NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 4.0013 8.3544 108.0301 45.7485 0.0000 172.6828 2 I 3.7011 8.4066 120.9826 60.0431 38.5431 174.2315 3 D 4.5728 8.6401 129.1050 53.9696 41.9303 174.6843 4 P 4.5896 0.0000 0.0000 64.9291 31.8071 176.6208 5 N 4.7824 9.0349 116.7970 52.9717 38.9664 176.0852 6 Y 4.1559 7.8599 119.8563 60.1055 38.0164 178.9632 7 R 3.1504 6.7221 118.2896 58.0092 30.0731 177.1368 8 T 4.4916 7.4275 105.0825 61.1842 69.5782 174.7375 9 S 4.6645 7.8705 114.9236 58.0953 65.0750 173.9615 10 R 4.7478 8.0687 120.2548 54.3674 31.9868 176.1170 11 Q 4.1442 8.5934 124.0889 56.0329 30.4870 174.9928 12 V 3.9133 8.3660 126.8226 62.9899 31.4951 175.8112 13 V 4.0517 8.4077 121.7939 61.8448 32.8992 175.8347 14 G 3.9807 6.9352 105.8619 45.9453 0.0000 171.5168 15 E 5.0821 8.8088 119.6353 54.5282 33.0041 175.4655 16 H 4.6245 9.1934 124.7434 55.3854 32.2300 173.3756 17 Q 3.2365 9.8225 127.5782 56.8681 26.2066 175.1735 18 G 3.9376 8.5289 104.8884 45.1439 0.0000 173.1715 19 H 5.0900 7.8752 115.5362 53.3070 31.8554 174.1160 20 K 4.4811 8.5959 118.8225 56.4507 33.6789 175.8157 21 V 4.6820 7.9678 121.9519 61.3740 34.2216 173.8016 22 Y 4.8222 9.6859 127.2020 56.7453 39.5802 176.1417 23 G 4.4935 9.0219 114.0276 44.6463 0.0000 171.0822 24 P 4.7844 0.0000 0.0000 62.6730 32.4888 176.1511 25 V 4.5296 8.2531 113.7252 59.8345 34.8496 175.8037 26 D 4.7870 9.0595 123.8256 51.8565 41.3900 172.7258 27 P 4.7458 0.0000 0.0000 61.7102 32.0306 174.7879 28 P 4.7209 0.0000 0.0000 62.9665 31.8849 177.3150 29 K 4.1439 7.9022 118.2543 57.4290 32.8180 176.6473 30 V 4.6006 7.9640 119.2124 61.1387 33.0601 175.3895 31 L 4.6443 9.3804 126.1502 53.5111 43.5629 178.1994 32 G 3.9129 8.3916 109.1109 44.7932 0.0000 171.9333 33 I 4.6134 8.0486 119.0628 59.7277 38.9862 174.4376 34 H 5.0836 8.4978 122.1408 55.0723 30.3169 175.2958 35 G 4.5630 9.2825 110.3415 47.2526 0.0000 172.5137 36 T 4.5916 8.7035 114.1278 65.2701 71.0060 176.0537 37 I 3.9434 8.6512 122.3129 63.7289 38.4108 175.8812 38 V 4.5317 8.1864 123.7939 61.1071 33.9442 174.1522 39 G 4.5833 9.2270 116.7232 43.8644 0.0000 171.4909 40 V 4.8501 8.5735 125.5329 61.0072 34.3787 174.1751 41 D 4.8373 9.1935 129.1912 53.5423 40.5707 176.7225 42 F 4.5631 8.7917 125.7590 60.3808 39.0999 176.7975 43 D 4.7651 8.4112 118.6196 55.4025 41.0730 176.8706 44 L 4.4929 7.7908 117.9236 55.7302 43.4206 176.8372 45 C 3.9154 8.2622 118.6607 60.3127 31.5910 172.9956 46 I 4.2076 8.3930 124.7471 60.1414 38.0782 174.4263 47 A 4.0043 8.0592 119.1234 53.6693 15.4051 179.1142 48 D 4.3824 8.4052 121.7906 56.9460 41.8933 177.2602 49 G 4.1910 8.5294 106.7409 45.7682 0.0000 175.2639 50 S 4.0915 8.1000 116.2083 61.6578 62.8632 175.9971 51 C 3.8393 7.8892 116.6517 61.6406 28.7626 176.0818 52 I 3.6538 7.1710 120.5728 64.2019 36.7862 178.1478 53 T 3.9973 7.7179 115.5253 65.7137 68.2758 175.7760 54 A 4.5351 7.3491 121.1084 52.2347 19.7329 177.0557 55 C 4.2160 7.6569 118.9866 58.8941 31.7850 172.5184 56 P 4.1551 0.0000 0.0000 64.4011 31.3046 177.0914 57 V 4.2052 6.9598 116.7467 60.6790 31.8952 174.6792 58 N 4.1497 8.1481 116.3529 55.1514 36.8734 175.4123 59 V 3.6523 7.6517 118.7846 65.2859 32.7695 175.7337 60 F 5.3594 7.8003 117.0627 56.2486 40.8729 175.4318 61 Q 4.5075 9.0243 122.4061 53.9513 32.6577 174.0908 62 W 5.0827 8.9032 125.7947 57.7851 30.1676 174.7763 63 Y 4.9873 9.5464 124.6025 55.7862 41.6098 174.0441 64 D 4.6146 8.4422 127.1023 54.0730 41.5702 177.1679 65 T 4.4579 9.1019 114.4521 58.7305 68.5266 171.1731 66 P 4.1472 0.0000 0.0000 64.9455 32.1063 177.8841 67 G 3.9275 8.8553 110.7503 45.3631 0.0000 172.9854 68 H 4.5369 8.0337 120.6622 54.5586 30.2952 174.4228 69 P 4.2989 0.0000 0.0000 65.0215 31.3435 176.9800 70 A 4.3575 7.6767 120.8692 53.4664 19.6607 176.8455 71 S 4.5556 7.0333 106.2742 57.7161 