8039 56.2740 38.3804 177.5876 140 A 4.0436 7.8343 121.5290 55.1029 18.5485 179.4022 141 L 3.9446 7.7961 116.2775 56.8112 41.9564 178.4448 142 A 4.3725 7.5709 119.5153 52.5080 19.0457 178.1943 143 H 4.0913 7.8592 117.2555 58.9378 29.9489 175.9389 144 K 4.5416 8.1313 115.9639 56.2847 32.0032 176.0703 145 Y 4.1790 8.0575 117.7449 58.1682 38.4283 175.6333 146 H 4.5191 8.3176 118.0807 55.9529 28.7131 173.0808 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 4.32 0.00 2.13 2.13 0.00 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.63 0.00 2 H 8.68 4.29 0.00 3.22 3.24 0.00 5.67 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 L 7.78 4.78 0.00 1.53 1.44 0.81 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 4 T 8.29 4.10 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 1.23 0.00 0.00 5 P 0.00 4.22 0.00 2.15 2.12 0.00 3.58 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 2.09 2.14 0.00 6 E 8.04 3.95 0.00 2.03 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 2.39 2.45 0.00 7 E 8.11 3.96 0.00 2.09 1.93 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 2.30 2.28 0.00 8 K 8.08 3.74 0.00 1.98 1.91 0.00 1.44 0.00 0.00 1.48 0.00 0.00 2.90 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.38 1.43 7.81 9 S 8.19 4.08 0.00 3.92 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 7.89 3.97 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 11 V 7.64 3.33 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 0.48 0.00 0.00 0.51 0.00 0.00 12 T 7.60 3.93 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 1.24 0.00 0.00 13 A 8.25 4.17 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 14 L 7.92 3.83 0.00 1.84 1.98 -0.07 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 15 W 8.76 4.24 0.00 3.87 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 7.82 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 17 K 7.71 4.45 0.00 1.92 2.04 0.00 1.66 0.00 0.00 1.43 0.00 0.00 3.13 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.43 1.61 7.81 18 V 6.75 3.52 1.06 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 0.01 0.00 0.00 0.53 0.00 0.00 19 N 8.21 4.47 0.00 2.68 2.56 0.00 0.00 6.82 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 8.10 3.42 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 0.99 0.00 0.00 0.94 0.00 0.00 21 D 8.13 4.28 0.00 2.85 2.65 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 22 E 8.43 3.83 0.00 1.98 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 2.18 2.26 0.00 23 V 7.79 3.56 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 0.94 0.00 0.00 0.64 0.00 0.00 24 G 8.12 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 G 8.09 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 0.00 0.00 0.00 26 E 8.46 3.90 0.00 2.18 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.37 0.00 27 A 8.38 4.02 1.61 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 0.00 0.00 28 L 8.27 3.90 0.00 2.05 1.78 0.59 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 29 G 8.34 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 8.17 3.93 0.00 1.85 1.94 0.00 3.12 0.00 0.00 3.05 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.70 0.00 31 L 7.79 3.95 0.00 1.80 1.82 0.92 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 32 L 7.78 3.91 0.00 1.83 1.66 0.74 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 33 V 7.22 3.60 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 0.71 0.00 0.00 0.94 0.00 0.00 34 V 7.75 3.54 1.45 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 0.14 0.00 0.00 0.73 0.00 0.00 35 Y 7.28 3.85 0.00 2.54 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 4.41 0.00 2.23 2.13 0.00 3.80 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.09 0.00 37 W 8.00 4.31 0.00 3.50 3.47 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 38 T 7.52 4.15 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 1.03 0.00 0.00 39 Q 8.23 4.33 0.00 2.25 2.21 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 2.40 0.00 40 R 7.36 3.73 0.00 1.57 1.91 0.00 2.95 0.00 0.00 2.58 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.54 0.50 0.00 41 F 6.93 4.51 0.00 1.86 2.26 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 42 F 7.83 4.64 0.00 2.75 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 0.00 0.00 0.00 43 E 8.41 4.05 0.00 2.00 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 2.35 2.22 0.00 44 S 8.07 4.53 0.00 4.13 4.09 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 45 F 8.38 4.55 0.00 3.21 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 46 G 7.48 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 