NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3447 8.3049 120.3466 55.2621 33.3343 175.0548 2 L 4.1631 8.0867 124.7989 53.9372 42.9386 175.6257 3 Q 4.7805 8.5116 116.2404 55.8758 31.2421 172.2841 4 P 4.3435 0.0000 0.0000 64.2449 32.5991 177.8395 5 K 4.3251 7.0608 117.6826 54.4069 31.9961 177.1240 6 R 3.7702 8.8510 116.0831 57.4221 28.8116 175.0778 7 T 3.4908 8.6565 101.1035 63.0221 67.0106 169.5489 8 K 4.5975 7.3829 123.2132 55.8059 36.0039 174.0754 9 F 4.7897 8.8905 115.3920 56.1812 39.6633 174.8893 10 R 4.0343 8.2465 118.1262 58.1247 30.4432 177.2637 11 K 4.0036 6.0479 115.5657 56.4284 34.1124 174.1386 12 M 3.6054 8.4035 116.6447 54.7531 30.1234 177.8960 13 H 4.1910 8.3475 113.2655 55.1168 26.5806 173.6874 14 K 4.7292 8.2434 118.1792 56.0386 35.8404 176.7576 15 G 3.8133 8.8923 105.3577 47.2303 0.0000 172.4182 16 R 3.3457 8.4955 117.6225 56.4020 29.9231 175.0744 17 N 4.1964 7.6487 110.0771 52.6139 38.9252 173.5543 18 R 4.9008 8.4218 123.4785 54.4882 32.4282 174.2812 19 G 4.3130 8.3358 107.7082 45.3600 0.0000 170.6380 20 L 4.8783 8.1608 120.3702 53.8336 47.0976 175.1310 21 A 4.6942 7.9545 125.1951 52.7576 20.1898 179.7992 22 Q 4.4667 8.9407 118.6752 56.7963 30.3832 175.1117 23 G 4.1658 8.1073 106.4118 46.0679 0.0000 172.7513 24 T 4.9294 8.2068 114.0037 62.1182 73.5725 172.6953 25 D 4.8916 8.4845 122.0027 53.0362 43.8543 175.0851 26 V 4.1402 7.8981 127.2755 63.3505 33.8943 174.1096 27 S 4.4749 7.3306 109.2824 58.3603 63.9820 175.9998 28 F 4.5768 8.5391 121.7247 56.4916 42.4070 174.1343 29 G 4.4246 7.4802 108.1018 44.0416 0.0000 171.8178 30 S 4.6428 9.2644 115.0278 60.1964 63.9098 174.9175 31 F 4.9555 7.6976 121.4635 56.5458 42.6199 173.2605 32 G 4.5704 8.0679 111.7055 44.2770 0.0000 171.9081 33 L 4.8139 8.5582 121.7432 53.1685 44.4367 175.0193 34 K 4.7289 8.7195 127.1434 54.9167 34.5921 175.0432 35 A 4.9755 8.3851 126.0497 50.2492 22.2992 176.5016 36 V 4.1934 9.3268 119.0397 63.6030 33.5417 174.5764 37 G 3.9613 8.4952 114.8375 43.7887 0.0000 172.9456 38 R 4.1479 8.7019 125.3104 57.1039 31.0534 175.3061 39 G 4.0680 8.0819 108.1146 46.4272 0.0000 171.7714 40 R 4.8146 8.6486 119.3669 54.2483 30.7441 177.5587 41 L 4.7272 8.2763 130.8715 52.8116 40.3407 175.7568 42 T 4.2473 7.7727 116.5995 61.6198 68.8944 174.1458 43 A 3.7909 8.9829 129.1457 55.6592 18.1021 180.2911 44 R 4.0516 7.5634 116.8064 58.8294 30.1646 179.0528 45 Q 3.9626 7.9110 116.9884 59.1978 28.8520 178.7314 46 I 3.8194 8.0638 120.9969 64.5044 37.1773 178.4705 47 E 3.8757 8.4979 119.3867 59.2335 29.0992 178.9278 48 A 4.0661 7.8236 119.3286 55.6065 18.6807 179.1061 49 A 4.0291 8.1845 119.0770 55.2272 18.3861 179.7466 50 R 3.8775 8.2173 115.2766 59.5722 30.2000 179.4060 51 R 3.9183 8.3008 116.6738 59.1534 30.0528 177.4773 52 A 4.3010 7.6550 118.0970 53.0783 18.7234 178.4471 53 M 4.2294 8.1368 118.2298 58.5990 32.5911 177.9223 54 T 3.7661 8.5387 108.4195 66.0061 68.8587 174.9137 55 R 3.4885 8.4933 117.0971 58.4835 27.0975 174.3720 56 A 3.8888 7.8172 127.5182 52.3155 17.6855 178.4464 57 V 3.7841 