NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4392 8.2893 118.1963 54.6929 32.9316 174.9706 2 P 4.4625 0.0000 0.0000 61.8758 30.8375 170.6652 3 E 4.9510 8.3664 117.2839 55.8822 35.6881 177.5824 4 I 4.7534 8.3408 120.4614 60.1271 40.9696 175.5964 5 R 4.8416 8.7265 124.5509 54.3524 33.9155 174.9965 6 L 4.8779 8.4450 120.3171 54.5904 42.9451 175.9262 7 R 4.5808 8.0796 118.8544 57.7501 31.7849 175.3090 8 H 4.8212 7.4337 111.8755 54.4861 31.9187 173.1414 9 V 4.0243 8.4348 120.1425 60.8680 29.9025 176.1214 10 V 3.8673 8.6849 127.3327 65.2248 31.0616 176.3727 11 S 5.0576 8.3917 117.5680 56.0085 66.7571 172.3890 12 C 4.8902 8.2925 115.1803 56.5280 32.5694 173.6717 13 S 4.6900 10.1104 116.2344 56.2367 62.3754 173.8373 14 S 5.9865 7.7141 127.9621 58.5943 63.6493 175.1837 15 Q 5.1793 7.6417 121.7768 55.0713 31.2457 174.7159 16 D 4.9252 8.0792 120.6181 53.3433 43.1060 175.0020 17 S 4.3834 8.2023 112.3323 61.0694 62.9295 176.1494 18 T 3.9421 7.7171 110.7873 64.9823 69.2147 175.2700 19 H 4.5369 7.8081 122.1140 53.5390 27.5071 174.2867 20 C 4.7772 7.5892 118.0315 56.6800 31.8403 175.5802 21 A 4.0878 8.6035 121.1614 54.8743 17.7622 179.1964 22 E 3.9313 8.2212 117.2915 58.8763 29.6818 178.2055 23 N 4.4064 8.2439 116.2881 55.8632 38.2695 176.9865 24 L 4.0793 7.8186 120.1500 57.4683 41.7043 178.9597 25 L 4.1545 7.8450 118.1930 56.1221 42.9348 177.6760 26 K 4.5268 7.8147 118.6304 54.2369 31.5697 176.6748 27 A 4.1721 7.9443 122.4105 54.5442 18.9378 177.9035 28 D 4.8902 7.3092 114.2675 51.9730 40.9934 174.9363 29 T 4.8136 7.2002 113.4274 60.7231 75.7008 173.6597 30 Y 4.9647 7.5854 117.0680 55.3858 39.8460 174.3379 31 R 4.6348 7.7186 116.6720 56.4294 34.2996 174.8728 32 K 4.8365 8.2432 120.2804 54.7513 35.2840 174.8837 33 W 4.9724 8.6042 129.3788 57.8979 32.2664 176.9100 34 R 4.5655 8.3684 123.9655 54.1303 34.2390 174.3199 35 A 3.8578 8.3340 125.7321 52.0580 18.9869 178.4371 36 A 4.1610 9.1453 122.5006 53.8056 18.6653 177.1593 37 K 4.5011 7.3091 111.2365 55.6414 35.8680 174.3364 38 A 5.0143 7.7121 120.7007 51.7602 21.0273 176.2194 39 G 3.8787 8.5659 99.5061 45.8024 0.0000 174.5398 40 E 3.8129 7.7386 119.8391 56.9567 29.0187 178.3990 41 K 4.0520 8.2542 124.9658 57.8681 34.1765 176.0880 42 T 5.0599 7.4444 108.0071 60.7499 71.1603 172.5986 43 I 5.1396 8.7730 119.9167 58.0810 41.0171 174.6148 44 S 5.4337 8.9488 120.0099 57.1220 66.9928 174.1957 45 V 4.2659 8.8931 123.2418 60.9548 33.7628 173.1056 46 V 4.3520 8.5609 127.8092 61.9004 32.5361 174.8205 47 L 5.0207 8.7304 128.1823 53.2349 44.0694 175.8594 48 Q 4.7276 8.9102 123.2556 55.2078 31.6337 174.0141 49 L 5.0423 8.4989 122.8071 52.6614 43.5784 177.3115 50 E 4.2008 8.6251 125.6384 58.4492 29.9987 176.8755 51 K 4.5040 7.7268 115.8264 56.1181 35.8752 175.0310 52 E 4.4765 8.8698 125.2382 56.3136 30.2431 175.0957 53 E 4.6796 9.0456 124.6924 55.3206 34.0565 174.0906 54 Q 4.7569 8.2441 118.2537 54.6221 31.0996 175.2847 55 I 4.5838 8.5898 120.3198 60.8152 39.8281 174.9720 56 H 4.8289 9.2285 126.3986 56.9641 32.3001 174.3167 57 S 4.9868 8.5341 112.8008 57.1096 67.7884 173.5515 58 V 4.8893 9.3400 122.2040 61.4033 35.7908 173.8769 59 D 5.3224 9.0484 122.6968 52.9032 45.2710 174.8885 60 I 4.7081 9.1042 123.5103 59.7635 42.2059 174.0370 61 G 3.5972 6.9602 113.7733 44.2623 0.0000 172.2836 62 N 5.1078 8.8718 122.5930 51.9033 39.9887 174.3219 63 D 5.4484 8.2280 124.6934 51.4576 40.6621 176.2795 64 G 3.3435 8.0072 107.3871 45.2050 0.0000 171.3562 65 S 4.0126 7.2248 114.6961 56.6829 65.4767 173.5784 66 A 4.2331 8.2778 118.0676 53.0890 22.1447 175.7650 67 F 5.4525 8.0922 114.1237 55.8186 41.8745 175.1371 68 V 4.8661 8.7707 122.7949 61.3936 34.3573 173.6541 69 E 5.1796 9.1780 129.2980 53.8571 32.5547 174.7556 70 V 4.8400 8.5203 124.1412 61.3261 34.9974 174.2745 71 L 5.1904 