NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 V 3.8408 8.0544 120.2920 61.6068 32.6668 174.0916 2 H 4.4992 8.3729 122.4883 53.7226 31.2453 172.4196 3 W 4.6216 8.4381 126.7244 55.6237 31.6823 176.0199 4 S 4.6135 9.3340 115.9293 57.5118 64.4106 175.3804 5 A 4.0966 8.4133 127.9286 55.2289 18.3810 180.0739 6 E 3.9511 8.1358 116.7669 59.4625 29.5838 179.2844 7 E 3.9828 8.0621 118.3999 59.2725 29.5466 179.3933 8 K 3.6487 8.4057 119.1146 59.4467 31.8224 179.1296 9 Q 4.1538 7.9520 116.1396 57.9864 28.2873 177.8361 10 L 3.9657 7.6937 121.3544 57.3928 41.8699 178.8932 11 I 3.5065 7.6071 119.8803 64.3601 36.5347 178.0771 12 T 4.0475 8.1650 117.0258 67.0514 68.1933 176.5839 13 G 3.7479 7.4455 105.3645 47.9504 0.0000 175.1089 14 L 4.1013 7.9181 121.5883 57.2015 42.0183 178.7648 15 W 4.6175 8.9960 128.8972 60.4798 30.5484 178.0429 16 G 3.9906 7.7301 101.5995 46.5163 0.0000 173.4617 17 K 4.4824 8.2175 117.9592 55.1977 33.9304 176.2284 18 V 3.5089 6.9135 114.9618 62.5165 32.2950 175.4368 19 N 4.3804 7.9424 125.1426 52.6005 37.9877 175.7130 20 V 3.4262 7.9599 120.1661 63.9537 32.2552 178.9665 21 A 3.9403 7.8797 121.6025 55.2863 18.4349 178.9726 22 D 4.2471 8.0410 116.5800 57.7914 40.9997 178.9311 23 C 4.1870 8.3103 117.1901 62.4837 28.1673 176.6468 24 G 3.8714 8.0713 108.3403 47.1020 0.0000 175.4252 25 A 4.0110 8.6023 124.4841 54.6456 18.4377 179.0891 26 E 4.2427 8.2234 116.8752 58.5564 29.7884 178.4198 27 A 4.0977 7.6888 120.2553 54.1442 18.2899 178.8421 28 L 4.1041 7.8206 118.0464 57.0830 42.3723 177.9402 29 A 3.9844 8.3386 121.2901 55.5919 18.1866 179.8343 30 R 3.8845 7.8585 115.4372 58.9824 29.9001 178.6136 31 L 4.0995 8.0179 120.1432 58.1393 41.4336 178.4360 32 L 4.3688 7.7974 117.2504 55.2462 41.8078 178.0656 33 I 4.1528 6.8330 118.3428 62.2476 39.0625 177.2416 34 V 3.4727 7.7074 119.2995 64.9394 31.7064 175.5449 35 Y 4.0661 7.1368 116.4500 54.5340 38.1272 173.8382 36 P 4.6970 0.0000 0.0000 62.9505 31.9009 177.4796 37 W 4.4217 7.8411 116.3768 59.3809 28.0720 177.6133 38 T 4.5375 7.4127 109.2626 63.5000 68.3768 176.1605 39 Q 4.3566 8.0557 121.4523 58.4992 28.4527 178.1132 40 R 3.8687 7.6783 118.9013 58.6467 30.1623 177.4367 41 F 4.3258 7.4635 115.4641 57.7548 38.7889 175.3576 42 F 4.5577 8.0036 118.3100 56.8262 40.0613 177.1145 43 A 4.3600 8.0676 125.6289 54.9376 18.9412 180.6998 44 S 4.2398 8.2284 109.9494 61.6441 63.0078 175.7887 45 F 4.4511 7.8005 119.4696 58.8069 40.1824 175.9789 46 G 3.9507 7.9144 105.9535 44.1106 0.0000 176.2990 47 N 4.4871 9.0431 128.3244 53.6974 38.0322 173.1888 48 L 4.8770 8.3118 126.7226 54.6291 42.9563 177.5405 49 S 4.6425 8.2383 111.7548 58.4142 63.5786 174.2364 50 S 4.6368 7.5391 114.9965 55.6972 66.5874 172.9663 51 P 4.1816 0.0000 0.0000 66.3816 31.0761 178.6426 52 T 3.8189 8.0374 113.3864 66.8406 68.2853 175.8688 53 A 3.9656 8.1163 122.1184 55.4680 18.2327 179.3787 54 I 3.6375 7.8912 117.1167 64.9048 37.3032 178.3212 55 L 4.2166 8.2138 118.8504 57.6559 41.5693 179.3759 56 G 3.7859 8.3677 104.6544 45.3638 0.0000 173.5779 57 N 4.0902 7.9354 119.6437 53.7197 39.6602 173.4138 58 P 4.2006 0.0000 0.0000 66.0646 31.5818 178.7266 59 M 3.7647 7.8322 117.0329 57.9348 31.8108 178.8424 60 V 3.4839 7.5435 117.9102 66.0918 31.6836 178.1446 61 R 3.8482 7.7459 117.1313 59.4380 29.7791 178.8771 62 A 4.0653 7.8682 120.0147 54.7706 18.3751 179.2683 63 H 4.3309 8.1831 117.3526 59.5277 30.1268 177.3596 64 G 4.3137 8.6384 109.2144 47.0930 0.0000 174.9982 65 K 4.0729 7.8739 121.2218 59.6839 31.7110 179.0665 66 K 4.1280 7.9253 118.3595 59.3739 31.8429 179.6413 67 V 3.7022 8.4306 119.1085 65.8513 31.5504 