8.8073 119.8545 64.7695 30.6862 176.6184 58 K 4.5925 8.4565 112.8906 55.6158 36.7367 175.5498 59 R 4.3722 8.3625 120.1552 56.0440 30.0784 176.2433 60 Q 4.0486 8.0897 117.1178 57.3484 30.1428 178.4491 61 G 3.7896 8.5541 111.0105 46.6529 0.0000 172.5752 62 K 4.5208 8.0897 117.9952 55.2790 36.5933 175.6636 63 I 4.4276 8.0042 117.9076 59.2168 39.1700 175.4160 64 W 4.8134 8.7828 123.1389 56.9716 32.5287 176.3985 65 I 4.5812 8.4242 130.2035 62.4217 39.6070 173.9329 66 R 4.4508 8.7201 127.6237 57.3659 30.9391 177.5258 67 V 4.0040 7.7128 116.8848 62.4579 32.3050 175.3752 68 F 4.3584 8.5994 127.4925 56.4438 41.1292 171.9629 69 P 4.5857 0.0000 0.0000 63.7337 31.2579 176.2490 70 D 4.7609 8.4521 119.0866 52.6325 41.4469 176.7751 71 K 4.1525 8.2315 118.6636 57.2867 33.8682 176.8927 72 P 4.1409 0.0000 0.0000 64.4486 27.9753 177.5979 73 I 4.5173 7.8717 119.2464 59.9035 39.2188 175.2675 74 T 4.7344 8.2646 121.6497 62.7042 69.7137 174.2016 75 E 4.9748 8.5239 123.3760 54.5077 33.8222 174.9539 76 K 4.7399 8.4241 119.7160 54.4492 35.4958 176.1133 77 P 4.6016 0.0000 0.0000 62.9345 32.2079 175.9774 78 L 4.2615 8.3662 114.2244 55.9217 42.1516 176.5123 79 A 4.6685 7.5081 119.1389 49.3585 21.9427 176.2721 80 V 3.5952 8.0899 119.3652 63.0973 31.7075 174.7319 81 R 4.2809 8.2916 121.2787 56.5941 31.2469 175.8868 82 M 3.1997 8.5231 121.9340 56.3622 30.0091 177.2823 83 G 3.8067 7.7438 104.8715 46.0884 0.0000 173.9537 84 K 4.1531 7.1684 128.5887 54.0804 34.5473 172.5814 85 G 3.1373 8.4953 112.0369 44.1446 0.0000 171.7249 86 K 3.7860 7.5342 123.5077 55.7015 33.5300 175.4449 87 G 3.8746 8.4962 110.9204 46.0028 0.0000 171.9618 88 N 4.7660 8.2051 113.3413 49.8631 39.3351 177.8800 89 V 3.5419 9.0002 124.3586 61.4468 32.7043 172.5740 90 E 3.5353 7.8640 117.7829 55.1953 30.7388 174.1649 91 Y 4.9828 7.3630 115.3536 55.8891 42.1230 174.7142 92 W 4.4281 8.1968 126.8239 57.6345 33.3371 174.5773 93 V 3.7773 8.9973 123.9705 63.9386 32.3567 175.1284 94 A 3.5998 8.4208 118.7493 52.4873 14.3695 175.7623 95 L 4.5175 7.4616 120.4576 54.3149 42.4407 175.8109 96 I 4.5550 7.4052 115.7875 61.8371 40.1101 176.8893 97 Q 5.2758 7.7582 122.3285 54.6188 29.8704 172.6710 98 P 5.4619 0.0000 0.0000 62.0070 33.6761 174.7912 99 G 4.2527 8.3538 107.4200 45.0095 0.0000 174.9205 100 K 4.5320 8.2850 120.3705 55.7992 33.5133 173.6763 101 V 4.6273 8.4218 127.8072 61.1381 40.1535 169.0561 102 L 4.2068 8.3287 125.3422 54.4513 42.1410 173.1610 103 Y 4.5688 8.6242 118.5662 57.7709 41.5945 173.7001 104 E 4.2573 9.3658 125.7104 58.4185 29.3874 177.8399 105 M 3.9750 9.2384 114.2813 56.8996 33.6223 174.0426 106 D 4.2477 9.4845 121.8236 55.8222 41.8735 180.1861 107 G 3.9553 9.1246 114.5467 47.5946 0.0000 175.8374 108 V 5.1289 8.4555 115.8850 61.0308 32.8954 175.9274 109 P 2.9700 0.0000 0.0000 64.9405 31.7523 177.1736 110 E 3.0421 7.6754 117.3575 59.3987 30.4392 176.4147 111 E 3.6451 8.0738 116.2587 59.5943 29.3337 178.6416 112 L 3.9261 8.1371 119.3887 58.8243 42.3186 179.4874 113 A 4.0314 7.2989 119.9239 55.5909 18.3257 179.5320 