NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 R 4.4835 8.0132 119.1019 56.2873 32.1882 177.2569 3 L 3.8865 8.0338 116.3117 55.1608 41.6242 175.5573 4 N 5.1421 7.7824 116.1128 52.7562 38.7172 174.3884 5 T 4.5990 8.5118 106.1853 61.6970 70.3528 172.4690 6 L 4.6894 7.8824 122.8807 54.0887 42.1821 175.7832 7 S 4.8206 8.2907 116.6692 55.3672 65.8377 171.9474 8 P 4.4475 0.0000 0.0000 61.8057 32.2679 175.9275 9 A 4.0096 8.4306 121.8133 52.2579 18.7443 176.9177 10 E 4.0895 8.6075 122.2186 57.5961 30.0052 177.5400 11 G 3.9346 8.9157 113.5992 45.8289 0.0000 174.4304 12 S 4.1543 7.9545 114.4059 60.8607 62.6327 175.6312 13 K 4.3428 7.4798 122.9150 54.5078 30.5490 176.2538 14 K 4.1923 8.4621 122.5723 56.5177 34.4835 178.8528 15 A 3.6651 6.9875 118.6756 49.8677 21.2582 179.0272 16 G 3.1898 9.5132 112.2856 46.0746 0.0000 173.1580 17 K 3.8153 8.3074 126.1241 56.8982 32.2217 175.7950 18 R 4.2998 8.1042 118.7140 55.5393 32.8531 175.4023 19 L 4.7235 7.3084 119.1275 57.2544 42.5890 174.1534 20 G 3.9444 8.7225 110.2225 46.7196 0.0000 173.7306 21 R 4.5152 8.0627 116.7714 55.1952 30.8916 176.3151 22 G 4.0896 8.1489 101.3120 45.5281 0.0000 174.5280 23 I 3.7374 8.4632 120.3690 64.5892 37.5731 179.1955 24 G 4.0117 8.0653 108.4629 48.7446 0.0000 174.6683 25 S 4.0268 7.3268 113.3658 59.8470 62.4007 175.0806 26 G 4.2218 8.3633 116.4522 44.5047 0.0000 173.7073 27 L 4.4106 7.7719 127.9016 52.8579 41.3939 176.2703 28 G 4.1687 8.4690 110.3822 45.0847 0.0000 167.4091 29 K 3.7000 9.3102 133.1377 56.7808 33.1603 176.4725 30 T 3.4865 8.7077 116.3389 60.6508 68.7643 172.0107 31 G 4.0066 8.6592 109.4866 46.6404 0.0000 173.2953 32 G 3.9574 8.1902 101.8042 46.3013 0.0000 174.8204 33 R 4.3920 8.1223 113.8529 54.7617 30.6994 178.3641 34 G 3.6968 7.9068 105.9665 46.8498 0.0000 174.5136 35 H 4.5820 8.5876 122.2441 54.9527 30.3185 174.2137 36 K 3.7995 8.7153 125.6303 56.1346 30.2746 175.8898 37 G 4.0387 8.2180 108.2960 45.0663 0.0000 174.3445 38 Q 3.8818 8.5932 120.0947 59.2101 28.9757 179.5117 39 K 4.3152 7.8988 115.0313 58.1815 33.5389 177.7914 40 S 4.7493 7.4299 120.9617 55.5645 61.5805 173.7569 41 R 3.5803 8.8485 126.4315 55.2157 29.0795 175.3734 42 S 4.0142 8.6304 117.8474 59.3318 62.7946 173.2087 43 G 3.6119 8.9253 117.7902 45.8229 0.0000 172.2921 44 G 4.5206 7.8818 105.5274 42.2706 0.0000 170.6653 45 G 4.3320 7.6012 108.6200 43.4933 0.0000 172.3121 46 V 4.2400 7.4435 113.0875 58.5863 34.6305 176.4238 47 R 4.0618 8.1580 119.4097 56.0400 29.7623 176.2737 48 R 4.1380 8.2793 118.1732 57.9148 30.5728 176.6456 49 G 4.2804 8.9501 110.2594 45.6137 0.0000 174.1057 50 F 4.2096 7.9254 121.5372 58.6878 40.2016 175.0343 51 E 4.5936 7.3320 124.4194 55.0445 29.6452 175.6338 52 G 3.7585 7.4240 107.4484 45.8347 0.0000 172.7191 53 G 3.5288 8.7518 106.9986 48.2964 0.0000 173.6671 54 Q 3.6846 7.5607 119.2303 54.7976 30.2720 176.3183 55 M 4.0826 8.2631 123.5101 54.6072 33.1033 174.3190 56 P 4.5586 0.0000 0.0000 61.9493 32.6652 176.7820 57 L 3.8378 8.6842 125.4060 58.6952 41.9898 179.1981 58 Y 4.3645 8.0613 111.3846 57.5017 37.5612 175.9861 59 R 4.3507 8.1943 118.7140 58.4035 33.7407 177.0069 60 R 3.9862 7.9987 114.9522 58.6151 30.2873 177.0367 61 L 4.4820 7.6004 117.5396 52.7865 42.7137 174.9091 62 P 4.5509 0.0000 0.0000 62.2394 32.2696 176.2723 63 K 4.4585 8.3583 119.4318 56.6430 32.7739 177.4777 64 F 5.0218 8.1784 111.4274 56.8642 40.5534 176.7057 65 G 3.8452 7.5544 108.1563 45.4460 0.0000 171.4225 66 F 4.3000 8.5133 123.5992 57.7416 40.0218 174.0936 67 T 4.4100 8.4948 125.5554 