47 D 8.59 4.57 0.00 2.66 2.63 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 48 L 8.35 4.91 0.00 1.64 1.60 1.04 1.04 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 49 S 8.19 4.27 0.00 4.03 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 50 T 7.44 4.72 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 4.20 0.00 2.15 2.11 0.00 3.58 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 2.08 2.15 0.00 52 D 8.09 4.33 0.00 2.67 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 7.73 4.00 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 54 V 8.20 3.69 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 0.99 0.00 0.00 55 M 8.58 4.24 0.00 1.96 2.10 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.92 0.00 56 G 7.64 4.10 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 0.00 0.00 0.00 57 N 7.53 4.62 0.00 2.96 2.85 0.00 0.00 6.95 7.56 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 58 P 0.00 4.24 0.00 2.25 2.27 0.00 3.73 0.00 0.00 3.83 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 8.26 3.64 0.00 1.49 0.74 0.00 1.47 0.00 0.00 0.96 0.00 0.00 2.79 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.11 1.21 7.81 60 V 7.87 3.80 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 1.17 0.00 0.00 1.10 0.00 0.00 61 K 8.00 3.98 0.00 2.00 1.84 0.00 1.71 0.00 0.00 1.64 0.00 0.00 3.02 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.46 1.65 7.81 62 A 8.10 3.98 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 H 8.56 4.38 0.00 3.62 3.59 0.00 5.81 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 8.39 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 65 K 7.95 3.97 0.00 1.83 1.90 0.00 1.67 0.00 0.00 1.68 0.00 0.00 2.90 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.59 1.68 7.81 66 K 7.77 3.98 0.00 1.88 2.08 0.00 1.88 0.00 0.00 1.85 0.00 0.00 3.10 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.57 1.54 7.81 67 W 8.37 4.28 0.00 3.78 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 68 L 6.28 3.15 0.00 0.39 1.21 0.23 1.39 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 69 G 7.92 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 70 A 7.75 4.14 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 71 F 8.65 4.32 0.00 3.20 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 72 S 8.65 3.86 0.00 4.39 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 73 D 8.32 4.54 0.00 2.71 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 74 G 7.79 3.54 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 0.00 75 L 7.26 3.77 0.00 1.38 1.39 -0.53 0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 76 A 7.25 4.28 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 77 H 8.25 4.86 0.00 3.03 3.14 0.00 5.83 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 L 8.00 3.93 0.00 1.54 1.66 0.79 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 79 D 7.91 4.52 0.00 2.63 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 80 N 8.04 5.02 0.00 2.71 2.59 0.00 0.00 7.04 6.99 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 81 L 8.00 4.08 0.00 1.77 1.85 0.92 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 82 K 8.13 4.04 0.00 1.75 1.78 0.00 1.28 0.00 0.00 1.39 0.00 0.00 2.85 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.48 1.45 7.81 83 G 8.14 3.65 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 84 T 7.63 3.80 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 0.41 0.00 0.00 85 F 7.97 4.79 0.00 3.15 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 86 A 7.62 4.08 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 87 T 7.88 3.84 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 88 L 8.04 4.16 0.00 2.03 1.89 1.22 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 89 S 8.60 4.30 0.00 4.02 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 0.00 90 E 8.26 3.93 0.00 2.25 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 2.34 2.54 0.00 91 L 8.04 3.90 0.00 1.89 1.92 0.92 0.87 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 92 H 8.56 4.19 0.00 3.55 3.71 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 7.62 3.63 0.00 1.23 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 94 D 8.22 4.42 0.00 2.70 2.70 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 95 K 7.74 4.27 0.00 1.79 1.79 0.00 1.74 0.00 0.00 1.67 0.00 0.00 2.96 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.32 1.35 7.81 96 L 7.70 4.15 0.00 1.70 1.56 0.70 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 97 H 7.19 4.15 0.00 3.47 3.42 0.00 5.64 0.00 0.00 0.00 0.00 8.