NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.1579 8.1727 122.0516 56.3142 34.1045 174.1085 2 V 4.5098 8.2040 127.3223 60.7833 32.0333 174.4942 3 F 4.4642 9.8456 128.8311 57.5655 40.1918 174.9638 4 E 4.2824 8.8234 121.2192 55.5364 31.0947 176.8827 5 R 3.3084 8.9236 121.2369 60.7001 29.9624 179.5121 6 C 4.3328 8.0162 115.2598 59.6407 35.3739 175.6847 7 E 3.9079 8.1037 120.7165 59.2833 29.2236 178.5325 8 L 3.6297 7.9917 120.0690 57.8159 42.0434 178.5732 9 A 3.9390 7.8874 120.7470 55.4130 18.3102 179.8967 10 R 3.8860 8.0666 116.3996 59.5733 30.1271 179.4770 11 T 3.8410 7.8097 115.3544 66.6450 68.4633 176.7293 12 L 3.8513 8.0644 121.1874 57.5135 41.6218 179.4586 13 K 3.8791 7.9902 119.6106 59.6302 31.9453 178.8963 14 R 3.9563 7.7501 117.6312 58.9840 30.0561 177.5250 15 L 4.3035 7.5318 116.3110 54.1531 41.8942 176.7102 16 G 3.8067 7.8740 106.9216 47.0757 0.0000 175.0647 17 M 3.9061 7.8162 120.8692 56.2549 32.5434 175.9232 18 D 4.4294 8.0144 117.9822 55.8608 41.2499 175.8725 19 G 3.9619 9.3976 115.6543 45.4253 0.0000 171.5876 20 Y 4.2672 8.2586 122.0710 58.9254 38.9827 176.3848 21 R 3.6128 8.9825 126.0374 57.1784 27.8571 177.1995 22 G 3.8253 8.2132 103.5532 45.5582 0.0000 174.0144 23 I 4.1131 7.8142 122.3844 59.0737 38.2853 175.8743 24 S 4.6129 8.3390 120.2771 57.7501 63.9700 174.8711 25 L 4.2070 9.0270 123.7262 58.6887 41.7494 179.3462 26 A 4.1417 8.2412 119.9696 55.3716 18.1099 179.2700 27 N 4.4404 8.2186 114.8350 56.3096 38.6159 177.7142 28 W 4.2226 8.0556 119.9235 59.8978 29.1654 178.3957 29 M 4.1665 8.4963 118.9141 58.5552 31.4991 177.8924 30 C 3.0836 8.0902 118.6465 59.0880 44.8906 175.2919 31 L 3.9580 8.2699 121.8764 58.3281 41.7208 178.8688 32 A 4.1337 8.3325 120.7189 54.8692 18.3563 179.4937 33 K 2.7597 8.0356 118.1260 59.2980 32.0294 179.1712 34 W 4.1286 7.5514 117.4370 59.3325 29.0596 178.3527 35 E 4.3285 8.2854 118.4517 58.6904 28.9902 177.8212 36 S 4.5178 7.8538 109.5973 56.4970 64.6009 174.4931 37 G 3.2283 8.0755 108.6895 46.9199 0.0000 173.3153 38 Y 3.6449 7.6138 113.5073 58.6534 35.4118 168.5115 39 N 5.3936 7.6265 117.9044 51.9681 40.1651 175.7162 40 T 4.1176 9.0286 117.1629 63.8120 69.2272 175.9180 41 R 4.5389 8.0254 116.9294 55.5678 29.9826 176.0325 42 A 4.3090 7.6912 121.4625 52.7022 19.1829 177.1265 43 T 4.9915 8.4878 112.1152 59.9216 72.3747 173.3804 44 N 4.8141 8.7178 122.1763 52.4094 41.8193 172.4299 45 Y 4.6088 8.7284 128.5311 57.4256 40.6832 173.9461 46 N 4.5268 8.5724 125.0751 51.2610 38.4867 175.3611 47 A 3.6331 8.3055 127.6446 54.8256 18.9074 179.1934 48 G 3.7429 8.0876 104.1026 48.1278 0.0000 173.8450 49 D 4.7292 7.5105 115.0512 51.9900 40.1235 175.7797 50 R 3.9984 8.2066 116.4768 57.0868 28.1459 175.8318 51 S 4.9949 7.7275 111.5933 57.0369 66.5120 172.6513 52 T 5.0877 8.7152 116.3027 61.9513 72.6200 172.7142 53 D 5.4102 9.0381 125.3766 53.3539 43.0730 175.0418 54 Y 4.9616 9.1903 121.0975 57.5099 41.4587 177.1332 55 G 4.1103 9.1324 112.1484 45.4517 0.0000 173.2621 56 I 3.8311 8.2035 116.7450 62.8482 37.7758 177.1145 57 F 4.7350 8.0107 115.3695 56.4313 40.0093 175.1259 58 Q 3.6396 8.0677 119.2883 57.1362 26.5583 174.2328 59 I 4.3569 8.1830 119.0086 61.2516 39.2352 176.9801 60 N 5.3354 9.2361 126.0869 53.3931 39.7949 175.7258 61 S 4.6863 9.0336 120.2978 60.1889 63.3448 175.4206 62 R 3.7420 8.8557 122.4786 58.6733 30.3270 177.7375 63 Y 4.3156 7.6574 114.5067 57.8390 40.7574 177.2471 64 W 4.7425 7.9774 118.8293 57.8671 30.4729 173.7309 65 C 5.5991 7.8729 110.5684 53.4962 45.7955 171.8427 66 N 4.7755 8.9563 119.9658 52.3372 39.6113 174.9184 67 D 4.8863 8.4844 122.8365 52.1990 40.4706 178.2203 68 G 4.0933 8.6613 109.9823 46.2729 0.0000 174.8783 69 K 4.3683 8.0301 116.1982 56.7579 33.2305 176.1547 70 T 4.5378 7.4884 116.5954 61.7096 69.1981 173.0757 71 P 4.2798 0.0000 0.0000 63.7809 31.9290 176.1847 