NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.4344 8.2649 123.5887 52.2000 20.1757 176.1157 2 T 4.3095 8.5014 118.9880 62.5705 70.1320 172.5080 3 K 5.3301 8.9773 125.1664 54.9273 37.3750 174.4970 4 A 5.3554 9.0461 123.3124 51.0398 23.4544 175.1384 5 V 4.9890 8.7126 117.1383 61.0677 35.4153 173.2896 6 C 4.9253 9.1295 121.8019 58.1478 35.5681 172.6101 7 V 4.5648 8.4627 126.0897 61.4547 33.0188 174.1909 8 L 4.8530 8.8811 129.4863 53.9919 43.0116 176.2673 9 K 4.8226 9.0593 122.1526 55.6346 37.1230 176.2421 10 G 4.5213 7.9046 108.3056 46.0102 0.0000 172.4263 11 D 4.5825 8.8214 118.4279 55.5969 41.9302 176.7462 12 G 4.3213 7.6139 109.1413 44.3549 0.0000 171.3839 13 P 4.4794 0.0000 0.0000 63.1521 32.0864 176.0034 14 V 4.3278 7.5357 120.6134 62.6437 32.1305 174.9789 15 Q 4.8366 8.6251 124.9950 55.3593 32.4540 173.6578 16 G 4.2240 8.3138 107.0718 46.2058 0.0000 171.8386 17 I 5.1193 8.0695 119.4649 59.4064 40.6251 175.1488 18 I 4.6276 8.7959 127.6971 59.4505 40.3495 174.4453 19 N 5.0118 8.3047 123.7931 51.3797 41.4085 173.8561 20 F 5.3600 8.7763 119.3177 55.8878 43.4666 173.6852 21 E 5.2371 9.6985 122.6431 54.8282 33.6711 173.8038 22 Q 4.8455 9.4873 127.5247 54.2990 31.0779 175.8558 23 K 4.1120 8.9458 127.1886 58.7066 32.7218 177.6768 24 E 4.7529 7.7551 116.5670 53.9771 33.4502 174.8408 25 S 4.2502 8.7893 118.0160 60.5905 63.2135 173.8326 26 N 4.1496 9.0139 119.9218 53.9684 36.2077 174.4818 27 G 3.9868 7.9512 108.1007 43.7656 0.0000 171.9971 28 P 4.4984 0.0000 0.0000 62.1874 32.2223 176.4739 29 V 4.5884 8.8696 123.5465 61.2499 33.5144 174.5069 30 K 4.8182 9.1743 130.4047 55.8597 33.8114 175.4362 31 V 4.8467 9.1503 127.4980 60.8716 34.3008 174.1359 32 W 6.0946 7.8040 123.9533 55.2681 31.8826 175.5851 33 G 3.6054 7.6574 106.4084 46.1927 0.0000 170.7141 34 S 5.1333 7.6368 113.3449 56.7755 66.5977 174.4250 35 I 5.1348 8.7152 125.7877 59.3733 40.9827 174.7071 36 K 4.7966 9.2675 125.6345 55.6467 36.0221 176.9807 37 G 3.7680 8.8737 106.7674 45.6325 0.0000 173.4459 38 L 4.4615 7.6536 119.8258 53.0168 43.0341 176.5547 39 T 4.3058 8.1648 111.3115 61.1036 69.4874 173.9960 40 E 4.1187 8.5772 124.4871 57.9289 30.4023 175.6109 41 G 3.7906 8.7447 110.5581 43.8812 0.0000 172.1687 42 L 4.8564 8.1492 118.4334 54.7712 42.8168 176.5396 43 H 5.0313 9.3088 119.6209 53.6698 32.8658 173.5238 44 G 4.0502 9.1475 110.6642 46.7249 0.0000 172.7381 45 F 5.3931 8.7651 124.5232 57.4393 42.3648 172.8520 46 H 5.0377 8.8634 122.6793 54.1912 33.9737 172.6461 47 V 4.4131 8.6301 120.8849 62.5795 32.6410 175.0547 48 H 5.1653 9.2571 125.2703 54.3099 30.9526 175.8062 49 E 3.7006 8.7833 122.0005 58.9558 29.6969 177.1535 50 F 4.9682 7.7890 118.1947 55.7648 41.2024 176.3757 51 G 4.2278 8.4452 113.5791 44.6010 0.0000 174.0498 52 D 4.7688 7.9860 118.0049 52.6101 42.9404 174.2688 53 N 5.1093 8.5276 124.6124 53.4595 39.3848 176.1317 54 T 3.8670 8.5477 109.7013 63.6646 68.6826 174.7083 55 A 4.6333 8.1096 124.7459 51.4188 20.1159 177.4054 56 G 3.8563 7.9327 111.0487 47.0292 0.0000 174.3717 57 C 4.3963 8.5803 114.6299 59.8275 34.3429 175.5979 58 T 3.7487 7.9398 114.7194 65.1147 66.7235 175.6671 59 S 4.3522 7.8819 115.1794 60.3650 63.1644 175.5482 60 A 4.5654 7.5542 124.7566 53.7661 18.3853 178.5918 61 G 4.1181 8.2239 105.5047 44.3159 0.0000 170.9582 62 P 4.6924 0.0000 0.0000 61.9424 33.7034 175.3213 63 H 4.4038 8.4089 116.4768 55.7237 29.5902 175.5962 64 F 4.2830 9.1200 125.1256 58.0150 40.2692 175.1699 65 N 5.1110 7.8861 125.9956 51.7151 38.8870 173.0297 66 P 4.2166 0.0000 0.0000 64.9037 32.2009 177.8933 67 L 4.2949 7.6073 116.8682 53.8622 42.1474 176.0947 68 S 3.6267 7.5627 113.6099 59.7485 60.5698 171.8568 69 R 4.5203 8.0932 117.8503 54.3335 32.2201 176.7604 70 K 4.3387 8.8155 118.6944 56.2053 33.4244 176.5827 