NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 Q 4.2546 8.2027 119.6893 55.5456 31.0380 174.3486 2 V 3.8867 7.5878 118.6906 62.4460 31.8346 173.8255 3 Q 4.7506 10.0316 127.3270 54.2959 33.7020 173.5145 4 L 5.2930 8.4909 120.5064 53.0777 46.2996 175.6467 5 V 4.9357 8.5465 122.0498 60.1913 34.4752 174.2744 6 E 5.2532 9.1585 127.5991 56.0775 31.0726 175.4958 7 S 4.5700 9.6168 116.6031 57.6983 66.6010 174.3600 8 G 4.0192 9.6132 107.9418 45.4482 0.0000 174.6905 9 G 4.2382 7.6974 106.0048 46.3315 0.0000 172.5507 10 A 4.4591 7.9106 121.7913 50.7582 22.5668 175.0927 11 L 4.7177 8.5848 121.9062 55.4081 43.0040 176.6015 12 V 4.6644 8.7216 124.7324 60.2098 35.1405 174.0697 13 Q 4.7317 8.6796 121.4155 54.9676 30.3530 173.6471 14 P 4.5719 0.0000 0.0000 64.3406 31.9382 176.0511 15 G 4.0209 9.3356 110.8730 45.3491 0.0000 173.8191 16 G 3.9498 7.9415 106.6835 46.6412 0.0000 172.4570 17 S 5.2765 8.1012 114.3078 56.9072 66.6643 173.6940 18 L 4.3702 8.3791 121.7650 54.2378 45.9332 173.4226 19 R 4.8600 8.3628 123.8261 54.5330 32.6761 174.3673 20 L 4.8640 8.4779 126.0002 53.3497 44.4715 175.5788 21 S 5.3080 9.2417 117.5269 57.0260 66.8754 172.6831 22 C 5.3164 9.4164 123.2395 54.7252 46.2209 172.2657 23 A 4.6349 9.1969 129.6660 51.1421 19.4521 175.5841 24 A 5.1517 8.3797 125.1407 50.2609 21.0884 175.9800 25 S 4.4573 9.0938 116.2008 57.6343 65.6579 175.0578 26 G 3.9814 10.9275 113.3360 46.4004 0.0000 173.0579 27 F 4.8186 6.9038 112.1517 54.9085 40.4475 171.8568 28 P 4.5391 0.0000 0.0000 61.7175 31.4946 177.0588 29 V 3.6783 8.3586 125.0011 65.2588 31.4370 176.1675 30 N 4.8711 8.1133 114.5537 52.6783 37.3624 175.3018 31 R 4.4231 8.2081 116.6784 56.3118 31.7227 175.3195 32 Y 4.9665 7.6619 114.8771 55.6461 41.6376 175.4734 33 S 4.5762 8.9035 117.8641 59.0606 64.1353 173.2026 34 M 5.1825 8.6901 120.3846 54.1076 36.7694 174.3641 35 R 5.3485 8.5866 117.8249 54.7159 35.4904 174.0647 36 W 5.5254 9.4446 121.9184 55.4952 31.9644 174.7959 37 Y 5.5560 10.0023 121.1735 56.3753 41.9061 174.4553 38 R 5.1622 9.1332 115.9098 54.9205 33.8232 174.1838 39 Q 4.6612 9.1324 120.8585 54.5587 31.8880 174.3450 40 A 4.6079 8.6280 129.5565 50.7300 19.6444 174.5544 41 P 4.3510 0.0000 0.0000 63.9770 32.1151 175.3367 42 G 4.2799 9.1989 114.2656 45.8828 0.0000 174.1441 43 K 4.3530 7.0477 117.3487 54.8648 33.2186 176.3414 44 E 4.2312 8.2639 119.3433 55.5127 30.2538 177.0910 45 R 4.2849 8.4268 121.6949 56.5071 29.9570 175.4305 46 E 4.9327 8.7326 124.4867 54.1809 32.3295 175.3259 47 W 3.4450 8.8847 132.0602 57.9768 31.1189 174.6264 48 V 4.0913 8.6251 126.2734 63.9139 32.8579 175.0033 49 A 4.4787 7.1899 119.5170 50.9286 23.0467 174.1373 50 G 4.6455 8.7318 104.9215 45.8330 0.0000 172.0085 51 M 5.4399 8.8690 119.8437 53.1787 35.8460 175.0440 52 S 4.4758 9.0468 120.7173 58.2958 64.1814 175.6065 52A S 3.9997 8.7780 115.0427 61.4972 62.7945 175.8751 53 A 3.9782 7.8560 122.4923 53.1346 18.2531 178.3168 54 G 4.0553 7.8274 104.2871 45.2923 0.0000 174.1863 55 D 4.5815 7.7894 117.6839 54.9176 40.1737 176.4133 56 R 4.8108 8.1517 119.2716 54.5807 34.2547 174.4169 57 S 5.2957 8.8217 117.8232 57.0493 66.6216 173.5434 58 S 4.8963 8.7330 117.1338 57.3992 67.3838 172.7740 59 Y 4.9374 8.5971 119.0518 55.7921 42.0568 174.9308 60 E 4.2174 8.1264 120.0807 56.2440 30.2206 177.4596 61 D 4.3905 9.2038 122.5649 57.8850 41.0094 179.0351 62 S 4.2912 7.9499 110.5735 59.7683 63.4693 174.6695 63 V 3.8243 7.7829 113.4461 60.2538 33.1057 175.6579 64 K 3.6919 7.2101 118.7494 58.1579 32.1924 177.4212 65 G 3.9049 8.5864 110.2633 45.6354 0.0000 173.7792 66 R 4.6063 7.9151 117.2372 55.6171 33.3233 175.4668 67 F 5.6045 8.0465 115.9107 55.9031 42.3041 175.1031 68 T 4.7971 9.1639 118.1998 61.9284 72.2263 172.6617 69 I 5.0970 9.3743 127.5900 59.9541 39.7509 174.5691 70 S 5.0359 8.9882 122.2541 57.4813 67.1741 172.5603 71 R 5.0956 8.4782 115.1331 54.8876 32.5780 174.3132 72 D 4.7394 8.7947 122.1317 52.9310 41.8919 176.5393 73 D 4.3661 8.9128 127.3797 57.3521 41.2837 179.2286 74 A 4.0014 8.3017 121.3488 55.0514 18.4038 178.4085 75 R 4.1738 8.2453 111.4223 55.7295 31.0494 175.5900 76 N 4.0587 7.7500 116.4461 55.0643 38.0259 173.1489 77 T 5.0451 7.6500 112.1103 61.6663 