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 7.98 3.56 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 0.02 0.00 0.00 0.28 0.00 0.00 99 D 8.86 4.36 0.00 2.79 2.59 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 0.00 100 P 0.00 3.42 0.00 1.95 1.85 0.00 3.44 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.65 0.00 101 E 8.32 3.88 0.00 2.02 1.90 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 2.29 2.39 0.00 102 N 8.07 4.25 0.00 2.38 2.66 0.00 0.00 6.94 8.00 0.00 0.00 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 7.37 4.38 0.00 3.11 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 R 7.91 4.00 0.00 1.98 1.97 0.00 3.11 0.00 0.00 3.34 7.56 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 7.63 3.82 0.00 1.60 1.25 0.68 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 106 L 8.09 4.01 0.00 1.63 1.65 0.52 -0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 107 G 8.09 3.65 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 0.00 108 N 8.29 4.50 0.00 2.94 2.95 0.00 0.00 6.68 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 0.00 109 V 7.99 3.65 2.23 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 1.07 0.00 0.00 1.17 0.00 0.00 110 L 8.31 4.00 0.00 2.01 1.95 1.05 0.80 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 0.00 111 V 7.75 3.66 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 1.32 0.00 0.00 1.20 0.00 0.00 112 C 8.11 4.16 0.00 3.22 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 0.00 113 V 7.95 3.53 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 1.05 0.00 0.00 1.02 0.00 0.00 114 L 7.85 3.77 0.00 1.00 1.13 0.72 0.86 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 0.00 115 A 7.24 3.63 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 0.00 116 H 8.01 4.11 0.00 3.15 3.43 0.00 5.77 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 H 8.13 3.84 0.00 2.92 2.65 0.00 5.99 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 8.45 4.66 0.00 3.23 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 0.00 119 G 8.84 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 K 8.90 4.00 0.00 1.92 2.02 0.00 1.61 0.00 0.00 1.66 0.00 0.00 2.99 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.46 1.49 7.81 121 E 7.96 4.10 0.00 2.01 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 2.33 2.28 0.00 122 F 8.05 4.64 0.00 3.06 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 0.00 123 T 7.40 4.20 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 1.27 0.00 0.00 124 P 0.00 4.17 0.00 2.16 2.15 0.00 3.59 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 2.12 2.20 0.00 125 P 0.00 4.22 0.00 2.12 2.07 0.00 3.51 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.12 0.00 126 V 7.36 3.58 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 0.95 0.00 0.00 0.90 0.00 0.00 127 Q 7.89 3.49 0.00 1.73 2.12 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 2.43 2.57 0.00 128 A 8.10 4.02 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 0.00 129 A 7.89 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 0.00 130 Y 8.17 4.00 0.00 3.32 3.27 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 0.00 131 Q 8.79 4.15 0.00 2.25 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.81 0.00 0.00 0.00 0.00 0.00 2.74 2.62 0.00 132 K 8.02 4.01 0.00 2.03 1.85 0.00 1.66 0.00 0.00 1.57 0.00 0.00 2.90 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.47 1.61 7.81 133 V 7.66 3.54 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 1.00 0.00 0.00 0.76 0.00 0.00 134 V 8.29 3.87 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 1.17 0.00 0.00 135 A 8.16 4.13 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 0.00 136 G 8.27 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.28 3.48 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 0.69 0.00 0.00 0.89 0.00 0.00 138 A 8.24 3.87 1.45 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 0.00 139 N 8.35 4.32 0.00 2.77 2.89 0.00 0.00 6.91 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 0.00 140 A 7.83 4.04 1.44 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 0.00 0.00 0.00 141 L 7.80 3.94 0.00 1.05 0.64 0.04 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 142 A 7.57 4.37 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 H 7.86 4.09 0.00 3.30 3.53 0.00 5.74 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 K 8.13 4.54 0.00 1.87 1.84 0.00 1.77 0.00 0.00 1.81 0.00 0.00 3.02 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.52 1.60 7.81 145 Y 8.06 4.18 0.00 3.12 2.97 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 0.00 146 H 8.32 4.52 0.00 3.19 3.22 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