61.7314 70.5139 174.8701 68 S 3.9751 8.4270 121.0725 61.5693 63.0221 174.2056 69 R 4.5917 8.2911 121.8462 56.7217 27.9866 178.3992 70 K 4.0192 7.9854 117.0344 59.5026 32.2195 178.4220 71 A 4.4013 8.0418 121.6795 54.4257 18.0506 178.8492 72 A 4.3245 7.5999 117.1905 53.4771 18.7105 177.5673 73 I 4.8065 8.2209 111.9100 60.4612 39.6511 174.7380 74 T 5.2800 8.2489 112.9992 60.7888 71.1409 172.5696 75 A 5.1931 9.1569 128.0693 49.8700 22.4842 174.5684 76 E 4.9463 8.6740 117.0471 54.9455 32.6138 176.1190 77 I 4.4755 8.1025 121.7458 59.0155 39.4482 174.8009 78 R 4.1048 8.6604 125.7038 56.4464 30.6742 178.0129 79 L 3.9486 8.6684 121.8213 57.7254 41.0550 178.8112 80 S 4.4341 8.2747 112.7583 60.6809 62.7196 174.7085 81 D 4.6252 6.9202 118.6362 54.3611 40.7887 175.0635 82 L 4.1862 8.8626 123.0341 56.1696 41.6472 176.8056 83 A 4.1849 7.3385 119.8194 54.0846 18.3682 177.8234 84 K 4.6423 7.3536 115.4851 56.6608 32.9982 177.7635 85 V 3.6988 7.9001 120.2403 62.3776 32.1771 173.1734 86 E 3.4362 9.1906 124.0539 59.3881 27.1821 173.5012 87 G 4.1355 9.2328 117.8909 48.9931 0.0000 173.9247 88 G 3.5974 8.1565 107.1390 47.4707 0.0000 171.9483 89 V 4.5158 8.6541 121.9184 60.1590 32.9021 175.7410 90 V 4.0052 8.8911 126.0668 62.0560 32.0024 174.6311 91 D 5.0584 8.4670 127.7116 52.5942 42.4837 175.9673 92 L 4.2190 7.8796 121.9485 56.4972 41.8506 178.0724 93 N 4.8614 7.7161 116.8326 52.9634 37.7711 174.9769 94 T 3.7642 8.9106 114.6164 64.7951 67.2165 173.6152 95 L 3.9575 7.8983 120.1626 57.8365 41.6804 179.1966 96 K 3.7683 8.1130 118.5698 59.8030 31.7896 178.3913 97 A 4.0476 7.8937 118.5757 54.8441 18.3948 178.3427 98 A 4.2880 8.0609 116.9061 51.6264 18.4410 176.8471 99 N 4.1656 7.6292 115.2738 55.3894 37.9171 174.8929 100 I 4.2312 7.6695 109.0063 60.4118 38.6049 175.2831 101 I 4.0372 7.5176 118.7576 62.6474 39.7903 174.9135 102 G 4.0726 8.5767 110.9839 44.9391 0.0000 174.0296 103 I 3.6447 8.7488 127.0809 64.7259 37.1401 177.6413 104 Q 4.1138 7.9218 116.2704 57.7515 28.8577 176.8359 105 I 3.8226 7.8159 119.5163 61.7340 37.4984 175.4787 106 E 4.3675 8.4933 121.1131 56.0619 31.6508 175.9670 107 F 5.2183 7.6777 116.4197 56.3205 44.2356 173.2769 108 A 5.5529 8.4272 120.0829 52.3064 22.5840 176.4541 109 K 4.6849 8.6496 122.0104 55.7683 34.8468 176.1969 110 V 4.1527 7.8946 114.6844 64.1462 32.5515 176.3624 111 I 3.5879 7.9662 118.2719 61.8515 36.1805 174.3858 112 L 4.2917 8.0952 123.7409 53.7478 40.1173 177.1338 113 A 4.5527 7.9076 130.5835 52.3796 19.5836 177.4516 114 G 3.6458 8.8642 109.1105 47.4266 0.0000 172.5097 115 E 3.7010 8.4351 117.3261 56.3886 25.7566 173.0979 116 V 4.5985 7.6122 117.7338 59.9817 33.9008 174.8461 117 T 4.4426 7.9319 118.5688 64.3388 71.6652 173.9477 118 T 3.8999 7.7735 113.1197 61.7845 69.2361 171.8789 119 P 4.9546 0.0000 0.0000 62.1409 32.0059 175.8546 120 V 4.5155 8.4503 123.5937 61.2069 35.5145 173.5699 121 T 5.1933 8.2408 120.0995 60.2104 69.8917 173.1477 122 V 4.9127 8.7632 128.3074 59.8318 34.2188 174.4491 123 R 5.3616 8.7217 124.2521 55.3904 32.1048 175.4063 124 G 3.8016 9.4263 114.9937 45.2484 0.0000 173.2881 125 L 4.5335 7.3733 117.9579 53.9061 42.5247 176.7552 126 R 4.3697 8.7014 122.4892 56.5228 32.0051 175.8532 127 V 4.4676 8.0485 118.3900 60.8296 33.0905 173.2125 128 T 3.9079 8.6748 116.5744 61.8793 69.4952 174.9213 129 K 3.9656 9.0672 120.9419 59.6459 32.0382 179.3095 130 G 3.8933 8.1932 104.9122 48.0742 0.0000 174.9981 131 A 3.9454 7.7871 122.9755 54.7100 18.4673 179.2114 132 R 3.7636 8.2065 117.2871 59.8292 29.9751 