72 G 3.9343 8.5263 109.1782 46.4260 0.0000 172.8433 73 A 4.5873 7.7683 118.6285 50.5369 20.8900 177.5154 74 V 4.3110 8.3694 112.7186 59.2627 35.4570 176.0112 75 N 4.9803 8.0860 117.4750 51.8803 37.6313 174.4426 76 A 3.9915 8.9732 125.0022 54.8498 19.1214 178.4649 77 C 4.5085 8.4217 111.0920 57.2461 41.0193 173.0248 78 H 4.1005 7.9068 116.3651 56.7264 26.4193 174.4215 79 L 4.8469 8.2549 117.1726 52.7954 46.2693 176.8204 80 S 4.6313 8.3639 115.6711 58.0793 63.2641 176.0126 81 C 4.1484 8.6862 123.9222 59.5381 40.6827 176.3645 82 S 3.9035 7.7341 114.7638 61.2587 61.6629 175.8968 83 A 4.0869 7.7847 122.5556 54.5440 18.3310 177.9500 84 L 4.4624 7.6728 116.2735 55.0467 41.7215 177.6255 85 L 5.2973 7.7687 116.4820 53.6722 42.3880 176.7516 86 Q 4.3469 7.8379 117.8407 55.5171 29.4557 175.9728 87 D 4.4299 8.5017 119.4768 56.9117 41.1902 176.7648 88 N 4.6175 8.0352 118.2056 53.0783 39.3638 174.6008 89 I 4.2831 8.4437 118.8549 60.9852 38.0459 177.0462 90 A 3.9393 8.7509 125.0826 56.1301 18.2063 180.2880 91 D 4.3143 8.0866 116.4262 57.3026 40.8762 178.6652 92 A 4.1038 7.9957 120.9601 55.1532 18.4091 179.7421 93 V 3.3372 8.1137 116.6724 66.0632 31.6534 178.1592 94 A 3.8206 7.9561 120.5321 55.1882 18.0580 178.8395 95 C 4.2062 8.3170 116.9021 59.6416 39.1714 175.6140 96 A 3.8376 8.1256 122.6635 54.9518 17.5937 179.7740 97 K 3.7769 7.6217 116.3056 59.4701 32.4096 179.2088 98 R 4.0521 7.8022 118.7004 59.3422 29.7778 178.3125 99 A 2.6572 7.8277 120.8101 54.7564 17.9764 179.3885 100 V 3.8803 7.7463 108.6188 62.4440 31.6866 177.8471 101 R 4.1906 7.6931 118.1405 57.1214 30.5226 175.8940 102 D 4.7589 7.2523 118.7289 53.1404 41.9646 175.2753 103 P 4.2494 0.0000 0.0000 66.3279 31.1628 177.8176 104 Q 4.0259 8.1607 117.4515 56.6280 29.8765 176.9415 105 G 3.7261 7.9526 107.0164 47.2102 0.0000 176.1047 106 I 3.7665 7.7459 121.5142 62.8723 37.9960 177.6939 107 R 4.2417 7.3601 117.7606 58.3214 30.0375 177.5624 108 A 3.9168 7.5717 120.8730 54.0848 18.6188 177.4311 109 W 4.7082 8.0797 117.0245 55.3819 29.6066 177.4475 110 V 3.7559 8.6755 124.0436 65.9198 30.8888 177.5817 111 A 4.0870 8.3162 120.2056 54.6868 18.1056 179.2679 112 W 3.9554 8.3914 127.2028 60.6166 30.5918 178.4373 113 R 3.6523 8.1341 116.3888 59.2295 29.6736 178.4281 114 N 4.3210 7.8722 114.7893 56.0487 38.7502 177.0513 115 R 4.0000 7.6303 116.0343 56.1759 31.2138 176.3582 116 C 4.5787 7.7114 115.6099 57.7159 42.6753 174.4329 117 Q 3.3379 6.5306 119.2603 57.2196 28.7050 175.6383 118 N 4.1680 8.6436 120.0047 53.9114 36.3249 173.8963 119 R 4.3892 7.2887 116.6646 54.2648 32.2809 175.9104 120 D 4.5659 8.3445 118.9321 53.9633 40.2118 175.8433 121 V 4.4979 8.1887 118.9166 61.4504 32.3649 178.5461 122 R 4.0490 8.0380 121.4515 59.3154 29.5410 178.5748 123 Q 3.9815 8.1189 116.2375 59.7066 28.2490 178.3076 124 Y 4.3506 7.8201 117.3565 59.8298 38.3493 176.7230 125 V 4.3948 7.8833 110.9809 60.6767 33.4416 175.6079 126 Q 4.1705 8.0321 119.8595 57.4260 28.7902 176.9268 127 G 3.9460 8.9391 110.2799 46.0135 0.0000 174.4713 128 C 4.4479 8.0738 115.7785 56.5398 40.6539 173.8077 129 G 3.8333 8.0978 107.2453 46.9723 0.0000 174.1845 130 V 4.0108 7.8858 117.8745 61.0958 32.1371 175.9155 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 K 8.17 4.16 0.00 1.97 1.68 0.00 1.27 0.00 0.00 1.08 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.88 1.11 7.81 2 V 8.20 4.51 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 0.90 0.00 0.00 0.95 0.00 0.00 3 F 9.85 4.46 0.00 2.86 2.82 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 4 E 8.82 4.28 0.00 1.88 1.85 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 2.30 2.24 0.00 5 R 8.92 3.31 0.00 1.90 1.90 0.00 3.47 0.00 0.00 3.47 7.