114 R 4.0227 8.2420 116.7356 59.2391 30.1046 178.1512 115 E 4.3046 8.1960 116.8248 58.1335 29.5060 177.1189 116 A 4.8021 7.5889 121.5100 51.7239 19.7618 177.0521 117 F 4.6113 8.3761 117.1140 60.0840 38.8153 178.0031 118 K 3.5378 7.0446 121.7011 58.8151 32.1772 177.4681 119 L 3.9622 7.9463 117.7186 57.5167 41.7025 177.7354 120 A 4.1968 7.4251 119.9419 51.7580 18.9607 177.3997 121 A 4.0260 8.7314 124.0826 54.7224 18.8608 178.0429 122 A 4.5461 7.7396 116.3251 51.2819 20.7899 176.6834 123 K 4.7553 8.4977 117.9761 54.9291 34.2617 176.0465 124 L 5.1929 8.4233 124.6393 53.1591 42.7698 174.8415 125 P 4.5352 0.0000 0.0000 61.6384 32.3594 177.0627 126 I 3.3912 8.2553 111.9736 61.8436 37.3751 177.1585 127 K 3.6450 7.3450 121.5273 56.0853 32.0342 172.6511 128 T 3.9720 7.0167 105.1114 60.6240 70.3696 174.0248 129 T 3.7157 7.2695 114.7683 60.3550 70.5904 172.1215 130 F 4.2860 8.6975 126.9076 58.5773 39.6979 174.2424 131 V 3.8561 6.7036 124.9195 61.7165 33.6349 172.6521 132 T 4.2001 7.7285 109.6458 61.1097 68.7229 172.3918 133 K 4.3685 7.7474 121.0995 56.4200 35.1144 173.3987 134 T 4.1763 7.9648 115.9822 63.2061 72.2912 173.0960 135 V 4.2699 8.0041 126.5166 63.5629 34.7414 174.4734 136 M 3.4494 8.7287 125.0981 56.1595 33.0014 176.0539 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 8.30 4.34 0.00 1.98 2.03 0.00 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.51 0.00 2 L 8.09 4.16 0.00 1.67 1.54 0.88 0.55 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 3 Q 8.51 4.78 0.00 1.92 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 7.09 0.00 0.00 0.00 0.00 0.00 2.13 2.18 0.00 4 P 0.00 4.34 0.00 1.61 1.94 0.00 3.35 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 1.83 1.93 0.00 5 K 7.06 4.33 0.00 1.20 1.18 0.00 2.17 0.00 0.00 1.79 0.00 0.00 3.11 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.50 1.71 7.81 6 R 8.85 3.77 0.00 2.00 2.00 0.00 3.70 0.00 0.00 3.51 7.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.75 0.00 7 T 8.66 3.49 4.33 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 1.26 0.00 0.00 8 K 7.38 4.60 0.00 1.86 1.98 0.00 1.94 0.00 0.00 1.95 0.00 0.00 3.22 0.00 0.00 3.27 0.00 0.00 0.00 0.00 1.49 1.59 7.81 9 F 8.89 4.79 0.00 3.22 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 10 R 8.25 4.03 0.00 1.68 1.90 0.00 3.17 0.00 0.00 3.26 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.60 0.00 11 K 6.05 4.00 0.00 1.59 1.68 0.00 1.49 0.00 0.00 1.46 0.00 0.00 3.05 0.00 0.00 3.02 0.00 0.00 0.00 0.00 0.65 1.39 7.81 12 M 8.40 3.61 0.00 2.24 2.68 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 2.62 3.00 0.00 13 H 8.35 4.19 0.00 3.28 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 14 K 8.24 4.73 0.00 1.81 1.74 0.00 1.70 0.00 0.00 1.71 0.00 0.00 2.77 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.30 1.37 7.81 15 G 8.89 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 16 R 8.50 3.35 0.00 1.99 1.97 0.00 3.06 0.00 0.00 3.25 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.57 0.00 17 N 7.65 4.20 0.00 