8.8147 127.1782 53.1440 45.1370 175.6731 72 V 4.5997 7.8835 113.2634 59.5507 35.5938 174.9720 73 G 2.8192 7.0091 108.2838 45.9356 0.0000 171.8551 74 S 5.5679 8.4290 114.4515 56.0270 65.0748 174.1549 75 S 4.3058 9.2701 116.7958 59.1942 63.0759 174.6968 76 A 3.9129 7.6591 125.1574 53.6306 19.0748 176.1067 77 G 3.7683 9.6689 111.6965 43.5651 0.0000 173.9401 78 G 3.6276 8.9498 105.8513 45.7557 0.0000 173.8596 79 A 4.2431 7.9754 122.8519 53.8010 19.8597 177.7614 80 G 4.2728 7.6152 100.5307 44.3421 0.0000 171.5386 81 E 4.4732 8.6095 115.5592 56.5235 29.4622 177.0329 82 Q 4.5797 8.0796 114.9928 55.9074 29.5046 175.0891 83 D 4.8583 8.1199 116.6356 54.7380 41.6053 175.1907 84 Y 4.4110 7.9818 114.7579 55.5637 41.0428 174.5018 85 E 4.5174 8.1996 117.8725 54.3670 32.6700 175.5165 86 V 4.0199 8.5260 123.4558 63.4678 29.9742 175.1592 87 L 4.1994 8.4078 128.6930 56.9711 43.3098 176.1338 88 L 4.9736 8.0629 119.7661 53.8953 43.3645 176.2859 89 V 4.1169 8.5770 117.3270 61.3278 32.9855 174.9921 90 T 4.3670 8.5478 116.4086 62.6192 67.9679 173.3135 91 S 4.7537 9.3191 124.1697 56.5562 65.3520 173.1701 92 S 4.9384 8.4856 119.7080 58.0554 63.1260 172.9413 93 F 4.9471 9.0582 123.3798 58.8362 40.8129 175.2973 94 M 4.8559 7.7951 115.4905 53.2692 34.6346 173.4407 95 S 4.6358 8.2954 113.2938 56.4650 66.0496 172.2771 96 P 4.7386 0.0000 0.0000 63.0822 31.4350 175.9139 97 S 4.5597 8.0852 114.7979 60.5586 64.8337 176.5004 98 E 4.1045 8.0390 117.6488 58.8238 29.5661 178.9737 99 S 3.8746 7.2305 114.3189 60.7172 62.6244 174.8120 100 R 4.0055 7.1278 120.6067 56.7528 29.9660 176.8908 101 S 4.5197 7.7048 116.0051 57.4129 63.2123 175.9600 102 G 4.0277 8.2479 109.2531 46.1193 0.0000 173.7965 103 S 4.1512 7.4615 113.6356 56.9585 64.1687 172.3864 104 N 4.2320 8.8696 118.7158 53.2122 36.1019 172.8541 105 P 4.5414 0.0000 0.0000 63.5955 33.1891 175.5856 106 N 5.0482 7.7464 117.5385 52.4170 43.2094 173.5851 107 R 4.8882 8.6315 121.2788 54.9875 35.2967 174.2450 108 V 4.6667 8.2904 114.6324 59.7866 34.5030 175.0017 109 R 4.4839 8.2910 122.0184 54.7841 34.8106 173.3484 110 M 5.2499 7.7984 118.2282 54.3691 36.7053 174.2698 111 F 4.9209 9.9305 117.2386 56.1770 43.3897 174.6662 112 G 4.6008 8.5032 109.9297 44.3521 0.0000 172.6817 113 P 4.0830 0.0000 0.0000 65.6706 31.8755 178.4191 114 D 4.3551 8.0960 117.3449 56.6136 41.2622 176.5604 115 K 4.4923 7.5983 116.1514 56.1688 32.3831 176.3161 116 L 5.0782 7.6231 119.7216 53.0947 43.0236 176.8916 117 V 3.7393 8.3951 121.7335 62.0259 31.9258 177.5450 118 R 3.8277 8.7778 122.9666 59.1844 29.8738 178.8839 119 A 4.0780 8.1788 118.8631 54.0998 18.4852 178.0820 120 A 4.8085 7.8981 117.1411 53.9539 20.7551 178.1012 121 A 3.8395 8.7128 121.2695 55.5342 18.4724 178.8730 122 E 4.3054 7.9790 110.6371 57.0138 29.9160 176.4976 123 K 4.1691 8.7248 121.8793 55.0583 33.9879 176.1713 124 R 3.9935 8.0648 123.5721 56.3803 30.4034 175.9412 125 W 4.9704 9.1519 124.4418 54.5947 33.0771 175.9846 126 D 5.1299 8.5262 117.2404 53.1958 41.2410 174.6177 127 R 5.1461 8.6271 117.5115 55.1567 35.0612 174.4461 128 V 4.7654 9.0588 121.3684 59.9264 35.4373 174.1251 129 K 4.4805 8.8687 124.9222 54.9751 34.0516 174.6537 130 I 4.7503 8.3923 129.7674 59.7948 39.1625 175.1733 131 V 4.8617 8.7296 127.3649 61.2753 34.2110 174.0245 132 C 5.1730 9.4621 129.2576 58.9506 33.5533 172.2264 133 S 5.0652 10.0965 118.8178 55.7017 65.8604 171.4208 134 Q 5.2057 7.9586 132.0472 54.6392 32.1287 171.3956 135 P 5.0671 0.0000 0.0000 61.2903 30.3474 174.7241 136 Y 4.6607 6.9626 121.1452 56.4070 39.8191 175.2607 137 S 4.9604 6.7737 116.3524 57.6862 66.1557 172.0543 138 K 4.2483 8.2072 122.9696 57.1174 37.3457 175.4140 139 D 4.7724 8.4198 116.4630 53.7908 41.0923 176.3265 140 S 4.7692 7.7843 113.2622 55.4797 64.8808 172.0086 141 P 5.1761 0.0000 0.0000 61.9457 