71 H 3.9642 8.6511 123.4395 56.7487 30.4683 174.8084 72 G 4.2151 7.4852 110.2944 44.9281 0.0000 171.9989 73 G 4.1161 8.9512 109.2985 43.5298 0.0000 173.3487 74 P 4.3850 0.0000 0.0000 65.3284 31.3299 177.6388 75 K 4.2344 7.9403 115.8688 57.1035 32.4953 176.3907 76 D 4.7550 7.7410 119.4953 52.9643 41.9954 176.4057 77 E 3.8887 8.7235 123.5761 58.8983 29.9670 176.4705 78 E 4.2598 7.9929 121.5819 55.4110 28.8697 174.7710 79 R 4.7547 7.6307 120.1605 55.7577 32.3025 174.6528 80 H 4.4473 9.0023 116.7201 55.3933 29.4127 177.0726 81 V 3.4527 8.2463 122.0991 66.3598 31.3816 177.2707 82 G 3.9133 8.2491 104.5411 47.1713 0.0000 173.2818 83 D 4.9942 8.2016 121.3659 53.7528 40.4368 175.8544 84 L 4.5600 8.4557 122.6572 52.9841 42.6953 178.3818 85 G 4.0796 8.4826 109.5686 46.5454 0.0000 174.5275 86 N 5.6510 8.6911 120.4137 51.3212 42.1010 173.1962 87 V 4.3768 8.5491 114.2838 59.9399 35.1587 174.8616 88 T 5.0191 8.2350 118.9041 61.8569 71.1571 173.0461 89 A 4.7930 9.0001 129.4502 50.8159 21.0661 177.1405 90 D 4.8186 8.6892 121.4726 51.8931 41.5367 177.0645 91 K 3.8863 8.5038 119.1089 59.7617 32.1059 177.4041 92 D 4.4577 8.1361 115.9666 54.8758 41.2311 176.8790 93 G 4.3508 8.6898 108.6832 44.3762 0.0000 172.4285 94 V 4.8608 8.2178 119.7847 60.7389 33.9257 174.2121 95 A 5.2017 8.8665 130.1198 49.6567 21.0765 175.1949 96 D 4.9863 8.6587 123.4911 53.4314 41.8408 176.2476 97 V 3.9893 8.6227 125.3536 61.8403 33.2452 175.2478 98 S 4.6728 8.4241 122.8069 57.8266 64.0084 172.8725 99 I 4.8141 9.1990 128.3876 59.3822 41.1832 174.4577 100 E 5.2800 8.8679 124.4040 54.7003 32.3593 174.9565 101 D 4.8093 9.2817 122.9336 52.8650 44.7910 175.6020 102 S 4.7146 8.8565 119.3151 58.4910 64.0577 175.9107 103 V 3.8015 8.1172 121.2093 65.0978 31.7656 176.5938 104 I 4.0223 7.8085 111.4923 61.2430 38.0725 174.5794 105 S 4.6761 8.4094 114.4006 57.4088 65.4992 174.1284 106 L 4.4716 8.8544 122.2837 54.2862 41.6323 176.3515 107 S 4.5223 7.7320 112.5724 57.8383 66.5114 175.1314 108 G 3.8822 8.5496 109.0562 44.7974 0.0000 173.6533 109 D 4.4796 8.6948 117.0427 56.0981 39.6074 176.5136 110 H 5.0152 8.1469 116.3526 55.5570 28.9470 173.9874 111 C 4.4559 8.0486 121.1035 59.8116 31.8043 173.5491 112 I 3.8827 8.1647 118.9768 60.5717 38.0804 175.7256 113 I 3.7176 7.2199 122.9670 62.7173 37.5554 176.3059 114 G 3.7960 9.3713 112.8630 45.5011 0.0000 172.9515 115 R 4.8673 7.4357 119.1949 54.6942 33.7810 174.5420 116 T 4.9461 7.9696 115.6320 62.0145 71.3261 173.6616 117 L 4.7684 8.5757 128.4557 53.9979 44.0458 175.3589 118 V 4.9815 8.6687 125.5292 60.9732 35.1567 174.2112 119 V 5.1367 8.6486 126.6684 60.4599 33.8845 174.7121 120 H 5.2910 8.8795 120.9375 54.0992 30.9481 174.7493 121 E 4.1825 9.3100 121.3798 59.2579 29.7236 177.0139 122 K 4.7212 8.2772 117.5666 53.9556 35.5145 175.5650 123 A 4.5499 8.3661 123.0314 52.1985 19.2072 176.6866 124 D 4.8033 9.3549 121.7269 53.6924 41.5402 176.0058 125 D 4.6111 9.3336 125.2481 53.0346 39.7083 176.8400 126 L 3.4831 9.9000 119.1734 56.1407 39.5804 175.9973 127 G 3.9986 8.5557 104.7402 45.9668 0.0000 174.8331 128 K 4.5029 8.0330 116.8158 56.0149 32.6341 177.2783 129 G 3.7307 7.9767 108.2148 44.8806 0.0000 175.8358 130 G 3.8078 8.2813 107.3534 45.7312 0.0000 172.5827 131 N 5.1405 7.4157 115.2190 50.0400 40.2097 174.4632 132 E 4.1172 8.5550 115.9245 59.1971 30.1134 179.0672 133 E 4.0712 8.1328 118.8353 58.7413 29.2820 178.6602 134 S 4.1392 8.2868 114.0802 61.4000 62.2121 175.3996 135 T 4.6262 7.4252 109.2866 61.5235 68.6066 175.2595 136 K 4.2788 7.7719 118.7999 58.3250 34.5708 177.1647 137 T 4.0591 8.0062 106.3665 60.0773 70.2369 175.2798 138 G 3.7759 8.1433 110.3766 45.6386 0.0000 173.5817 139 N 4.3210 8.0197 114.7190 53.9701 36.7687 175.8856 140 A 4.0128 7.6210 119.5547 52.5513 19.3896 180.0637 