NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -4 A 4.3311 8.1227 123.5862 51.8592 20.2853 177.1939 -3 M 3.8377 8.4124 117.4408 58.2892 31.9843 176.3940 -2 A 3.9340 8.6365 123.2463 54.5671 19.0984 178.9597 -1 I 3.8904 7.8379 118.1101 64.7711 37.2846 178.7542 0 S 4.1866 8.1006 114.9012 61.2791 62.7753 176.1928 1 N 4.1590 8.0897 120.2156 56.0663 38.2583 177.3882 2 W 4.5078 7.8922 120.1637 59.6739 29.1589 178.7753 3 V 3.6849 8.0704 118.4291 66.1986 30.9693 177.9215 4 N 4.3869 8.3297 116.2658 55.9334 38.2745 177.5176 5 V 3.5458 8.1645 120.3354 66.2047 31.5366 178.1607 6 I 3.5943 7.8926 119.3988 64.3857 36.8833 178.3306 7 S 4.0469 7.9560 113.8932 61.3693 61.6069 176.0892 8 D 4.2820 8.0341 121.6663 57.1848 40.4946 178.5275 9 L 3.8520 7.8744 119.6021 57.6944 41.6215 179.3887 10 K 3.8167 8.1536 119.6038 59.4279 32.0686 178.6577 11 K 3.9023 7.9225 119.6924 59.5223 32.1436 178.6555 12 I 3.6806 8.1517 120.4755 64.6069 36.8512 178.0321 13 E 3.9528 8.2376 118.8679 59.0511 29.6643 177.9915 14 D 4.4704 8.1144 118.1708 57.5820 41.1386 178.4497 15 L 4.0872 7.7511 118.1640 57.3561 41.5639 178.7433 16 I 4.0180 8.0322 111.3069 61.8038 37.5834 177.2026 17 Q 3.8919 7.5824 121.0819 60.3149 28.8799 178.2791 18 S 4.1932 7.8275 114.2582 61.0745 63.6654 174.2984 19 M 4.2272 7.3472 118.9967 55.2020 32.4777 176.1693 20 H 4.6912 7.9975 116.1956 54.1210 29.0161 171.9771 21 I 4.1463 7.9463 122.3286 60.1743 36.6827 175.0692 22 D 4.7383 8.4326 123.7019 52.6283 39.7055 176.5288 23 A 4.1650 7.8406 121.4570 53.0937 18.9074 177.3746 24 T 4.6997 8.2693 110.8172 59.9333 71.0712 173.8090 25 L 4.5791 8.5978 124.0166 52.4673 45.8927 175.2569 26 Y 4.6636 8.6166 120.6157 59.2973 38.4154 176.1759 27 T 4.2650 8.9663 122.0407 61.4881 71.3389 173.8713 28 E 4.2883 8.2958 128.2637 55.2127 29.3997 175.9095 29 S 4.5398 8.5660 122.4735 59.3640 63.4703 174.3756 30 D 4.6319 7.9951 118.6416 52.0945 41.2403 173.6161 31 V 3.9594 8.0188 123.3057 61.8806 32.8908 174.7440 32 H 4.7665 8.4861 126.0186 53.9728 31.1790 174.1034 33 P 4.2747 0.0000 0.0000 65.2092 31.2751 177.8161 34 S 4.5729 7.9799 110.3845 59.1123 63.5087 174.9156 35 C 5.2519 8.6244 118.8694 56.2490 42.7348 175.9658 36 K 3.8863 7.9152 123.3777 60.2802 31.8509 179.1377 37 V 3.9192 8.3858 119.3904 66.0491 31.4562 178.1693 38 T 3.9227 8.6941 115.7276 66.6040 68.2899 176.5206 39 A 4.0614 8.4539 123.0130 55.1360 18.4001 179.2296 40 M 4.0506 8.4516 116.8981 58.9326 32.2980 178.6695 41 K 4.0799 8.2973 118.5336 59.6294 32.1068 178.7288 42 C 4.3444 8.1047 116.5050 59.9418 38.5126 176.0729 43 F 3.9835 8.1791 119.3436 60.4594 38.1200 177.6917 44 L 4.2392 8.1548 117.6862 57.9667 41.7194 179.2823 45 L 4.4563 7.9741 120.1639 57.4544 41.6495 179.3838 46 E 4.1191 8.7148 118.1152 58.5034 29.2508 178.9853 47 L 4.2445 8.2938 121.2349 58.3197 42.3263 178.8653 48 Q 4.1483 8.1393 117.3628 58.3859 28.4544 178.8771 49 V 3.6877 7.5556 119.5402 65.8576 31.5453 177.9076 50 I 3.6494 7.4237 119.4882 64.3785 36.4998 178.2550 51 S 4.0818 8.0326 113.2250 61.4370 62.1370 175.9393 52 L 4.0148 7.5768 120.0155 58.0973 41.5222 179.3363 53 E 4.1377 8.3263 117.4269 58.9674 29.4019 179.2025 54 S 4.3226 7.9982 114.2965 59.2650 63.3622 174.9206 55 G 3.9222 8.4173 109.3295 46.4936 0.0000 173.0091 56 D 4.8503 7.8425 117.3260 51.1480 44.4545 174.6826 57 A 4.0035 8.6352 128.8567 55.7214 18.5699 179.7794 58 S 4.1085 8.0445 112.9428 61.6697 62.9175 176.9888 59 I 3.6839 8.0025 122.4235 