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.76 0.00 6 C 8.02 4.33 0.00 3.00 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 7 E 8.10 3.91 0.00 2.05 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 0.00 2.62 2.43 0.00 8 L 7.99 3.63 0.00 1.38 1.40 -0.08 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 9 A 7.89 3.94 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 10 R 8.07 3.89 0.00 2.01 1.99 0.00 3.14 0.00 0.00 3.28 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.85 0.00 11 T 7.81 3.84 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 12 L 8.06 3.85 0.00 1.74 1.59 0.95 0.64 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 13 K 7.99 3.88 0.00 1.93 1.94 0.00 1.65 0.00 0.00 1.58 0.00 0.00 2.92 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.44 1.46 7.81 14 R 7.75 3.96 0.00 1.98 2.06 0.00 3.30 0.00 0.00 3.22 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.66 0.00 15 L 7.53 4.30 0.00 1.69 1.55 0.87 0.89 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 16 G 7.87 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 17 M 7.82 3.91 0.00 1.31 1.95 0.00 0.00 0.00 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.23 0.00 18 D 8.01 4.43 0.00 2.67 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 19 G 9.40 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 20 Y 8.26 4.27 0.00 3.17 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 21 R 8.98 3.61 0.00 1.85 1.81 0.00 3.17 0.00 0.00 2.95 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.37 0.00 22 G 8.21 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 23 I 7.81 4.11 1.79 0.00 0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.56 -0.17 0.00 0.00 24 S 8.34 4.61 0.00 4.06 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 25 L 9.03 4.21 0.00 2.07 1.82 0.98 1.20 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 26 A 8.24 4.14 1.52 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 27 N 8.22 4.44 0.00 2.83 2.74 0.00 0.00 6.92 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 28 W 8.06 4.22 0.00 3.55 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 29 M 8.50 4.17 0.00 2.17 2.37 0.00 0.00 0.00 0.00 0.00 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.91 0.00 30 C 8.09 3.08 0.00 2.57 3.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 L 8.27 3.96 0.00 1.82 1.87 0.58 0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 32 A 8.33 4.13 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 33 K 8.04 2.76 0.00 1.40 1.71 0.00 0.71 0.00 0.00 1.10 0.00 0.00 2.61 0.00 0.00 2.65 0.00 0.00 0.00 0.00 1.18 0.23 7.81 34 W 7.55 4.13 0.00 3.36 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 35 E 8.29 4.33 0.00 2.03 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.42 0.00 36 S 7.85 4.52 0.00 4.06 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 37 G 8.08 3.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 Y 7.61 3.64 0.00 3.25 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 39 N 7.63 5.39 0.00 2.85 2.81 0.00 0.00 7.01 7.10 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 40 T 9.03 4.12 4.46 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 1.49 0.00 0.00 41 R 8.03 4.54 0.00 2.00 2.10 0.00 3.09 0.00 0.00 3.26 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.74 0.00 42 A 7.69 4.31 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 43 T 8.49 4.99 4.11 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 1.34 0.00 0.00 44 N 8.72 4.81 0.00 3.06 2.68 0.00 0.00 6.83 7.43 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 45 Y 8.73 4.61 0.00 2.98 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 46 N 8.57 4.53 0.00 2.64 2.60 0.00 0.00 6.52 6.79 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 47 A 8.31 3.63 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 G 8.09 3.74 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 0.00 0.00 0.00 49 D 7.51 4.73 0.00 2.70 