2.77 2.81 0.00 0.00 5.83 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 18 R 8.42 4.90 0.00 1.86 1.93 0.00 3.09 0.00 0.00 3.10 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.46 0.00 19 G 8.34 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 20 L 8.16 4.88 0.00 1.58 1.58 0.94 0.69 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 21 A 7.95 4.69 0.89 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 0.00 0.00 22 Q 8.94 4.47 0.00 2.05 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.82 0.00 0.00 0.00 0.00 0.00 2.31 2.34 0.00 23 G 8.11 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 0.00 0.00 0.00 0.00 24 T 8.21 4.93 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 1.21 0.00 0.00 25 D 8.48 4.89 0.00 2.58 2.47 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 26 V 7.90 4.14 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 0.71 0.00 0.00 0.97 0.00 0.00 27 S 7.33 4.47 0.00 3.63 3.69 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 28 F 8.54 4.58 0.00 2.14 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 29 G 7.48 4.42 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 0.00 30 S 9.26 4.64 0.00 3.90 4.07 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 31 F 7.70 4.96 0.00 3.16 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 32 G 8.07 4.57 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 0.00 0.00 0.00 33 L 8.56 4.81 0.00 1.88 1.70 1.04 0.38 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 34 K 8.72 4.73 0.00 1.80 1.66 0.00 1.98 0.00 0.00 1.70 0.00 0.00 2.84 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.35 1.68 7.81 35 A 8.39 4.98 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 36 V 9.33 4.19 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 0.78 0.00 0.00 0.95 0.00 0.00 37 G 8.50 3.96 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 0.00 0.00 0.00 38 R 8.70 4.15 0.00 1.84 1.93 0.00 3.60 0.00 0.00 3.46 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.66 0.00 39 G 8.08 4.07 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 0.00 0.00 0.00 40 R 8.65 4.81 0.00 1.18 0.66 0.00 2.21 0.00 0.00 2.25 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.66 1.26 0.00 41 L 8.28 4.73 0.00 1.92 1.68 1.02 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 42 T 7.77 4.25 4.48 0.00 0.00 0.00 0.00 0.00 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 43 A 8.98 3.79 0.57 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 0.00 0.00 44 R 7.56 4.05 0.00 1.94 2.02 0.00 3.52 0.00 0.00 3.60 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.52 0.00 45 Q 7.91 3.96 0.00 2.41 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.87 0.00 0.00 0.00 0.00 0.00 2.44 2.44 0.00 46 I 8.06 3.82 1.93 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 1.54 0.95 0.89 0.00 0.00 47 E 8.50 3.88 0.00 1.91 1.93 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 2.22 2.27 0.00 48 A 7.82 4.07 1.38 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 0.00 0.00 49 A 8.18 4.03 