64.6301 36.8628 177.5698 60 H 4.1267 8.3759 120.7548 58.9441 29.6179 176.8465 61 D 4.3025 8.5275 120.6503 57.6245 40.5839 178.9939 62 T 3.9048 8.0438 116.3760 66.4213 68.4744 177.1067 63 V 3.5769 8.2760 120.6534 65.8573 31.5556 177.6435 64 E 3.8598 8.3152 119.3015 59.2175 29.4555 178.0708 65 N 4.1679 8.1140 117.0059 56.6765 38.9172 176.2098 66 L 4.0316 7.8309 122.7789 57.7881 42.0818 179.1408 67 I 3.8096 7.8194 119.4586 64.3007 36.9813 178.5831 68 I 3.6637 7.7273 120.7292 64.2132 37.0715 178.3144 69 L 3.7407 7.9270 119.5386 57.7359 41.5080 179.4485 70 A 3.0758 8.0623 120.7518 55.1473 18.5156 179.4595 71 N 4.3766 8.3888 115.3132 56.4076 38.3282 177.1896 72 N 4.3314 7.8284 117.7566 56.6887 39.0787 176.8850 73 S 4.1365 7.6029 116.2637 61.3774 62.6181 176.3979 74 L 4.5297 8.1782 121.1506 56.8651 41.5803 176.6923 75 S 3.8723 7.9027 111.7704 59.6104 61.5057 173.0066 76 S 3.2201 7.6452 121.8734 56.2661 64.8582 172.4432 76 V 2.8701 7.3652 125.3734 60.1661 33.9582 174.1432 81 T 4.4597 8.3019 117.1512 62.0512 69.4490 174.0737 82 E 4.7103 8.7394 126.4559 54.3451 31.5801 175.5672 83 S 4.6607 8.3639 117.5021 57.3590 66.2370 173.8273 84 G 3.9528 8.4961 109.4041 46.9120 0.0000 173.1814 85 C 4.7754 7.5834 113.4304 54.6675 42.7114 174.5556 86 K 4.2943 8.2671 120.8739 56.2867 32.4064 177.4015 87 E 4.0816 9.0766 122.9961 56.5014 30.3753 177.5766 88 C 4.0652 8.7547 119.1345 60.4174 40.3106 175.7150 89 E 2.5400 7.6006 114.9503 56.9708 28.9046 176.9951 90 E 4.2703 7.5155 118.0467 56.5669 30.2060 176.2051 91 L 4.4527 7.2970 119.1005 53.5996 43.1776 176.2804 92 E 4.2514 8.6427 121.0393 56.4218 31.0966 175.0298 93 E 4.9394 8.6970 124.9432 55.3913 30.6762 175.6509 94 K 4.8780 8.8684 123.4668 53.9682 36.9997 175.6634 95 N 4.8433 8.5634 119.1768 52.5126 38.2783 176.1172 96 I 3.8496 8.2278 118.3934 64.1198 36.9773 178.6893 97 K 4.0129 8.1314 120.2941 59.5666 32.2050 178.5995 98 E 4.0481 8.8624 119.1766 59.2948 29.2823 179.1317 99 F 4.3164 8.5769 120.7125 61.5724 39.5884 177.3031 100 L 4.0741 8.5579 118.8689 57.6832 41.4365 179.3228 101 Q 3.9089 8.2054 119.7712 59.2484 28.7426 178.3997 102 S 4.1324 8.1640 116.3214 61.3394 62.9393 176.1684 103 F 3.0040 8.1663 123.8032 60.9365 38.8369 177.3397 104 V 3.4478 7.6313 117.5499 66.3547 31.3622 177.5512 105 H 4.1644 7.7667 115.7114 59.1347 28.5818 177.6652 106 I 3.6765 7.6994 120.1589 63.8053 37.6539 178.2106 107 V 3.1254 7.6269 119.1586 65.7904 31.3093 177.6859 108 Q 3.9368 8.2243 118.2212 59.5929 28.5772 179.2319 109 M 3.9184 7.9610 118.7425 58.4724 32.0906 178.2782 110 F 3.5775 8.0602 118.0147 60.2948 38.7240 177.5040 111 I 3.7834 7.4670 118.2775 64.5752 37.0397 177.3307 112 N 4.4027 8.0146 116.6741 56.3745 38.7549 175.8797 113 T 4.4336 7.1954 106.8097 61.4246 69.4046 174.9464 114 S 4.5222 7.8086 122.8096 59.0502 63.5636 173.6210 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 -4 A 8.12 4.33 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 -3 M 8.41 3.84 0.00 2.11 2.05 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.57 0.00 -2 A 8.64 3.93 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 -1 I 7.84 3.89 2.06 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.96 0.99 0.00 0.00 0 S 8.10 4.19 0.00 4.07 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1 N 8.09 4.16 0.00 2.51 2.37 0.00 0.00 6.93 7.00 0.00 0.00 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 W 7.89 4.51 0.00 3.57 