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 50 R 8.21 4.00 0.00 2.04 2.20 0.00 3.12 0.00 0.00 3.20 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.53 0.00 51 S 7.73 4.99 0.00 3.96 3.98 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 0.00 0.00 0.00 52 T 8.72 5.09 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 0.66 0.00 0.00 53 D 9.04 5.41 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 54 Y 9.19 4.96 0.00 2.94 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 G 9.13 4.11 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 0.00 0.00 0.00 56 I 8.20 3.83 1.68 0.00 0.00 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 1.75 0.10 0.00 0.00 57 F 8.01 4.74 0.00 3.22 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 58 Q 8.07 3.64 0.00 2.55 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.89 6.83 0.00 0.00 0.00 0.00 0.00 2.53 2.70 0.00 59 I 8.18 4.36 2.15 0.00 0.00 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 1.40 1.15 1.17 0.00 0.00 60 N 9.24 5.34 0.00 2.98 2.99 0.00 0.00 6.98 7.16 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 61 S 9.03 4.69 0.00 4.08 4.41 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 62 R 8.86 3.74 0.00 1.61 1.31 0.00 2.67 0.00 0.00 2.87 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.10 0.00 63 Y 7.66 4.32 0.00 1.53 1.79 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 64 W 7.98 4.74 0.00 3.66 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 65 C 7.87 5.60 0.00 3.18 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 66 N 8.96 4.78 0.00 2.80 2.71 0.00 0.00 7.05 8.75 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 67 D 8.48 4.89 0.00 2.98 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 68 G 8.66 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 69 K 8.03 4.37 0.00 1.91 1.94 0.00 1.60 0.00 0.00 1.71 0.00 0.00 2.88 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.42 1.47 7.81 70 T 7.49 4.54 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 1.20 0.00 0.00 71 P 0.00 4.28 0.00 2.01 1.97 0.00 3.82 0.00 0.00 3.86 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 72 G 8.53 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 73 A 7.77 4.59 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 V 8.37 4.31 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 0.63 0.00 0.00 0.88 0.00 0.00 75 N 8.09 4.98 0.00 2.79 2.65 0.00 0.00 6.76 7.96 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 76 A 8.97 3.99 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 77 C 8.42 4.51 0.00 3.33 3.22 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 78 H 7.91 4.10 0.00 3.33 3.36 0.00 5.62 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 79 L 8.25 4.85 0.00 1.68 1.50 0.96 0.67 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 80 S 8.36 4.63 0.00 3.83 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 81 C 8.69 4.15 0.00 2.25 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 82 S 7.73 3.90 0.00 3.82 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 83 A 7.78 4.09 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 84 L 7.67 4.46 0.00 1.94 1.81 1.06 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 85 L 7.77 5.30 0.00 1.76 1.71 1.10 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 86 Q 7.84 4.35 0.00 2.23 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.61 7.11 0.00 0.00 0.00 0.00 0.00 2.37 2.52 0.00 87 D 8.50 4.43 0.00 2.63 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 88 N 8.04 4.62 0.00 2.69 2.74 0.00 0.00 6.95 7.94 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 89 I 8.44 4.28 1.80 0.00 0.00 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.39 1.01 0.00 0.00 90 A 8.75 3.94 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 91 D 8.09 4.31 0.00 2.75 