32.8480 175.2139 142 F 4.3359 7.1270 114.8421 58.9751 44.5960 175.3475 143 G 4.3180 7.3870 116.9160 47.0972 0.0000 174.7993 144 L 5.3174 5.6200 121.5202 53.0212 44.9202 177.5152 145 S 4.5140 8.6691 117.7905 60.8227 63.8393 174.1782 146 F 4.7270 6.9601 112.6409 56.7001 40.2159 173.2736 147 V 4.8897 8.4950 111.6265 60.0494 35.4018 174.9567 148 R 4.5866 9.2359 122.7294 54.9656 35.2231 173.8314 149 F 5.4794 8.4358 117.4926 56.6934 44.1240 173.5220 150 H 5.1429 9.0707 115.9660 54.6725 32.1377 173.9775 151 S 4.5060 8.8099 116.1338 58.5475 63.2458 173.8434 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 1 M 8.29 4.44 0.00 2.15 2.16 0.00 0.00 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.55 0.00 2 P 0.00 4.46 0.00 2.30 2.16 0.00 3.72 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 1.97 2.06 0.00 3 E 8.37 4.95 0.00 1.84 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.35 0.00 4 I 8.34 4.75 2.18 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 1.29 0.74 1.07 0.00 0.00 5 R 8.73 4.84 0.00 1.76 1.82 0.00 3.13 0.00 0.00 3.36 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.65 0.00 6 L 8.45 4.88 0.00 1.55 1.61 1.22 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 7 R 8.08 4.58 0.00 1.75 1.69 0.00 3.44 0.00 0.00 3.34 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.61 0.00 8 H 7.43 4.82 0.00 3.19 3.37 0.00 5.50 0.00 0.00 0.00 0.00 6.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 V 8.43 4.02 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 0.83 0.00 0.00 0.96 0.00 0.00 10 V 8.68 3.87 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 0.91 0.00 0.00 0.98 0.00 0.00 11 S 8.39 5.06 0.00 3.72 3.68 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 12 C 8.29 4.89 0.00 2.95 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 13 S 10.11 4.69 0.00 3.83 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 14 S 7.71 5.99 0.00 4.64 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 Q 7.64 5.18 0.00 2.40 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.99 6.74 0.00 0.00 0.00 0.00 0.00 2.43 2.59 0.00 16 D 8.08 4.93 0.00 2.62 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 17 S 8.20 4.38 0.00 3.88 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 18 T 7.72 3.94 4.15 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 1.21 0.00 0.00 19 H 7.81 4.54 0.00 3.14 3.28 0.00 5.69 0.00 0.00 0.00 0.00 6.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 C 7.59 4.78 0.00 3.17 3.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 A 8.60 4.09 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 E 8.22 3.93 0.00 2.06 1.97 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 2.38 2.41 0.00 23 N 8.24 4.41 0.00 3.11 2.90 0.00 0.00 7.01 6.51 0.00 0.00 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 L 7.82 4.08 0.00 1.61 1.71 0.58 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 25 L 7.84 4.15 0.00 1.83 1.74 0.97 0.75 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 26 K 7.81 4.53 0.00 1.65 1.66 0.00 1.69 0.00 0.00 1.64 0.00 0.00 2.91 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.31 1.42 7.81 27 A 7.94 4.17 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 28 D 7.31 4.89 0.00 2.64 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 T 7.20 4.81 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 1.24 0.00 0.00 30 Y 7.59 4.96 0.00 3.11 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 31 R 7.72 4.63 0.00 1.42 1.76 0.00 3.17 0.00 0.00 2.99 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.16 0.00 32 K 8.24 4.84 0.00 1.74 2.02 0.00 1.78 0.00 0.00 1.73 0.00 0.00 2.82 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.55 1.45 7.81 33 W 8.60 4.97 0.00 3.40 3.31 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 