178.1533 68 L 4.5883 8.2844 118.8322 58.1935 41.4502 179.1404 69 T 4.2432 8.5655 115.0540 67.0014 68.5903 176.0622 70 S 4.1758 7.8785 113.8272 61.3947 62.5432 175.8969 71 F 4.3192 8.2179 120.3824 60.8490 38.6592 177.7514 72 G 2.6494 8.1700 103.9462 46.4725 0.0000 175.0777 73 D 4.4061 7.9299 119.8288 56.0069 40.5974 177.9484 74 A 4.2573 7.5827 121.3210 54.5647 19.0581 179.0178 75 V 3.0796 6.9863 115.4245 66.1837 31.4066 178.1462 76 K 4.1507 7.3069 115.8511 58.1825 32.9361 177.5432 77 N 4.8457 7.4010 117.8350 51.2005 38.4601 174.9054 78 L 4.0774 7.8370 121.0607 56.4732 42.2958 177.5651 79 D 4.9713 7.8386 117.2909 53.8834 41.1838 176.9124 80 N 4.8713 8.1076 112.3678 53.3613 42.1417 175.7928 81 I 3.8341 8.3082 120.0896 65.2054 37.1434 177.9139 82 K 4.1216 8.0717 118.7526 60.0728 32.4108 178.8676 83 N 4.4145 8.1230 116.3834 56.2963 38.5534 177.0467 84 T 4.0205 7.7429 116.5514 65.6711 68.8177 175.9270 85 F 4.5190 7.8432 117.3065 57.2280 39.3051 177.6328 86 S 4.0923 7.5955 115.4409 61.6457 61.7293 176.1319 87 Q 4.0042 7.9756 122.0653 58.6716 29.3592 177.3802 88 L 4.2460 7.7540 116.8518 56.5643 42.5766 178.9149 89 S 4.3283 8.0634 115.0626 60.7058 62.3070 175.5701 90 E 4.0477 8.0231 121.2657 59.4459 29.3386 179.2815 91 L 3.8578 7.4281 118.8147 58.7196 42.3091 178.8513 92 H 4.1970 8.4113 115.9729 58.1601 28.1201 177.1628 93 C 3.7887 7.9085 117.9678 61.2282 28.5349 175.6927 94 D 4.2284 7.8205 118.8773 56.2122 40.8623 177.4362 95 K 4.2945 7.8313 117.0526 56.3716 33.2160 176.3765 96 L 4.5017 7.5499 116.1030 53.9731 44.2140 175.9512 97 H 4.2489 7.2735 113.8186 55.4088 26.4159 174.9068 98 V 3.9668 8.2654 117.9443 60.9819 32.8403 174.9750 99 D 4.5248 8.6662 127.2216 53.5440 41.8448 175.1751 100 P 2.9700 0.0000 0.0000 64.6548 31.2165 178.2804 101 E 3.9153 8.3910 118.6447 59.3459 29.3521 178.5324 102 N 4.4325 8.2907 116.7967 55.7976 38.5251 177.4418 103 F 4.4631 7.5103 119.3401 60.6534 38.9871 177.4270 104 R 4.0031 8.0604 117.8267 59.6589 29.7186 178.4138 105 L 3.9064 8.0688 118.6848 57.4596 41.4688 179.2411 106 L 4.1923 8.3666 120.9449 57.8093 41.9821 179.0981 107 G 3.6534 8.3089 105.8501 48.1194 0.0000 175.1371 108 D 4.4982 8.3734 122.2915 57.2233 40.7653 179.5630 109 I 3.8462 7.6053 120.0486 64.0043 37.0984 177.9568 110 L 3.8323 8.2568 121.6830 58.3083 41.7686 178.9232 111 I 3.5952 7.8516 119.5925 64.7482 37.0056 178.5038 112 I 3.5636 7.4737 119.8882 64.1929 36.9050 178.6520 113 V 3.4811 7.9717 119.4476 65.9658 31.4516 178.1780 114 L 3.8026 8.4065 119.0146 57.3084 41.2708 178.9839 115 A 3.5802 7.8770 121.2606 55.0908 18.0381 179.2650 116 A 3.8396 7.7740 117.9839 55.7453 18.4585 179.1435 117 H 3.7509 7.7214 115.0098 59.0274 30.0304 176.7554 118 F 4.5018 8.0868 116.9573 58.5654 40.0478 177.6925 119 S 3.5991 8.5256 113.6578 60.8738 63.4740 174.4808 120 K 4.6613 8.1478 115.3953 59.6214 32.3406 176.8723 121 D 4.4295 8.1902 118.1513 56.4881 40.9075 176.1525 122 F 4.4249 10.1051 121.4361 57.1144 38.0802 175.5072 123 T 4.4491 7.5609 117.8869 59.4214 71.8465 173.4323 124 P 4.0853 0.0000 0.0000 65.9355 31.3288 178.7280 125 E 3.9598 8.0369 115.7588 59.4887 29.5215 178.6982 126 C 4.0149 7.5176 119.2853 61.9322 31.5793 175.0372 127 Q 3.5629 8.2238 121.8227 59.2332 28.6892 178.2104 128 A 4.0197 8.3033 121.7203 55.4134 18.2558 179.5208 129 A 4.0675 7.9321 118.5672 54.9598 18.4055 179.6201 130 W 4.1594 8.5081 116.7213 58.9118 29.1845 178.9866 131 Q 4.1700 8.7119 119.3485 58.6278 28.2542 178.1688 132 K 3.8892 7.9742 120.4674 59.4667 32.2958 178.3860 133 L 4.3751 8.3796 120.8095 58.4413 41.9464 179.1143 134 V 3.8856 7.7893 118.0816 66.1842 