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 92 A 8.00 4.10 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 93 V 8.11 3.34 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 0.71 0.00 0.00 0.87 0.00 0.00 94 A 7.96 3.82 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 95 C 8.32 4.21 0.00 3.14 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 96 A 8.13 3.84 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 K 7.62 3.78 0.00 1.64 1.44 0.00 1.28 0.00 0.00 0.76 0.00 0.00 2.21 0.00 0.00 2.47 0.00 0.00 0.00 0.00 0.30 1.00 7.81 98 R 7.80 4.05 0.00 1.97 2.09 0.00 3.27 0.00 0.00 3.27 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.91 0.00 99 A 7.83 2.66 0.31 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 0.00 100 V 7.75 3.88 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 1.16 0.00 0.00 1.42 0.00 0.00 101 R 7.69 4.19 0.00 2.21 2.02 0.00 3.33 0.00 0.00 3.30 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.74 0.00 102 D 7.25 4.76 0.00 3.08 2.60 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 0.00 103 P 0.00 4.25 0.00 2.15 2.20 0.00 3.78 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.01 0.00 104 Q 8.16 4.03 0.00 2.08 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.80 0.00 0.00 0.00 0.00 0.00 2.42 2.32 0.00 105 G 7.95 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 0.00 106 I 7.75 3.77 1.01 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.68 -0.61 0.00 0.00 107 R 7.36 4.24 0.00 2.00 2.04 0.00 3.25 0.00 0.00 3.29 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.60 0.00 108 A 7.57 3.92 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 W 8.08 4.71 0.00 3.51 3.26 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 0.00 110 V 8.68 3.76 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 1.09 0.00 0.00 1.00 0.00 0.00 111 A 8.32 4.09 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 W 8.39 3.96 0.00 3.49 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 0.00 113 R 8.13 3.65 0.00 2.05 1.97 0.00 3.64 0.00 0.00 3.53 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 2.08 0.00 114 N 7.87 4.32 0.00 2.54 2.70 0.00 0.00 7.02 7.82 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 0.00 115 R 7.63 4.00 0.00 0.90 0.72 0.00 2.82 0.00 0.00 2.84 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.95 0.00 116 C 7.71 4.58 0.00 1.74 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 0.00 117 Q 6.53 3.34 0.00 0.93 1.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.52 6.42 0.00 0.00 0.00 0.00 0.00 2.14 2.18 0.00 118 N 8.64 4.17 0.00 2.81 2.85 0.00 0.00 6.96 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 0.00 119 R 7.29 4.39 0.00 1.88 1.83 0.00 3.24 0.00 0.00 3.08 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.56 0.00 120 D 8.34 4.57 0.00 2.62 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 0.00 121 V 8.19 4.50 2.38 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 0.95 0.00 0.00 1.05 0.00 0.00 122 R 8.04 4.05 0.00 1.89 2.02 0.00 3.28 0.00 0.00 3.24 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.76 0.00 123 Q 8.12 3.98 0.00 2.01 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 7.12 0.00 0.00 0.00 0.00 0.00 1.98 1.50 0.00 124 Y 7.82 4.35 0.00 3.23 3.16 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 0.00 125 V 7.88 4.39 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 1.04 0.00 0.00 1.06 0.00 0.00 126 Q 8.03 4.17 0.00 2.04 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.86 0.00 0.00 0.00 0.00 0.00 2.49 2.31 0.00 127 G 8.94 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 C 8.07 4.45 0.00 3.08 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 0.00 129 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 0.00 130 V 7.89 4.01 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.96 0.00 0.00