34 R 8.37 4.57 0.00 1.83 1.52 0.00 2.81 0.00 0.00 2.98 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.56 0.00 35 A 8.33 3.86 1.13 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 0.00 0.00 0.00 0.00 0.00 0.00 36 A 9.15 4.16 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 37 K 7.31 4.50 0.00 1.85 1.76 0.00 1.59 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.29 1.33 7.81 38 A 7.71 5.01 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 39 G 8.57 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 40 E 7.74 3.81 0.00 1.21 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 2.65 2.27 0.00 41 K 8.25 4.05 0.00 1.74 1.71 0.00 1.73 0.00 0.00 1.85 0.00 0.00 2.87 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.41 1.37 7.81 42 T 7.44 5.06 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 1.25 0.00 0.00 43 I 8.77 5.14 1.95 0.00 0.00 -0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 2.24 0.74 0.00 0.00 44 S 8.95 5.43 0.00 3.80 3.77 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 0.00 0.00 0.00 45 V 8.89 4.27 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 0.00 0.00 -0.33 0.00 0.00 0.38 0.00 0.00 46 V 8.56 4.35 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 0.89 0.00 0.00 0.74 0.00 0.00 47 L 8.73 5.02 0.00 1.77 1.56 0.99 0.58 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 48 Q 8.91 4.73 0.00 2.09 1.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.68 6.78 0.00 0.00 0.00 0.00 0.00 2.42 2.55 0.00 49 L 8.50 5.04 0.00 1.63 1.69 0.96 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 50 E 8.63 4.20 0.00 2.03 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.30 0.00 51 K 7.73 4.50 0.00 1.78 1.72 0.00 1.67 0.00 0.00 1.64 0.00 0.00 2.92 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.35 1.38 7.81 52 E 8.87 4.48 0.00 1.98 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 2.23 2.46 0.00 53 E 9.05 4.68 0.00 2.07 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 2.21 2.41 0.00 54 Q 8.24 4.76 0.00 1.97 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.76 0.00 0.00 0.00 0.00 0.00 2.21 2.15 0.00 55 I 8.59 4.58 1.91 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.48 0.93 0.00 0.00 56 H 9.23 4.83 0.00 3.17 3.36 0.00 5.91 0.00 0.00 0.00 0.00 6.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 S 8.53 4.99 0.00 3.98 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 58 V 9.34 4.89 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 1.16 0.00 0.00 1.12 0.00 0.00 59 D 9.05 5.32 0.00 2.86 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 60 I 9.10 4.71 2.20 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.47 0.94 0.00 0.00 61 G 6.96 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 62 N 8.87 5.11 0.00 2.66 2.75 0.00 0.00 6.26 7.04 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 63 D 8.23 5.45 0.00 2.90 2.77 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 0.00 0.00 0.00 64 G 8.01 3.34 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 0.00 65 S 7.22 4.01 0.00 4.05 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 66 A 8.28 4.23 0.65 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 67 F 8.09 5.45 0.00 3.15 2.86 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 0.00 0.00 0.00 0.00 68 V 8.77 4.87 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 1.21 0.00 0.00 69 E 9.18 5.18 0.00 2.13 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.23 0.00 70 V 8.52 4.84 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 0.86 0.00 0.00 0.77 0.00 0.00 71 L 8.81 5.19 0.00 1.55 1.52 0.86 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 72 V 7.88 4.60 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 0.40 0.00 0.00 0.30 0.00 0.00 73 G 7.01 