65.8430 176.4563 72 E 4.3693 8.1345 122.3248 58.2698 30.4349 175.8920 73 K 5.0812 7.6255 116.3664 55.2405 36.3017 175.5112 74 K 4.7790 9.1969 118.8507 54.3774 36.6675 176.0558 75 A 4.3104 8.7206 124.7372 51.7411 18.6964 176.2074 76 D 5.0894 9.1110 123.1560 52.5805 42.8668 175.3408 77 P 4.4534 0.0000 0.0000 62.3574 28.2660 176.2198 78 I 3.8820 7.6395 121.2296 63.0500 39.4962 176.5587 79 N 5.0135 8.3611 121.0791 52.0256 39.2384 176.4634 80 E 3.7184 8.1796 118.3230 59.5106 29.7754 179.0233 81 Q 3.8935 7.9652 116.6470 58.0096 28.8190 176.8748 82 A 4.1401 7.7559 119.6065 52.6826 19.0633 177.2979 83 C 3.7836 7.6452 117.1919 59.7727 31.5427 173.4521 84 I 3.9101 7.8911 118.9009 60.1573 37.0444 175.4915 85 F 4.5427 7.4025 116.8770 59.2758 36.7353 177.4216 86 C 4.2232 7.5611 116.8096 59.7114 28.9511 174.9231 87 M 3.1249 7.9189 115.0902 56.1469 30.0760 178.2390 88 A 4.0655 7.7295 122.4841 55.3426 18.5793 179.9393 89 C 3.8987 8.1823 112.5525 61.8708 29.2534 176.1873 90 V 3.6465 7.1686 119.8289 64.9537 31.1133 176.6752 91 N 4.7619 7.9104 113.4588 53.2931 39.1902 175.7554 92 V 4.1228 7.4060 112.1207 61.5313 33.1459 175.7415 93 C 4.2017 7.8137 121.7455 58.5215 31.5831 172.5229 94 P 4.3009 0.0000 0.0000 64.7454 31.2474 176.9622 95 V 4.0253 7.7687 116.3567 61.5909 32.3828 174.5507 96 A 3.7109 7.5183 120.8247 54.0279 16.4761 177.7854 97 A 4.5167 7.7609 120.4099 52.9038 20.5542 178.0942 98 I 5.0589 7.6278 116.0890 59.3255 40.1528 174.7067 99 D 4.8033 9.1496 125.1909 52.5995 44.3610 173.9744 100 V 4.8132 8.5657 125.8904 61.0495 33.4376 174.7043 101 K 4.3194 8.8450 130.4877 54.8172 32.1695 174.9096 102 P 4.0431 0.0000 0.0000 60.9777 32.1457 174.9518 103 P 4.0937 0.0000 0.0000 63.2492 30.8295 176.1888 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 G 8.35 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 2 I 8.41 3.70 1.98 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.81 0.96 0.00 0.00 3 D 8.64 4.57 0.00 2.88 2.61 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 4 P 0.00 4.59 0.00 2.23 2.19 0.00 3.83 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.00 0.00 5 N 9.03 4.78 0.00 2.85 2.82 0.00 0.00 6.57 7.45 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 6 Y 7.86 4.16 0.00 2.95 3.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 R 6.72 3.15 0.00 1.35 1.71 0.00 2.80 0.00 0.00 3.02 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.50 0.00 8 T 7.43 4.49 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 1.14 0.00 0.00 9 S 7.87 4.66 0.00 3.98 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 10 R 8.07 4.75 0.00 2.14 2.17 0.00 3.33 0.00 0.00 3.45 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.68 0.00 11 Q 8.59 4.14 0.00 2.17 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 7.10 0.00 0.00 0.00 0.00 0.00 2.41 2.36 0.00 12 V 8.37 3.91 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 0.57 0.00 0.00 0.35 0.00 0.00 13 V 8.41 4.05 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 0.72 0.00 0.00 0.95 0.00 0.00 14 G 6.94 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 0.00 0.00 0.00 15 E 8.81 5.08 0.00 1.88 1.72 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 2.25 2.19 0.00 16 H 9.19 4.62 0.00 2.92 2.79 0.00 5.80 0.00 0.00 0.00 0.00 6.