177.8826 133 A 3.9499 8.3338 120.2353 55.5960 18.4386 179.2198 134 A 3.9121 8.4405 118.9605 55.3724 18.5205 179.4530 135 I 3.6701 8.2368 117.7520 64.9869 37.2473 178.0067 136 E 4.2861 8.6012 119.7388 58.9501 29.3059 179.1859 137 A 4.2138 8.2159 117.3164 53.1754 18.7474 177.1920 138 A 4.5979 7.9851 120.1448 51.8171 19.6091 178.2900 139 G 4.0372 8.7857 109.6462 46.3784 0.0000 175.2033 140 G 3.9032 7.9428 107.3632 46.1591 0.0000 172.7829 141 K 4.7252 9.2212 122.0402 54.4152 35.8962 175.1918 142 I 4.9086 8.5652 127.5790 59.6578 39.0587 174.1777 143 E 4.7643 8.6464 125.6487 54.1245 32.2146 176.3732 144 E 4.1616 8.6370 118.8727 56.7127 30.0018 176.3712 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 2 R 8.01 4.48 0.00 1.89 2.04 0.00 3.39 0.00 0.00 3.29 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.62 0.00 3 L 8.03 3.89 0.00 1.71 1.75 0.92 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 4 N 7.78 5.14 0.00 2.76 2.82 0.00 0.00 5.82 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 5 T 8.51 4.60 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 6 L 7.88 4.69 0.00 1.74 1.69 0.92 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 7 S 8.29 4.82 0.00 3.95 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 8 P 0.00 4.45 0.00 2.20 2.09 0.00 3.79 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 1.98 1.96 0.00 9 A 8.43 4.01 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 10 E 8.61 4.09 0.00 1.92 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 0.00 2.29 2.37 0.00 11 G 8.92 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 0.00 0.00 0.00 12 S 7.95 4.15 0.00 3.87 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 13 K 7.48 4.34 0.00 1.78 1.75 0.00 1.82 0.00 0.00 1.63 0.00 0.00 2.92 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.38 1.35 7.81 14 K 8.46 4.19 0.00 1.71 1.70 0.00 1.80 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.42 1.43 7.81 15 A 6.99 3.67 0.97 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 16 G 9.51 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 0.00 0.00 0.00 17 K 8.31 3.82 0.00 1.75 1.79 0.00 1.70 0.00 0.00 1.70 0.00 0.00 3.04 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.45 1.50 7.81 18 R 8.10 4.30 0.00 1.76 1.86 0.00 3.26 0.00 0.00 3.15 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.57 0.00 19 L 7.31 4.72 0.00 1.79 1.73 0.97 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 20 G 8.72 3.94 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 0.00 21 R 8.06 4.52 0.00 1.71 1.84 0.00 3.28 0.00 0.00 3.23 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.64 0.00 22 G 8.15 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 0.00 0.00 0.00 23 I 8.46 3.74 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.70 0.91 0.00 0.00 24 G 8.07 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 0.00 0.00 0.00 25 S 7.33 4.03 0.00 4.05 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 0.00 26 G 8.36 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 0.00 0.00 0.00 0.00 27 L 7.77 4.41 0.00 1.82 1.64 0.92 0.81 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 28 G 8.47 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 K 9.31 3.70 0.00 1.96 1.80 0.00 1.80 0.00 0.00 1.87 0.00 0.00 2.96 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.37 1.40 7.81 30 T 8.71 3.49 4.39 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 1.07 0.00 0.00 31 G 8.66 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 0.00 0.00 0.00 32 G 8.19 