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 0.00 0.00 0.00 74 S 8.43 5.57 0.00 3.96 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 75 S 9.27 4.31 0.00 4.07 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 76 A 7.66 3.91 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 77 G 9.67 3.77 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 0.00 0.00 0.00 0.00 0.00 0.00 78 G 8.95 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 79 A 7.98 4.24 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 80 G 7.62 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 0.00 0.00 0.00 81 E 8.61 4.47 0.00 1.87 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.27 0.00 82 Q 8.08 4.58 0.00 2.01 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 7.58 0.00 0.00 0.00 0.00 0.00 2.22 2.28 0.00 83 D 8.12 4.86 0.00 2.70 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 84 Y 7.98 4.41 0.00 2.75 2.79 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 85 E 8.20 4.52 0.00 1.84 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 1.49 1.66 0.00 86 V 8.53 4.02 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 0.67 0.00 0.00 0.89 0.00 0.00 87 L 8.41 4.20 0.00 1.63 1.65 0.90 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 88 L 8.06 4.97 0.00 1.81 1.81 0.54 0.33 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 V 8.58 4.12 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.95 0.00 0.00 90 T 8.55 4.37 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 1.04 0.00 0.00 91 S 9.32 4.75 0.00 3.13 4.21 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 92 S 8.49 4.94 0.00 4.07 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 93 F 9.06 4.95 0.00 2.89 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 94 M 7.80 4.86 0.00 1.81 2.06 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.40 0.00 95 S 8.30 4.64 0.00 3.91 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 96 P 0.00 4.74 0.00 2.22 2.29 0.00 3.68 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 1.97 2.00 0.00 97 S 8.09 4.56 0.00 3.86 3.86 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 0.00 0.00 0.00 0.00 98 E 8.04 4.10 0.00 2.15 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 0.00 2.28 2.35 0.00 99 S 7.23 3.87 0.00 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 0.00 100 R 7.13 4.01 0.00 1.96 1.80 0.00 3.19 0.00 0.00 3.14 7.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.53 0.00 101 S 7.70 4.52 0.00 3.75 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 0.00 102 G 8.25 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 0.00 103 S 7.46 4.15 0.00 3.75 3.64 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 0.00 0.00 0.00 0.00 104 N 8.87 4.23 0.00 2.82 2.84 0.00 0.00 5.83 8.04 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 0.00 105 P 0.00 4.54 0.00 2.01 2.23 0.00 3.84 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.78 0.00 106 N 7.75 5.05 0.00 2.59 2.69 0.00 0.00 6.73 7.77 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 0.00 107 R 8.63 4.89 0.00 1.60 1.67 0.00 3.15 0.00 0.00 3.13 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.57 0.00 108 V 8.29 4.67 2.34 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 0.88 0.00 0.00 1.00 0.00 0.00 109 R 8.29 4.48 0.00 0.67 0.66 0.00 2.84 0.00 0.00 2.55 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 1.25 0.00 110 M 7.80 5.25 0.00 2.32 1.92 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.76 0.00 111 F 9.93 4.92 0.00 2.96 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 0.00 112 G 8.50 4.60 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 0.00 113 P 0.00 4.08 0.00 2.17 1.89 0.00 3.74 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 1.97 0.00 114 D 8.10 4.36 0.00 2.69 2.79 