73.4502 174.6018 78 V 4.6412 8.3509 123.7813 61.3527 34.8687 173.9849 79 Y 5.5129 9.5178 123.8998 56.1828 42.1207 174.5739 80 L 4.5417 8.6149 123.6024 53.2415 44.6702 174.9583 81 Q 4.3431 9.1658 129.6129 55.5760 30.4051 174.1931 82 M 4.6508 8.9564 126.4442 53.4973 34.6957 174.7835 82A N 5.2668 8.9776 119.9754 50.7966 42.9504 173.9405 82B S 3.6776 8.5424 112.9780 59.5648 60.6822 173.7164 82C L 4.3115 7.7858 119.4850 54.9350 42.3610 177.2373 83 K 4.8401 9.7269 123.6945 53.8039 34.3768 175.7278 84 P 4.4168 0.0000 0.0000 65.0423 31.4118 178.5546 85 E 4.1054 8.1372 116.1510 58.9337 29.4399 177.3683 86 D 4.7072 8.6560 117.7822 55.3838 41.2649 176.6886 87 T 4.3351 7.8969 117.3804 63.9142 68.9364 173.5766 88 A 4.3043 8.5674 127.0422 51.8645 23.8264 174.6150 89 V 4.5089 7.9280 119.3557 62.1467 33.1230 174.3323 90 Y 5.1396 9.0367 125.8736 56.8473 40.3363 174.3455 91 Y 5.5712 9.7907 120.6745 56.5587 42.4898 172.4358 92 C 5.4464 9.4086 117.4747 53.5167 39.4711 171.8136 93 N 5.0431 8.0248 115.3247 52.6936 41.8401 173.2263 94 V 4.5718 8.0128 123.2774 60.5159 35.4942 172.4337 95 N 5.0838 8.3964 119.9478 52.0753 40.9040 174.3542 96 V 3.7591 8.5830 126.9151 60.6082 30.9224 173.7440 97 G 3.7534 7.9389 115.0110 43.7567 0.0000 171.9469 98 F 4.5111 7.3980 115.1370 54.4086 42.0828 174.3644 98 E 4.2411 7.5180 115.0370 53.3086 32.3828 175.1644 102 Y 4.7559 8.5650 122.6434 55.9437 41.6017 174.6383 103 W 5.1680 8.8751 121.4764 54.9015 32.7613 175.7307 104 G 4.2856 8.6338 110.1086 45.2980 0.0000 173.6366 105 Q 4.3527 8.9628 116.2603 56.9119 29.2941 176.8588 106 G 3.7271 9.6662 105.2939 45.8479 0.0000 172.4832 107 T 4.6291 8.4074 115.1814 59.8062 71.0703 172.5606 108 Q 4.5971 8.7140 129.8335 55.8365 30.6343 174.2263 109 V 4.6899 8.9182 127.2633 61.5505 33.8494 174.2610 110 T 4.7214 8.6525 125.1519 61.9676 71.1691 173.7277 111 V 5.1147 8.9515 128.5062 60.7409 32.1070 175.7100 112 S 4.3229 8.2044 121.1178 58.1762 62.3164 173.3112 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 Q 8.20 4.25 0.00 2.10 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.92 7.05 0.00 0.00 0.00 0.00 0.00 2.36 2.31 0.00 2 V 7.59 3.89 0.95 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 -0.36 0.00 0.00 0.59 0.00 0.00 3 Q 10.03 4.75 0.00 1.98 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.52 6.54 0.00 0.00 0.00 0.00 0.00 2.29 2.33 0.00 4 L 8.49 5.29 0.00 1.61 1.51 0.97 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 5 V 8.55 4.94 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.96 0.00 0.00 6 E 9.16 5.25 0.00 2.00 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 0.00 2.57 2.39 0.00 7 S 9.62 4.57 0.00 3.85 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 G 9.61 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 0.00 0.00 0.00 9 G 7.70 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 0.00 0.00 0.00 0.00 10 A 7.91 4.46 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 11 L 8.58 4.72 0.00 1.65 1.57 0.96 0.85 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 12 V 8.72 4.66 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 0.66 0.00 0.00 0.90 0.00 0.00 13 Q 8.68 4.73 0.00 2.15 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 7.10 0.00 0.00 0.00 0.00 0.00 2.39 2.38 0.00 14 P 0.00 4.57 0.00 2.06 2.04 0.00 3.67 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.09 0.00 15 G 9.34 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 0.00 0.00 0.00 16 G 7.94 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 17 S 8.10 5.28 0.00 3.67 3.67 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 18 L 8.38 4.37 0.00 1.59 1.24 0.84 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 19 R 8.36 4.86 0.00 1.83 1.66 0.00 3.29 0.00 0.00 3.10 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.58 0.00 20 L 8.48 4.86 0.00 0.85 1.44 0.09 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 21 S 9.24 5.31 0.00 3.82 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 22 C 9.42 5.32 0.00 2.46 2.91 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 23 A 9.20 4.63 1.22 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 24 A 8.38 5.15 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 