141 G 4.0912 7.3347 104.2773 45.1996 0.0000 173.6813 142 S 4.4030 8.7362 115.7466 58.8685 64.6183 173.8936 143 R 4.4966 8.3554 120.7472 55.2002 30.0426 176.4695 144 L 4.3497 8.8956 125.6552 57.2594 43.1535 177.0204 145 A 4.9952 7.6869 117.8740 51.4428 22.8544 173.9458 146 C 5.5594 8.4299 113.1340 56.1150 46.8233 172.6726 147 G 4.6488 8.0094 104.3008 46.2955 0.0000 172.5283 148 V 4.4905 8.2831 120.6019 62.2193 32.8797 175.4215 149 I 4.1756 8.6909 129.1420 60.8087 38.1117 175.2331 150 G 4.4037 8.9256 114.8040 43.8981 0.0000 172.3705 151 I 4.2533 8.3404 122.1873 61.2086 37.5846 175.4436 152 A 4.9305 8.5127 128.3385 49.6163 22.0277 176.4635 153 Q 4.1043 8.4980 115.9364 56.5113 28.9242 176.1906 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 A 8.26 4.43 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 2 T 8.50 4.31 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 1.23 0.00 0.00 3 K 8.98 5.33 0.00 1.71 1.71 0.00 1.88 0.00 0.00 1.94 0.00 0.00 3.09 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.56 1.50 7.81 4 A 9.05 5.36 1.11 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 5 V 8.71 4.99 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 0.80 0.00 0.00 0.94 0.00 0.00 6 C 9.13 4.93 0.00 3.12 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 7 V 8.46 4.56 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 0.94 0.00 0.00 0.92 0.00 0.00 8 L 8.88 4.85 0.00 1.83 1.59 1.05 0.38 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 9 K 9.06 4.82 0.00 1.66 1.62 0.00 1.67 0.00 0.00 1.65 0.00 0.00 2.81 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.35 1.39 7.81 10 G 7.90 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 11 D 8.82 4.58 0.00 2.68 2.73 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 12 G 7.61 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 13 P 0.00 4.48 0.00 2.18 2.16 0.00 3.76 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 1.94 0.00 14 V 7.54 4.33 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 0.79 0.00 0.00 0.94 0.00 0.00 15 Q 8.63 4.84 0.00 2.14 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.40 0.00 0.00 0.00 0.00 0.00 2.39 2.31 0.00 16 G 8.31 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 17 I 8.07 5.12 1.82 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 1.20 1.33 0.82 0.00 0.00 18 I 8.80 4.63 1.84 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 1.18 0.47 0.00 0.00 19 N 8.30 5.01 0.00 1.44 1.46 0.00 0.00 6.46 8.17 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 20 F 8.78 5.36 0.00 2.93 2.94 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 21 E 9.70 5.24 0.00 2.45 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 2.31 2.39 0.00 22 Q 9.49 4.85 0.00 2.17 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.58 0.00 0.00 0.00 0.00 0.00 2.46 2.64 0.00 23 K 8.95 4.11 0.00 1.81 1.88 0.00 1.74 0.00 0.00 1.71 0.00 0.00 2.85 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.47 1.49 7.81 24 E 7.76 4.75 0.00 1.98 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 2.30 2.32 0.00 25 S 8.79 4.25 0.00 3.86 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 26 N 9.01 4.15 0.00 2.85 2.89 0.00 0.00 7.05 7.65 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 27 G 7.95 3.99 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 0.00 0.00 0.00 28 P 0.00 4.50 0.00 1.99 2.15 0.00 3.73 0.00 0.00 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.95 0.00 29 V 8.87 4.59 2.32 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 1.27 0.00 0.00 1.06 0.00 0.00 30 K 9.17 4.82 0.00 1.91 1.82 0.00 1.37 0.00 0.00 1.12 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.61 1.39 7.81 31 V 9.15 4.85 2.16 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 0.77 