31.5978 178.0586 135 R 4.0102 8.4366 118.1319 59.6383 29.9705 179.5033 136 V 3.7479 7.9596 111.8355 63.8266 31.4996 179.0338 137 V 3.1001 7.9217 118.1652 65.8287 31.3325 177.8604 138 A 3.9540 8.0644 120.4531 55.3859 17.5587 178.9474 139 H 4.2852 8.0652 115.9026 58.9496 29.9061 177.1705 140 A 4.1316 7.9820 121.2976 54.2033 18.3397 178.6158 141 L 4.0397 7.7114 118.6909 56.7085 42.2189 177.5291 142 A 4.7975 7.8485 118.9088 52.0103 18.9736 178.7000 143 R 3.8252 7.2670 114.4924 59.5074 29.3050 178.2456 144 K 3.9792 7.8340 119.0012 60.1008 32.3033 177.3750 145 Y 4.3481 8.8476 117.6895 58.9395 37.4321 176.0488 146 H 4.5408 7.8179 121.2762 55.9166 30.3952 174.4798 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 V 8.05 3.84 1.83 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 0.57 0.00 0.00 0.36 0.00 0.00 2 H 8.37 4.50 0.00 3.10 3.14 0.00 5.91 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 W 8.44 4.62 0.00 3.23 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 4 S 9.33 4.61 0.00 3.89 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 5 A 8.41 4.10 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 6 E 8.14 3.95 0.00 2.08 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 2.40 2.46 0.00 7 E 8.06 3.98 0.00 2.41 2.23 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 2.40 2.41 0.00 8 K 8.41 3.65 0.00 1.67 1.69 0.00 1.67 0.00 0.00 1.65 0.00 0.00 2.93 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.17 1.67 7.81 9 Q 7.95 4.15 0.00 2.30 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.76 0.00 0.00 0.00 0.00 0.00 2.34 2.40 0.00 10 L 7.69 3.97 0.00 1.93 1.76 0.91 0.53 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 11 I 7.61 3.51 1.53 0.00 0.00 0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.35 0.17 0.12 0.00 0.00 12 T 8.17 4.05 4.30 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 1.24 0.00 0.00 13 G 7.45 3.75 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 0.00 0.00 0.00 14 L 7.92 4.10 0.00 2.27 2.23 0.02 0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 15 W 9.00 4.62 0.00 3.93 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 16 G 7.73 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 17 K 8.22 4.48 0.00 1.82 2.19 0.00 1.93 0.00 0.00 1.88 0.00 0.00 3.00 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.36 1.38 7.81 18 V 6.91 3.51 1.66 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 0.52 0.00 0.00 1.13 0.00 0.00 19 N 7.94 4.38 0.00 2.49 2.55 0.00 0.00 7.19 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 20 V 7.96 3.43 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 0.44 0.00 0.00 0.93 0.00 0.00 21 A 7.88 3.94 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 22 D 8.04 4.25 0.00 2.64 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 23 C 8.31 4.19 0.00 3.01 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 24 G 8.07 3.87 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 0.00 0.00 0.00 0.00 0.00 0.00 25 A 8.60 4.01 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 26 E 8.22 4.24 0.00 2.03 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.28 0.00 27 A 7.69 4.10 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 28 L 7.82 4.10 0.00 1.76 1.63 0.93 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 29 A 8.34 3.98 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 30 R 7.86 3.88 0.00 2.02 1.98 0.00 3.14 0.00 0.00 3.07 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.65 0.00 31 L 8.02 4.10 0.00 1.92 1.81 0.99 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 32 L 7.80 4.37 0.00 2.04 