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 3 V 8.07 3.68 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 1.05 0.00 0.00 1.02 0.00 0.00 4 N 8.33 4.39 0.00 2.87 2.80 0.00 0.00 6.65 7.28 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 5 V 8.16 3.55 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.92 0.00 0.00 6 I 7.89 3.59 2.01 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 0.46 0.88 0.00 0.00 7 S 7.96 4.05 0.00 3.90 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 8 D 8.03 4.28 0.00 2.85 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 L 7.87 3.85 0.00 1.67 1.54 0.46 0.15 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 10 K 8.15 3.82 0.00 1.94 1.79 0.00 1.62 0.00 0.00 1.56 0.00 0.00 2.90 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.42 1.43 7.81 11 K 7.92 3.90 0.00 1.93 1.93 0.00 1.69 0.00 0.00 1.63 0.00 0.00 2.94 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.42 1.47 7.81 12 I 8.15 3.68 1.99 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 1.41 0.60 0.96 0.00 0.00 13 E 8.24 3.95 0.00 2.03 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 0.00 2.34 2.34 0.00 14 D 8.11 4.47 0.00 3.04 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 15 L 7.75 4.09 0.00 1.81 1.71 0.92 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 16 I 8.03 4.02 1.88 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 1.60 0.84 0.97 0.00 0.00 17 Q 7.58 3.89 0.00 2.39 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 7.05 0.00 0.00 0.00 0.00 0.00 2.39 2.46 0.00 18 S 7.83 4.19 0.00 3.99 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 19 M 7.35 4.23 0.00 2.02 2.04 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.47 0.00 20 H 8.00 4.69 0.00 3.09 3.21 0.00 5.69 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 I 7.95 4.15 1.87 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 1.47 0.78 0.88 0.00 0.00 22 D 8.43 4.74 0.00 2.76 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 23 A 7.84 4.17 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 24 T 8.27 4.70 4.16 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 1.17 0.00 0.00 25 L 8.60 4.58 0.00 1.08 1.03 -0.13 0.37 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 26 Y 8.62 4.66 0.00 2.78 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 27 T 8.97 4.27 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 1.38 0.00 0.00 28 E 8.30 4.29 0.00 1.85 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 2.31 2.47 0.00 29 S 8.57 4.54 0.00 3.96 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 30 D 8.00 4.63 0.00 2.63 2.54 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 31 V 8.02 3.96 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 0.86 0.00 0.00 1.08 0.00 0.00 32 H 8.49 4.77 0.00 3.24 3.12 0.00 5.93 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 33 P 0.00 4.27 0.00 2.03 1.90 0.00 3.01 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.91 0.00 34 S 7.98 4.57 0.00 4.01 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 35 C 8.62 5.25 0.00 2.94 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 K 7.92 3.89 0.00 1.60 1.84 0.00 0.61 0.00 0.00 1.24 0.00 0.00 2.69 0.00 0.00 2.61 0.00 0.00 0.00 0.00 1.35 1.06 7.81 37 V 8.39 3.92 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 1.14 0.00 0.00 1.15 0.00 0.00 38 T 8.69 3.92 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 1.22 0.00 0.00 39 A 8.45 4.06 