S 9.09 4.46 0.00 3.82 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 26 G 10.93 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 27 F 6.90 4.82 0.00 3.13 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 28 P 0.00 4.54 0.00 2.51 2.24 0.00 3.94 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.12 0.00 29 V 8.36 3.68 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 0.75 0.00 0.00 30 N 8.11 4.87 0.00 2.87 3.18 0.00 0.00 5.87 7.66 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 31 R 8.21 4.42 0.00 1.76 1.55 0.00 3.16 0.00 0.00 3.12 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.65 0.00 32 Y 7.66 4.97 0.00 2.92 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 33 S 8.90 4.58 0.00 3.95 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 34 M 8.69 5.18 0.00 1.84 1.97 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.77 2.62 0.00 35 R 8.59 5.35 0.00 1.91 2.09 0.00 3.22 0.00 0.00 3.07 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 1.78 0.00 36 W 9.44 5.53 0.00 3.35 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 37 Y 10.00 5.56 0.00 3.31 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 38 R 9.13 5.16 0.00 1.13 0.94 0.00 2.49 0.00 0.00 2.79 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.43 0.00 39 Q 9.13 4.66 0.00 2.16 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.99 0.00 0.00 0.00 0.00 0.00 2.27 2.41 0.00 40 A 8.63 4.61 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 41 P 0.00 4.35 0.00 2.07 2.01 0.00 3.66 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 2.04 2.10 0.00 42 G 9.20 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 0.00 0.00 0.00 43 K 7.05 4.35 0.00 1.78 1.79 0.00 1.71 0.00 0.00 1.72 0.00 0.00 2.85 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.47 1.42 7.81 44 E 8.26 4.23 0.00 2.00 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 2.31 2.31 0.00 45 R 8.43 4.28 0.00 1.85 1.81 0.00 2.33 0.00 0.00 2.31 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.73 0.00 46 E 8.73 4.93 0.00 2.21 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.27 0.00 47 W 8.88 3.44 0.00 2.78 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 V 8.63 4.09 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 1.11 0.00 0.00 1.08 0.00 0.00 49 A 7.19 4.48 1.19 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 50 G 8.73 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 51 M 8.87 5.44 0.00 2.15 1.93 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.52 0.00 52 S 9.05 4.48 0.00 3.94 4.01 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 52A S 8.78 4.00 0.00 3.95 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 53 A 7.86 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 54 G 7.83 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 0.00 0.00 0.00 55 D 7.79 4.58 0.00 2.82 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 56 R 8.15 4.81 0.00 1.77 1.83 0.00 3.08 0.00 0.00 3.18 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.61 0.00 57 S 8.82 5.30 0.00 3.83 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 58 S 8.73 4.90 0.00 3.99 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 59 Y 8.60 4.94 0.00 2.75 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 60 E 8.13 4.22 0.00 2.07 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 2.17 2.16 0.00 61 D 9.20 4.39 0.00 2.74 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 62 S 7.95 4.29 0.00 3.90 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 63 V 7.78 3.82 0.67 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 0.23 0.00 0.00 0.82 0.00 0.00 64 K 7.21 3.69 0.00 1.86 1.71 0.00 1.78 0.00 0.00 1.81 0.00 0.00 3.11 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.56 1.58 7.81 65 G 8.59 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 0.00 0.00 0.00 66 R 7.92 4.61 0.00 1.58 2.12 0.00 2.96 0.00 0.00 2.95 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.62 0.00 67 F 8.05 5.60 0.00 2.62 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 68 T 9.16 4.80 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 1.32 0.00 0.00 69 I 9.37 5.10 2.06 