0.00 0.00 1.08 0.00 0.00 32 W 7.80 6.09 0.00 3.50 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 33 G 7.66 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 34 S 7.64 5.13 0.00 3.83 3.62 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 35 I 8.72 5.13 1.79 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 1.27 0.48 0.88 0.00 0.00 36 K 9.27 4.80 0.00 1.74 1.88 0.00 1.33 0.00 0.00 1.64 0.00 0.00 2.85 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.47 1.34 7.81 37 G 8.87 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 38 L 7.65 4.46 0.00 1.82 1.41 0.80 0.16 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 39 T 8.16 4.31 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 1.24 0.00 0.00 40 E 8.58 4.12 0.00 1.95 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 2.30 2.45 0.00 41 G 8.74 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 0.00 0.00 0.00 42 L 8.15 4.86 0.00 1.50 1.59 0.91 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 43 H 9.31 5.03 0.00 3.00 3.32 0.00 5.62 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 44 G 9.15 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 0.00 0.00 0.00 45 F 8.77 5.39 0.00 2.99 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 46 H 8.86 5.04 0.00 3.08 3.12 0.00 5.85 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 V 8.63 4.41 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 0.88 0.00 0.00 0.89 0.00 0.00 48 H 9.26 5.17 0.00 3.04 3.39 0.00 5.69 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 49 E 8.78 3.70 0.00 1.61 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 1.49 2.14 0.00 50 F 7.79 4.97 0.00 3.16 2.89 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 51 G 8.45 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 D 7.99 4.77 0.00 2.64 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 53 N 8.53 5.11 0.00 2.76 2.70 0.00 0.00 6.89 7.22 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 54 T 8.55 3.87 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 55 A 8.11 4.63 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 56 G 7.93 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 0.00 0.00 0.00 57 C 8.58 4.40 0.00 2.96 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 T 7.94 3.75 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 1.26 0.00 0.00 59 S 7.88 4.35 0.00 4.21 4.06 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 0.00 0.00 0.00 0.00 60 A 7.55 4.57 1.42 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 0.00 0.00 61 G 8.22 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 0.00 0.00 0.00 62 P 0.00 4.69 0.00 2.04 2.20 0.00 3.56 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 1.94 1.99 0.00 63 H 8.41 4.40 0.00 2.82 3.18 0.00 5.72 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 F 9.12 4.28 0.00 2.89 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 N 7.89 5.11 0.00 2.55 2.43 0.00 0.00 6.93 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 66 P 0.00 4.22 0.00 2.08 1.99 0.00 2.96 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.08 0.00 67 L 7.61 4.29 0.00 1.57 1.69 0.93 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 68 S 7.56 3.63 0.00 4.02 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 69 R 8.09 4.52 0.00 1.86 1.97 0.00 3.30 0.00 0.00 3.20 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.77 0.00 70 K 8.82 4.34 0.00 1.67 1.69 0.00 1.66 0.00 0.00 1.56 0.00 0.00 2.76 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.45 1.37 7.81 71 H 8.65 3.96 0.00 3.18 3.14 0.00 5.93 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 72 G 7.49 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 73 G 8.95 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 0.00 0.00 0.00 74 