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 33 R 8.12 4.39 0.00 1.89 2.01 0.00 3.14 0.00 0.00 3.21 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.53 0.00 34 G 7.91 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 35 H 8.59 4.58 0.00 3.10 3.24 0.00 5.96 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 K 8.72 3.80 0.00 1.97 1.98 0.00 1.87 0.00 0.00 1.72 0.00 0.00 2.97 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.33 1.46 7.81 37 G 8.22 4.04 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 0.00 0.00 0.00 38 Q 8.59 3.88 0.00 2.09 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.90 6.89 0.00 0.00 0.00 0.00 0.00 2.49 2.41 0.00 39 K 7.90 4.32 0.00 1.79 1.85 0.00 1.80 0.00 0.00 1.77 0.00 0.00 3.11 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.45 1.44 7.81 40 S 7.43 4.75 0.00 4.00 3.28 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 41 R 8.85 3.58 0.00 2.11 1.98 0.00 3.37 0.00 0.00 3.15 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.53 0.00 42 S 8.63 4.01 0.00 3.82 3.79 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.93 3.61 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 0.00 44 G 7.88 4.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 7.60 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 0.00 0.00 0.00 46 V 7.44 4.24 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 0.49 0.00 0.00 1.04 0.00 0.00 47 R 8.16 4.06 0.00 2.00 2.04 0.00 3.12 0.00 0.00 3.41 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.82 0.00 48 R 8.28 4.14 0.00 1.75 1.89 0.00 3.27 0.00 0.00 3.20 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.69 0.00 49 G 8.95 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 0.00 0.00 0.00 0.00 50 F 7.93 4.21 0.00 3.09 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 51 E 7.33 4.59 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 2.39 2.14 0.00 52 G 7.42 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 53 G 8.75 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 54 Q 7.56 3.68 0.00 1.95 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.88 0.00 0.00 0.00 0.00 0.00 2.28 2.34 0.00 55 M 8.26 4.08 0.00 1.92 1.88 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.53 0.00 56 P 0.00 4.56 0.00 1.44 1.93 0.00 3.42 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 1.87 1.92 0.00 57 L 8.68 3.84 0.00 1.74 1.80 0.94 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 58 Y 8.06 4.36 0.00 3.12 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 59 R 8.19 4.35 0.00 1.56 1.74 0.00 3.19 0.00 0.00 3.05 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.97 0.00 60 R 8.00 3.99 0.00 1.77 1.96 0.00 3.17 0.00 0.00 3.19 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.75 0.00 61 L 7.60 4.48 0.00 1.82 1.65 0.93 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 62 P 0.00 4.55 0.00 2.24 2.08 0.00 3.80 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 2.04 2.00 0.00 63 K 8.36 4.46 0.00 1.81 1.79 0.00 1.74 0.00 0.00 1.78 0.00 0.00 3.05 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.48 1.46 7.81 64 F 8.18 5.02 0.00 3.10 3.05 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 65 G 7.55 3.85 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 0.00 0.00 0.00 66 F 8.51 4.30 0.00 2.98 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 67 T 8.49 4.41 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 1.19 0.00 0.00 68 S 8.43 3.98 0.00 3.61 3.79 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.29 4.59 0.00 