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 0.00 115 K 7.60 4.49 0.00 1.92 2.15 0.00 1.91 0.00 0.00 1.82 0.00 0.00 3.08 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.63 1.48 7.81 116 L 7.62 5.08 0.00 1.71 1.62 1.00 0.76 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 0.00 117 V 8.40 3.74 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 0.92 0.00 0.00 1.00 0.00 0.00 118 R 8.78 3.83 0.00 1.90 2.04 0.00 3.15 0.00 0.00 3.36 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.71 0.00 119 A 8.18 4.08 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 0.00 120 A 7.90 4.81 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 0.00 121 A 8.71 3.84 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 E 7.98 4.31 0.00 2.02 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 0.00 2.41 2.39 0.00 123 K 8.72 4.17 0.00 1.39 0.94 0.00 1.94 0.00 0.00 1.53 0.00 0.00 2.78 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.33 1.67 7.81 124 R 8.06 3.99 0.00 1.42 1.72 0.00 3.02 0.00 0.00 3.13 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.50 0.00 125 W 9.15 4.97 0.00 3.11 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 0.00 126 D 8.53 5.13 0.00 2.74 2.79 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 0.00 127 R 8.63 5.15 0.00 1.84 2.07 0.00 3.27 0.00 0.00 3.32 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.60 0.00 128 V 9.06 4.77 1.67 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 0.93 0.00 0.00 0.71 0.00 0.00 129 K 8.87 4.48 0.00 1.34 1.49 0.00 1.40 0.00 0.00 1.53 0.00 0.00 2.76 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.19 1.13 7.81 130 I 8.39 4.75 1.81 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.92 0.92 0.00 0.00 131 V 8.73 4.86 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 1.09 0.00 0.00 0.92 0.00 0.00 132 C 9.46 5.17 0.00 3.39 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 0.00 133 S 10.10 5.07 0.00 4.01 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 0.00 134 Q 7.96 5.21 0.00 1.96 2.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.86 6.61 0.00 0.00 0.00 0.00 0.00 2.25 2.18 0.00 135 P 0.00 5.07 0.00 2.15 2.01 0.00 3.41 0.00 0.00 4.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.91 0.00 136 Y 6.96 4.66 0.00 2.93 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 0.00 137 S 6.77 4.96 0.00 3.97 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 0.00 138 K 8.21 4.25 0.00 1.63 1.73 0.00 1.72 0.00 0.00 1.74 0.00 0.00 3.01 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.21 1.30 7.81 139 D 8.42 4.77 0.00 2.78 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 0.00 140 S 7.78 4.77 0.00 4.14 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 0.00 141 P 0.00 5.18 0.00 2.11 2.15 0.00 3.32 0.00 0.00 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.87 0.00 142 F 7.13 4.34 0.00 3.42 3.12 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 0.00 143 G 7.39 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 0.00 0.00 0.00 0.00 144 L 5.62 5.32 0.00 1.91 1.62 1.21 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 0.00 0.00 0.00 0.00 0.00 0.00 145 S 8.67 4.51 0.00 3.71 4.20 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 0.00 146 F 6.96 4.73 0.00 3.13 3.18 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 0.00 147 V 8.49 4.89 1.82 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 0.72 0.00 0.00 0.84 0.00 0.00 148 R 9.24 4.59 0.00 1.71 1.77 0.00 3.05 0.00 0.00 3.10 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.82 0.00 149 F 8.44 5.48 0.00 3.02 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 0.00 150 H 9.07 5.14 0.00 3.32 3.42 0.00 5.45 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 151 S 8.81 4.51 0.00 4.04 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