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 Q 9.82 3.24 0.00 1.90 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.38 0.00 0.00 0.00 0.00 0.00 1.79 2.08 0.00 18 G 8.53 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 0.00 0.00 0.00 19 H 7.88 5.09 0.00 3.11 3.47 0.00 5.27 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 K 8.60 4.48 0.00 1.69 1.25 0.00 1.70 0.00 0.00 1.53 0.00 0.00 2.81 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.41 1.43 7.81 21 V 7.97 4.68 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 0.99 0.00 0.00 0.47 0.00 0.00 22 Y 9.69 4.82 0.00 2.83 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 23 G 9.02 4.49 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 0.00 0.00 0.00 24 P 0.00 4.78 0.00 2.12 2.08 0.00 3.75 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.02 0.00 25 V 8.25 4.53 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 0.78 0.00 0.00 0.96 0.00 0.00 26 D 9.06 4.79 0.00 2.66 2.50 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 0.00 27 P 0.00 4.75 0.00 2.12 2.03 0.00 3.75 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 2.07 2.14 0.00 28 P 0.00 4.72 0.00 2.23 2.29 0.00 3.70 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.98 0.00 29 K 7.90 4.14 0.00 1.77 1.89 0.00 1.68 0.00 0.00 1.60 0.00 0.00 2.96 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.38 1.41 7.81 30 V 7.96 4.60 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 1.16 0.00 0.00 0.97 0.00 0.00 31 L 9.38 4.64 0.00 1.83 1.92 1.01 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 32 G 8.39 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 33 I 8.05 4.61 1.56 0.00 0.00 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.74 0.33 0.00 0.00 34 H 8.50 5.08 0.00 2.49 2.93 0.00 5.59 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 G 9.28 4.56 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 0.00 0.00 0.00 36 T 8.70 4.59 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 1.28 0.00 0.00 37 I 8.65 3.94 1.97 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.63 1.01 0.00 0.00 38 V 8.19 4.53 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 1.16 0.00 0.00 0.83 0.00 0.00 39 G 9.23 4.58 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 0.00 40 V 8.57 4.85 2.30 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 1.18 0.00 0.00 1.21 0.00 0.00 41 D 9.19 4.84 0.00 2.68 2.58 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 42 F 8.79 4.56 0.00 3.17 2.98 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 43 D 8.41 4.77 0.00 2.90 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 44 L 7.79 4.49 0.00 1.76 1.72 0.98 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 45 C 8.26 3.92 0.00 2.98 2.92 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 46 I 8.39 4.21 1.89 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 1.49 1.05 0.93 0.00 0.00 47 A 8.06 4.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 D 8.41 4.38 0.00 2.68 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 49 G 8.53 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 0.00 0.00 0.00 50 S 8.10 4.09 0.00 3.87 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 51 C 7.89 3.84 0.00 2.19 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 52 I 7.17 3.65 1.76 0.00 0.00 -0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 -0.18 0.74 0.00 0.00 53 T 7.72 4.00 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 1.21 0.00 0.00 54 A 7.35 4.54 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 55 C 7.66 4.22 0.00 3.42 2.98 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 56 P 0.00 4.16 0.00 2.20 2.15 0.00 3.77 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 1.95 1.94 0.00 57 V 6.96 4.21 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 0.60 0.00 0.00 0.91 0.00 0.00 58 N 8.15 4.15 0.00 2.83 2.89 0.00 0.00 7.06 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 59 V 7.65 3.65 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 0.05 0.00 0.00 0.70 0.00 0.00 60 F 7.80 5.36 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 61 Q 9.02 4.51 0.00 2.09 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.94 0.00 0.00 0.00 0.00 0.00 2.38 2.46 0.00 62 W 8.90 5.08 0.00 3.28 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 63 Y 9.55 4.99 0.00 3.02 