2.10 2.27 0.00 3.24 0.00 0.00 3.31 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.63 0.00 70 K 7.99 4.02 0.00 1.87 1.83 0.00 1.75 0.00 0.00 1.80 0.00 0.00 2.73 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.55 1.67 7.81 71 A 8.04 4.40 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 72 A 7.60 4.32 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 73 I 8.22 4.81 1.83 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.19 0.94 0.00 0.00 74 T 8.25 5.28 4.32 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 1.45 0.00 0.00 75 A 9.16 5.19 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 E 8.67 4.95 0.00 1.97 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 2.19 2.32 0.00 77 I 8.10 4.48 2.01 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 1.24 1.14 0.92 0.00 0.00 78 R 8.66 4.10 0.00 1.86 1.88 0.00 3.13 0.00 0.00 3.34 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.70 0.00 79 L 8.67 3.95 0.00 1.91 1.73 0.92 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 80 S 8.27 4.43 0.00 4.03 4.43 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 81 D 6.92 4.63 0.00 2.67 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 82 L 8.86 4.19 0.00 1.86 1.81 0.92 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 83 A 7.34 4.18 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 84 K 7.35 4.64 0.00 1.93 1.88 0.00 1.60 0.00 0.00 1.75 0.00 0.00 3.02 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.30 1.34 7.81 85 V 7.90 3.70 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 0.83 0.00 0.00 0.93 0.00 0.00 86 E 9.19 3.44 0.00 2.09 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 2.19 2.35 0.00 87 G 9.23 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 0.00 0.00 0.00 88 G 8.16 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 89 V 8.65 4.52 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 0.68 0.00 0.00 0.93 0.00 0.00 90 V 8.89 4.01 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 0.99 0.00 0.00 0.93 0.00 0.00 91 D 8.47 5.06 0.00 2.72 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 92 L 7.88 4.22 0.00 1.38 1.74 0.93 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 93 N 7.72 4.86 0.00 2.75 2.44 0.00 0.00 6.11 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 94 T 8.91 3.76 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 95 L 7.90 3.96 0.00 1.68 1.73 0.93 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 96 K 8.11 3.77 0.00 1.80 1.81 0.00 1.69 0.00 0.00 1.96 0.00 0.00 2.94 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.50 1.51 7.81 97 A 7.89 4.05 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 98 A 8.06 4.29 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 99 N 7.63 4.17 0.00 2.87 2.87 0.00 0.00 6.99 7.29 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 0.00 100 I 7.67 4.23 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.85 0.98 0.00 0.00 101 I 7.52 4.04 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.80 0.90 0.00 0.00 102 G 8.58 4.07 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 0.00 0.00 0.00 103 I 8.75 3.64 1.86 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.56 0.89 0.00 0.00 104 Q 7.92 4.11 0.00 2.02 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.55 6.95 0.00 0.00 0.00 0.00 0.00 2.35 2.31 0.00 105 I 7.82 3.82 1.92 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 1.35 0.73 0.93 0.00 0.00 106 E 8.49 4.37 0.00 1.16 1.12 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 1.92 