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 M 8.45 4.05 0.00 2.34 2.13 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.50 0.00 41 K 8.30 4.08 0.00 2.07 1.89 0.00 1.77 0.00 0.00 1.69 0.00 0.00 3.02 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.52 1.79 7.81 42 C 8.10 4.34 0.00 2.78 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 43 F 8.18 3.98 0.00 2.64 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 44 L 8.15 4.24 0.00 1.83 1.86 1.02 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 45 L 7.97 4.46 0.00 1.77 1.77 0.98 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 46 E 8.71 4.12 0.00 2.21 1.69 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 2.50 2.55 0.00 47 L 8.29 4.24 0.00 2.47 2.11 1.28 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 48 Q 8.14 4.15 0.00 2.26 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.59 0.00 0.00 0.00 0.00 0.00 2.44 2.66 0.00 49 V 7.56 3.69 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 0.93 0.00 0.00 50 I 7.42 3.65 2.09 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.38 0.95 0.00 0.00 51 S 8.03 4.08 0.00 3.93 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 52 L 7.58 4.01 0.00 1.85 1.72 0.98 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 53 E 8.33 4.14 0.00 1.95 1.99 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 0.00 2.32 2.49 0.00 54 S 8.00 4.32 0.00 4.04 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 55 G 8.42 3.92 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 0.00 0.00 0.00 56 D 7.84 4.85 0.00 2.75 2.49 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 57 A 8.64 4.00 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 58 S 8.04 4.11 0.00 4.03 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 59 I 8.00 3.68 2.01 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 0.53 0.94 0.00 0.00 60 H 8.38 4.13 0.00 3.23 3.57 0.00 5.83 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 D 8.53 4.30 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 62 T 8.04 3.90 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 1.18 0.00 0.00 63 V 8.28 3.58 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 1.04 0.00 0.00 0.98 0.00 0.00 64 E 8.32 3.86 0.00 1.98 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 2.27 2.28 0.00 65 N 8.11 4.17 0.00 2.96 3.01 0.00 0.00 6.89 6.02 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 66 L 7.83 4.03 0.00 1.94 1.82 0.72 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 67 I 7.82 3.81 2.01 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.76 0.94 0.00 0.00 68 I 7.73 3.66 1.97 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.68 0.86 0.00 0.00 69 L 7.93 3.74 0.00 1.85 1.46 0.85 0.86 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 70 A 8.06 3.08 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 71 N 8.39 4.38 0.00 2.75 2.86 0.00 0.00 6.72 6.64 0.00 0.00 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 N 7.83 4.33 0.00 2.70 2.85 0.00 0.00 7.28 7.74 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 73 S 7.60 4.14 0.00 3.10 3.43 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 74 L 8.18 4.53 0.00 1.75 1.86 1.01 1.04 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 75 S 7.90 3.87 0.00 3.96 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 76 S 7.65 3.22 0.00 4.00 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 V 7.37 2.87 