2.95 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 64 D 8.44 4.61 0.00 2.35 2.40 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 65 T 9.10 4.46 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 1.08 0.00 0.00 66 P 0.00 4.15 0.00 2.16 2.05 0.00 3.73 0.00 0.00 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.90 0.00 67 G 8.86 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 H 8.03 4.54 0.00 3.12 3.40 0.00 5.64 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 69 P 0.00 4.30 0.00 2.14 2.11 0.00 3.23 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.84 0.00 70 A 7.68 4.36 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 0.00 0.00 71 S 7.03 4.56 0.00 3.94 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 72 E 8.13 4.37 0.00 1.99 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 2.19 0.00 73 K 7.63 5.08 0.00 1.75 1.50 0.00 0.90 0.00 0.00 1.17 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.84 0.62 7.81 74 K 9.20 4.78 0.00 1.12 0.74 0.00 1.34 0.00 0.00 1.36 0.00 0.00 2.94 0.00 0.00 3.04 0.00 0.00 0.00 0.00 0.30 0.57 7.81 75 A 8.72 4.31 0.90 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 0.00 0.00 76 D 9.11 5.09 0.00 3.08 2.85 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 77 P 0.00 4.45 0.00 1.95 2.06 0.00 3.82 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 2.20 0.00 78 I 7.64 3.88 1.88 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 1.32 0.79 0.95 0.00 0.00 79 N 8.36 5.01 0.00 2.69 2.66 0.00 0.00 6.58 8.24 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 80 E 8.18 3.72 0.00 2.06 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.31 0.00 81 Q 7.97 3.89 0.00 2.02 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.04 0.00 0.00 0.00 0.00 0.00 2.34 2.29 0.00 82 A 7.76 4.14 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 C 7.65 3.78 0.00 2.73 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 84 I 7.89 3.91 1.81 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 1.31 0.72 0.85 0.00 0.00 85 F 7.40 4.54 0.00 3.27 3.09 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 86 C 7.56 4.22 0.00 2.95 3.20 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 87 M 7.92 3.12 0.00 2.32 2.28 0.00 0.00 0.00 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.90 0.00 88 A 7.73 4.07 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 89 C 8.18 3.90 0.00 3.09 3.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 V 7.17 3.65 2.26 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 0.88 0.00 0.00 1.03 0.00 0.00 91 N 7.91 4.76 0.00 2.76 2.84 0.00 0.00 6.93 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 92 V 7.41 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 0.72 0.00 0.00 0.98 0.00 0.00 93 C 7.81 4.20 0.00 2.92 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 94 P 0.00 4.30 0.00 2.22 2.17 0.00 3.78 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.18 0.00 95 V 7.77 4.03 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 0.97 0.00 0.00 96 A 7.52 3.71 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 97 A 7.76 4.52 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 98 I 7.63 5.06 1.90 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.67 1.03 0.00 0.00 99 D 9.15 4.80 0.00 2.84 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 0.00 100 V 8.57 4.81 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 1.03 0.00 0.00 1.04 0.00 0.00 101 K 8.85 4.32 0.00 1.79 1.74 0.00 1.79 0.00 0.00 1.60 0.00 0.00 2.91 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.37 1.36 7.81 102 P 0.00 4.04 0.00 1.89 1.78 0.00 3.68 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 1.97 2.06 0.00 103 P 0.00 4.09 0.00 1.93 1.63 0.00 2.88 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 1.58 1.38 0.00