2.01 0.00 107 F 7.68 5.22 0.00 2.95 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 A 8.43 5.55 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 0.00 109 K 8.65 4.68 0.00 1.73 1.77 0.00 1.62 0.00 0.00 1.74 0.00 0.00 2.80 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.47 1.43 7.81 110 V 7.89 4.15 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 0.92 0.00 0.00 0.94 0.00 0.00 111 I 7.97 3.59 1.88 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.38 0.94 0.00 0.00 112 L 8.10 4.29 0.00 1.63 1.63 0.92 0.76 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 0.00 113 A 7.91 4.55 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 0.00 114 G 8.86 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 0.00 115 E 8.44 3.70 0.00 2.21 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 2.29 2.28 0.00 116 V 7.61 4.60 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 0.77 0.00 0.00 0.93 0.00 0.00 117 T 7.93 4.44 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 118 T 7.77 3.90 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 119 P 0.00 4.95 0.00 1.96 1.95 0.00 3.67 0.00 0.00 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.92 0.00 120 V 8.45 4.52 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 1.10 0.00 0.00 0.99 0.00 0.00 121 T 8.24 5.19 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 1.27 0.00 0.00 122 V 8.76 4.91 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 0.65 0.00 0.00 0.94 0.00 0.00 123 R 8.72 5.36 0.00 1.86 1.79 0.00 3.10 0.00 0.00 3.27 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.39 0.00 124 G 9.43 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 L 7.37 4.53 0.00 1.56 1.85 0.93 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 126 R 8.70 4.37 0.00 1.92 1.82 0.00 3.09 0.00 0.00 3.19 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.57 0.00 127 V 8.05 4.47 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 0.70 0.00 0.00 0.93 0.00 0.00 128 T 8.67 3.91 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 129 K 9.07 3.97 0.00 1.82 1.90 0.00 1.70 0.00 0.00 1.82 0.00 0.00 2.98 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.53 1.52 7.81 130 G 8.19 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 0.00 131 A 7.79 3.95 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 0.00 132 R 8.21 3.76 0.00 1.96 2.15 0.00 3.13 0.00 0.00 3.17 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.68 0.00 133 A 8.33 3.95 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 0.00 134 A 8.44 3.91 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 0.00 135 I 8.24 3.67 1.95 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.51 0.91 0.00 0.00 136 E 8.60 4.29 0.00 2.26 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 2.33 2.32 0.00 137 A 8.22 4.21 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 0.00 138 A 7.99 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 0.00 139 G 8.79 4.04 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 0.00 0.00 0.00 140 G 7.94 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 0.00 0.00 0.00 141 K 9.22 4.73 0.00 1.80 1.60 0.00 1.46 0.00 0.00 1.65 0.00 0.00 2.90 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.32 1.43 7.81 142 I 8.57 4.91 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.80 0.92 0.00 0.00 143 E 8.65 4.76 0.00 2.07 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 2.36 2.24 0.00 144 E 8.64 4.16 0.00 2.09 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 2.27 2.37 0.00