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 0.76 0.00 0.00 0.93 0.00 0.00 81 T 8.30 4.46 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 82 E 8.74 4.71 0.00 1.95 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 2.24 2.29 0.00 83 S 8.36 4.66 0.00 3.92 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 84 G 8.50 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 85 C 7.58 4.78 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 86 K 8.27 4.29 0.00 1.70 1.69 0.00 1.72 0.00 0.00 1.68 0.00 0.00 3.01 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.42 1.44 7.81 87 E 9.08 4.08 0.00 1.93 1.77 0.00 0.00 0.00 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 2.38 0.00 88 C 8.75 4.07 0.00 2.77 2.99 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 0.00 0.00 0.00 0.00 89 E 7.60 2.54 0.00 1.69 1.73 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 2.21 2.05 0.00 90 E 7.52 4.27 0.00 2.09 1.92 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 2.21 2.17 0.00 91 L 7.30 4.45 0.00 1.66 1.77 0.86 0.64 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 92 E 8.64 4.25 0.00 2.09 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 2.40 2.37 0.00 93 E 8.70 4.94 0.00 1.86 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 2.33 0.00 94 K 8.87 4.88 0.00 1.76 1.85 0.00 1.76 0.00 0.00 1.77 0.00 0.00 3.04 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.38 1.40 7.81 95 N 8.56 4.84 0.00 2.96 2.99 0.00 0.00 5.95 7.75 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 96 I 8.23 3.85 1.92 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 1.62 0.99 1.01 0.00 0.00 97 K 8.13 4.01 0.00 1.87 1.98 0.00 1.76 0.00 0.00 1.85 0.00 0.00 2.96 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.55 1.56 7.81 98 E 8.86 4.05 0.00 2.14 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.61 0.00 99 F 8.58 4.32 0.00 3.26 3.39 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 0.00 100 L 8.56 4.07 0.00 1.86 1.74 1.01 1.32 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 0.00 101 Q 8.21 3.91 0.00 2.18 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.81 0.00 0.00 0.00 0.00 0.00 2.36 2.26 0.00 102 S 8.16 4.13 0.00 4.34 4.18 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 0.00 0.00 0.00 103 F 8.17 3.00 0.00 2.76 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 V 7.63 3.45 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 1.03 0.00 0.00 0.90 0.00 0.00 105 H 7.77 4.16 0.00 3.37 3.29 0.00 5.69 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 0.00 106 I 7.70 3.68 1.71 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.40 0.28 0.00 0.00 107 V 7.63 3.13 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 1.02 0.00 0.00 0.96 0.00 0.00 108 Q 8.22 3.94 0.00 2.33 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.58 0.00 0.00 0.00 0.00 0.00 2.38 2.45 0.00 109 M 7.96 3.92 0.00 2.12 1.95 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.19 0.00 110 F 8.06 3.58 0.00 2.27 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 0.00 111 I 7.47 3.78 2.01 0.00 0.00 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 1.59 0.62 0.96 0.00 0.00 112 N 8.01 4.40 0.00 2.72 2.99 0.00 0.00 7.17 7.86 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 0.00 113 T 7.20 4.43 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 1.07 0.00 0.00 114 S 7.81 4.52 0.00 4.17 4.26 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