1.67 0.84 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 33 I 6.83 4.15 1.81 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.61 0.86 0.00 0.00 34 V 7.71 3.47 1.63 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 -0.45 0.00 0.00 0.78 0.00 0.00 35 Y 7.14 4.07 0.00 2.32 1.43 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 36 P 0.00 4.70 0.00 2.23 2.09 0.00 3.94 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 1.96 0.00 37 W 7.84 4.42 0.00 3.63 3.57 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 38 T 7.41 4.54 4.51 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 0.00 0.00 0.00 1.06 0.00 0.00 39 Q 8.06 4.36 0.00 2.25 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.84 0.00 0.00 0.00 0.00 0.00 2.46 2.49 0.00 40 R 7.68 3.87 0.00 1.79 1.47 0.00 3.17 0.00 0.00 3.13 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.53 0.00 41 F 7.46 4.33 0.00 2.16 2.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 F 8.00 4.56 0.00 3.00 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 0.00 0.00 0.00 0.00 43 A 8.07 4.36 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 44 S 8.23 4.24 0.00 4.21 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 45 F 7.80 4.45 0.00 3.41 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 46 G 7.91 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 47 N 9.04 4.49 0.00 2.72 2.82 0.00 0.00 6.63 7.78 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 48 L 8.31 4.88 0.00 1.68 1.65 1.11 1.09 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 49 S 8.24 4.64 0.00 4.03 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 50 S 7.54 4.64 0.00 4.03 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 51 P 0.00 4.18 0.00 2.16 2.14 0.00 3.62 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.18 0.00 52 T 8.04 3.82 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 53 A 8.12 3.97 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 54 I 7.89 3.64 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 1.54 0.60 0.94 0.00 0.00 55 L 8.21 4.22 0.00 1.85 1.71 0.89 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 56 G 8.37 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 57 N 7.94 4.09 0.00 2.97 2.75 0.00 0.00 7.05 8.57 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 58 P 0.00 4.20 0.00 2.13 2.02 0.00 3.62 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.14 0.00 59 M 7.83 3.76 0.00 1.02 1.88 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.39 0.00 60 V 7.54 3.48 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 1.07 0.00 0.00 1.17 0.00 0.00 61 R 7.75 3.85 0.00 2.14 1.93 0.00 3.14 0.00 0.00 3.13 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.84 0.00 62 A 7.87 4.07 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 63 H 8.18 4.33 0.00 3.37 3.56 0.00 5.82 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 G 8.64 4.31 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 0.00 65 K 7.87 4.07 0.00 1.92 2.04 0.00 1.63 0.00 0.00 1.64 0.00 0.00 2.98 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.51 7.81 66 K 7.93 4.13 0.00 2.00 1.90 0.00 1.84 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.50 1.59 7.81 67 V 8.43 3.70 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 1.22 0.00 0.00 0.90 0.00 0.00 68 L 8.28 4.59 0.00 2.10 1.90 0.98 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 69 T 8.57 4.24 4.