P 0.00 4.38 0.00 2.23 2.38 0.00 3.79 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.05 0.00 75 K 7.94 4.23 0.00 1.78 1.90 0.00 1.74 0.00 0.00 1.72 0.00 0.00 2.98 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.44 1.47 7.81 76 D 7.74 4.75 0.00 2.78 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 E 8.72 3.89 0.00 1.92 1.96 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 2.28 2.29 0.00 78 E 7.99 4.26 0.00 2.06 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 0.00 2.32 2.31 0.00 79 R 7.63 4.75 0.00 1.97 1.89 0.00 2.85 0.00 0.00 2.25 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.56 0.00 80 H 9.00 4.45 0.00 3.49 3.37 0.00 5.65 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 V 8.25 3.45 1.42 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 0.75 0.00 0.00 0.40 0.00 0.00 82 G 8.25 3.91 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 0.00 0.00 0.00 0.00 0.00 0.00 83 D 8.20 4.99 0.00 2.70 2.76 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 84 L 8.46 4.56 0.00 1.77 1.90 0.96 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 85 G 8.48 4.08 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 N 8.69 5.65 0.00 2.59 2.70 0.00 0.00 6.61 7.68 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 87 V 8.55 4.38 1.80 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 -0.16 0.00 0.00 0.69 0.00 0.00 88 T 8.23 5.02 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 89 A 9.00 4.79 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 90 D 8.69 4.82 0.00 2.86 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 91 K 8.50 3.89 0.00 1.83 1.88 0.00 1.66 0.00 0.00 1.79 0.00 0.00 3.08 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.42 1.53 7.81 92 D 8.14 4.46 0.00 2.89 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 G 8.69 4.35 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 0.00 94 V 8.22 4.86 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 1.00 0.00 0.00 0.92 0.00 0.00 95 A 8.87 5.20 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 96 D 8.66 4.99 0.00 2.56 2.64 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 97 V 8.62 3.99 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 0.76 0.00 0.00 0.63 0.00 0.00 98 S 8.42 4.67 0.00 3.90 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 99 I 9.20 4.81 1.98 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 1.29 0.68 1.02 0.00 0.00 100 E 8.87 5.28 0.00 1.84 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 2.21 2.27 0.00 101 D 9.28 4.81 0.00 2.83 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 0.00 102 S 8.86 4.71 0.00 3.92 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 0.00 103 V 8.12 3.80 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 0.83 0.00 0.00 0.96 0.00 0.00 104 I 7.81 4.02 1.95 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 1.51 0.82 1.05 0.00 0.00 105 S 8.41 4.68 0.00 3.86 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 0.00 106 L 8.85 4.47 0.00 1.79 1.63 1.04 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 107 S 7.73 4.52 0.00 3.90 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 0.00 108 G 8.55 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 0.00 109 D 8.69 4.48 0.00 2.87 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 0.00 110 H 8.15 5.02 0.00 3.27 3.48 0.00 5.64 0.00 0.00 0.00 0.00 6.