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.33 0.98 0.00 0.00 70 S 8.99 5.04 0.00 4.06 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 71 R 8.48 5.10 0.00 1.96 1.97 0.00 3.07 0.00 0.00 3.22 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.80 0.00 72 D 8.79 4.74 0.00 3.00 2.78 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 73 D 8.91 4.37 0.00 2.76 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 74 A 8.30 4.00 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 75 R 8.25 4.17 0.00 1.86 2.00 0.00 3.65 0.00 0.00 3.28 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.65 0.00 76 N 7.75 4.06 0.00 2.83 2.62 0.00 0.00 6.91 6.53 0.00 0.00 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 T 7.65 5.05 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 0.68 0.00 0.00 78 V 8.35 4.64 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 1.15 0.00 0.00 0.93 0.00 0.00 79 Y 9.52 5.51 0.00 2.89 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 80 L 8.61 4.54 0.00 0.27 0.40 0.87 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.40 0.00 0.00 0.00 0.00 0.00 0.00 81 Q 9.17 4.34 0.00 2.09 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.72 6.54 0.00 0.00 0.00 0.00 0.00 2.26 2.28 0.00 82 M 8.96 4.65 0.00 1.49 1.56 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.81 0.00 82A N 8.98 5.27 0.00 2.65 2.68 0.00 0.00 7.17 7.63 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 82B S 8.54 3.68 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 82C L 7.79 4.31 0.00 1.82 1.62 0.84 1.10 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 83 K 9.73 4.84 0.00 1.77 1.70 0.00 1.66 0.00 0.00 1.63 0.00 0.00 2.87 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.37 1.50 7.81 84 P 0.00 4.42 0.00 2.18 2.14 0.00 3.89 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 2.13 2.10 0.00 85 E 8.14 4.11 0.00 1.97 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 0.00 2.32 2.34 0.00 86 D 8.66 4.71 0.00 2.89 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 T 7.90 4.34 4.37 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 1.28 0.00 0.00 88 A 8.57 4.30 1.10 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 0.00 0.00 89 V 7.93 4.51 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 0.57 0.00 0.00 0.98 0.00 0.00 90 Y 9.04 5.14 0.00 3.03 3.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 Y 9.79 5.57 0.00 3.27 3.24 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 92 C 9.41 5.45 0.00 2.31 1.56 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 93 N 8.02 5.04 0.00 2.25 2.71 0.00 0.00 6.39 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 94 V 8.01 4.57 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.36 0.00 0.00 95 N 8.40 5.08 0.00 2.58 2.63 0.00 0.00 6.70 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 96 V 8.58 3.76 1.65 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 0.49 0.00 0.00 -0.50 0.00 0.00 97 G 7.94 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 98 F 7.40 4.51 0.00 2.80 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 98 E 7.52 4.24 0.00 1.72 1.64 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 2.30 2.20 0.00 102 Y 8.56 4.76 0.00 2.63 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 0.00 103 W 8.88 5.17 0.00 3.07 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 0.00 104 G 8.63 4.29 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 0.00 105 Q 8.96 4.35 0.00 2.31 2.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.55 0.00 0.00 0.00 0.00 0.00 2.47 2.35 0.00 106 G 9.67 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 0.00 107 T 8.41 4.63 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 1.32 0.00 0.00 108 Q 8.71 4.60 0.00 2.24 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.64 0.00 0.00 0.00 0.00 0.00 2.44 2.44 0.00 109 V 8.92 4.69 2.22 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 0.83 0.00 0.00 0.57 0.00 0.00 110 T 8.65 4.72 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 111 V 8.95 5.11 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 0.89 0.00 0.00 0.97 0.00 0.00 112 S 8.20 4.32 0.00 3.87 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