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 70 S 7.88 4.18 0.00 4.19 3.87 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 0.00 0.00 0.00 71 F 8.22 4.32 0.00 3.66 3.32 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 72 G 8.17 2.65 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 73 D 7.93 4.41 0.00 2.62 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 74 A 7.58 4.26 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 V 6.99 3.08 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 0.53 0.00 0.00 0.28 0.00 0.00 76 K 7.31 4.15 0.00 1.73 1.77 0.00 1.73 0.00 0.00 1.83 0.00 0.00 3.02 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.44 1.39 7.81 77 N 7.40 4.85 0.00 2.77 2.66 0.00 0.00 7.12 6.62 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 78 L 7.84 4.08 0.00 1.11 0.95 0.46 -0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 79 D 7.84 4.97 0.00 2.66 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 80 N 8.11 4.87 0.00 2.79 2.69 0.00 0.00 7.20 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 81 I 8.31 3.83 1.97 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.49 0.93 0.00 0.00 82 K 8.07 4.12 0.00 2.02 2.11 0.00 1.53 0.00 0.00 1.85 0.00 0.00 3.00 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.52 1.56 7.81 83 N 8.12 4.41 0.00 3.01 2.92 0.00 0.00 6.93 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 84 T 7.74 4.02 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 0.88 0.00 0.00 85 F 7.84 4.52 0.00 2.98 2.93 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 86 S 7.60 4.09 0.00 4.16 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 87 Q 7.98 4.00 0.00 2.08 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.15 6.69 0.00 0.00 0.00 0.00 0.00 2.39 2.35 0.00 88 L 7.75 4.25 0.00 1.93 1.74 0.61 0.85 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 89 S 8.06 4.33 0.00 4.13 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 90 E 8.02 4.05 0.00 2.24 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 2.32 2.32 0.00 91 L 7.43 3.86 0.00 1.75 1.77 0.87 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 92 H 8.41 4.20 0.00 3.27 3.45 0.00 5.85 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 C 7.91 3.79 0.00 2.77 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 0.00 0.00 0.00 0.00 94 D 7.82 4.23 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 95 K 7.83 4.29 0.00 1.63 1.76 0.00 1.59 0.00 0.00 1.68 0.00 0.00 3.08 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.31 1.46 7.81 96 L 7.55 4.50 0.00 1.81 1.72 0.89 0.69 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 97 H 7.27 4.25 0.00 3.35 3.46 0.00 5.62 0.00 0.00 0.00 0.00 8.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 8.27 3.97 2.23 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 0.36 0.00 0.00 0.60 0.00 0.00 99 D 8.67 4.52 0.00 2.83 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 0.00 100 P 0.00 2.97 0.00 2.07 2.02 0.00 3.51 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.48 0.00 101 E 8.39 3.92 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 2.32 2.42 0.00 102 N 8.29 4.43 0.00 2.87 2.93 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 0.00 103 F 7.51 4.46 0.00 3.12 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 0.00 104 R 8.06 4.00 0.00 1.90 2.20 0.00 3.67 0.00 0.00 3.37 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.72 0.00 105 L 8.07 3.91 0.00 1.73 1.11 0.76 0.13 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 0.00 106 L 8.37 4.19 0.00 1.90 1.86 1.06 1.21 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 0.00 107 G 8.31 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 D 8.37 4.50 0.00 2.90 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 0.00 109 I 7.61 3.85 2.22 