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 C 8.05 4.46 0.00 3.05 2.81 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 0.00 112 I 8.16 3.88 1.62 0.00 0.00 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.13 0.97 0.00 0.00 113 I 7.22 3.72 1.77 0.00 0.00 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 1.18 0.36 0.83 0.00 0.00 114 G 9.37 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 0.00 115 R 7.44 4.87 0.00 1.58 1.81 0.00 2.21 0.00 0.00 2.25 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.21 0.00 116 T 7.97 4.95 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 1.23 0.00 0.00 117 L 8.58 4.77 0.00 1.77 1.51 0.38 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 118 V 8.67 4.98 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 0.70 0.00 0.00 0.71 0.00 0.00 119 V 8.65 5.14 2.31 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 0.82 0.00 0.00 1.03 0.00 0.00 120 H 8.88 5.29 0.00 3.13 3.57 0.00 5.66 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 E 9.31 4.18 0.00 2.01 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 0.00 2.36 2.34 0.00 122 K 8.28 4.72 0.00 1.77 1.69 0.00 1.91 0.00 0.00 1.66 0.00 0.00 2.85 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.37 1.39 7.81 123 A 8.37 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 0.00 124 D 9.35 4.80 0.00 2.76 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 0.00 125 D 9.33 4.61 0.00 2.92 2.89 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 0.00 126 L 9.90 3.48 0.00 1.85 1.79 0.94 1.03 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 0.00 127 G 8.56 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 0.00 0.00 0.00 128 K 8.03 4.50 0.00 1.89 1.80 0.00 1.72 0.00 0.00 1.71 0.00 0.00 2.83 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.37 1.49 7.81 129 G 7.98 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 0.00 130 G 8.28 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 0.00 131 N 7.42 5.14 0.00 2.92 2.78 0.00 0.00 6.88 7.54 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 0.00 132 E 8.56 4.12 0.00 2.21 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 0.00 2.36 2.39 0.00 133 E 8.13 4.07 0.00 2.19 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 2.39 2.41 0.00 134 S 8.29 4.14 0.00 4.03 3.99 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 0.00 135 T 7.43 4.63 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 0.00 136 K 7.77 4.28 0.00 1.79 1.79 0.00 1.78 0.00 0.00 1.74 0.00 0.00 3.26 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.31 1.36 7.81 137 T 8.01 4.06 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 1.13 0.00 0.00 138 G 8.14 3.78 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 0.00 0.00 0.00 0.00 0.00 0.00 139 N 8.02 4.32 0.00 3.04 2.88 0.00 0.00 6.92 7.70 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 0.00 140 A 7.62 4.01 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 0.00 141 G 7.33 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 0.00 142 S 8.74 4.40 0.00 3.90 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 0.00 143 R 8.36 4.50 0.00 1.66 1.81 0.00 3.19 0.00 0.00 3.14 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.66 0.00 144 L 8.90 4.35 0.00 1.70 1.70 0.94 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 145 A 7.69 5.00 1.21 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 0.00 0.00 146 C 8.43 5.56 0.00 3.03 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 0.00 147 G 8.01 4.65 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 0.00 148 V 8.28 4.49 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 0.82 0.00 0.00 0.91 0.00 0.00 149 I 8.69 4.18 1.79 0.00 0.00 0.58 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 0.36 0.42 0.00 0.00 150 G 8.93 4.40 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 0.00 151 I 8.34 4.25 1.85 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 1.25 0.54 0.91 0.00 0.00 152 A 8.51 4.93 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 153 Q 8.50 4.10 0.00 2.19 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.79 6.60 0.00 0.00 0.00 0.00 0.00 2.34 2.37 0.00