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.13 1.03 0.00 0.00 110 L 8.26 3.83 0.00 1.66 1.74 0.73 -0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 111 I 7.85 3.60 2.11 0.00 0.00 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 1.84 1.29 1.14 0.00 0.00 112 I 7.47 3.56 1.98 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 1.43 0.75 0.89 0.00 0.00 113 V 7.97 3.48 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 1.00 0.00 0.00 0.98 0.00 0.00 114 L 8.41 3.80 0.00 0.88 0.97 0.24 0.80 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 0.00 115 A 7.88 3.58 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 A 7.77 3.84 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 H 7.72 3.75 0.00 3.02 2.54 0.00 5.94 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 0.00 118 F 8.09 4.50 0.00 3.07 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 0.00 119 S 8.53 3.60 0.00 4.14 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 0.00 120 K 8.15 4.66 0.00 1.84 1.90 0.00 1.77 0.00 0.00 1.73 0.00 0.00 3.06 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.48 1.56 7.81 121 D 8.19 4.43 0.00 3.06 2.87 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 0.00 0.00 0.00 122 F 10.11 4.42 0.00 2.98 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 T 7.56 4.45 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 1.30 0.00 0.00 124 P 0.00 4.09 0.00 2.16 2.15 0.00 3.58 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.17 0.00 125 E 8.04 3.96 0.00 2.13 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.29 0.00 126 C 7.52 4.01 0.00 2.84 2.59 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.22 3.56 0.00 1.84 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.52 0.00 0.00 0.00 0.00 0.00 2.42 2.56 0.00 128 A 8.30 4.02 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 0.00 129 A 7.93 4.07 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 0.00 130 W 8.51 4.16 0.00 3.69 3.45 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 0.00 131 Q 8.71 4.17 0.00 2.41 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.81 0.00 0.00 0.00 0.00 0.00 2.51 2.59 0.00 132 K 7.97 3.89 0.00 1.96 2.11 0.00 1.39 0.00 0.00 1.50 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.87 1.17 7.81 133 L 8.38 4.38 0.00 1.64 1.59 0.55 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 134 V 7.79 3.89 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 1.03 0.00 0.00 135 R 8.44 4.01 0.00 2.23 1.98 0.00 3.30 0.00 0.00 3.48 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.77 0.00 136 V 7.96 3.75 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 0.74 0.00 0.00 1.29 0.00 0.00 137 V 7.92 3.10 2.03 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 -0.27 0.00 0.00 0.87 0.00 0.00 138 A 8.06 3.95 1.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 H 8.07 4.29 0.00 3.44 3.47 0.00 5.78 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 A 7.98 4.13 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 0.00 141 L 7.71 4.04 0.00 1.57 1.23 -0.77 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 142 A 7.85 4.80 1.60 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 0.00 143 R 7.27 3.83 0.00 2.00 2.34 0.00 3.11 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.65 0.00 144 K 7.83 3.98 0.00 1.74 1.83 0.00 1.75 0.00 0.00 1.69 0.00 0.00 3.14 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.74 1.54 7.81 145 Y 8.85 4.35 0.00 3.30 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 0.00 146 H 7.82 4.54 0.00 3.38 3.84 0.00 5.56 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00