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 50 R 8.22 3.88 0.00 1.86 2.03 0.00 3.38 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.83 0.00 51 R 8.30 3.92 0.00 1.83 2.01 0.00 3.24 0.00 0.00 3.22 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.64 0.00 52 A 7.66 4.30 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 53 M 8.14 4.23 0.00 2.17 2.26 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.89 2.60 0.00 54 T 8.54 3.77 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 1.20 0.00 0.00 55 R 8.49 3.49 0.00 1.98 2.32 0.00 3.55 0.00 0.00 3.24 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.64 0.00 56 A 7.82 3.89 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 57 V 8.81 3.78 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 0.84 0.00 0.00 1.11 0.00 0.00 58 K 8.46 4.59 0.00 1.76 1.66 0.00 1.80 0.00 0.00 1.64 0.00 0.00 3.00 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.36 1.44 7.81 59 R 8.36 4.37 0.00 1.75 1.89 0.00 3.23 0.00 0.00 3.13 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.58 0.00 60 Q 8.09 4.05 0.00 2.05 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.73 0.00 0.00 0.00 0.00 0.00 2.39 2.49 0.00 61 G 8.55 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 62 K 8.09 4.52 0.00 1.95 1.32 0.00 1.57 0.00 0.00 1.77 0.00 0.00 2.80 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.32 1.17 7.81 63 I 8.00 4.43 1.74 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.85 0.25 0.00 0.00 64 W 8.78 4.81 0.00 3.35 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 65 I 8.42 4.58 1.97 0.00 0.00 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 1.65 0.63 1.01 0.00 0.00 66 R 8.72 4.45 0.00 2.09 2.08 0.00 3.72 0.00 0.00 3.60 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.69 0.00 67 V 7.71 4.00 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 0.83 0.00 0.00 1.02 0.00 0.00 68 F 8.60 4.36 0.00 3.09 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 69 P 0.00 4.59 0.00 2.20 2.06 0.00 3.08 0.00 0.00 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.72 0.00 70 D 8.45 4.76 0.00 2.67 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 71 K 8.23 4.15 0.00 1.88 1.77 0.00 2.07 0.00 0.00 2.20 0.00 0.00 3.05 0.00 0.00 3.28 0.00 0.00 0.00 0.00 1.65 1.59 7.81 72 P 0.00 4.14 0.00 2.10 2.46 0.00 3.69 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 2.03 2.17 0.00 73 I 7.87 4.52 2.00 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 2.10 1.13 0.00 0.00 74 T 8.26 4.73 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 1.31 0.00 0.00 75 E 8.52 4.97 0.00 1.72 1.77 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 2.22 2.20 0.00 76 K 8.42 4.74 0.00 1.70 1.73 0.00 1.59 0.00 0.00 1.75 0.00 0.00 2.81 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.28 1.33 7.81 77 P 0.00 4.60 0.00 2.19 2.05 0.00 3.75 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.94 0.00 78 L 8.37 4.26 0.00 1.60 1.67 0.91 0.88 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 79 A 7.51 4.67 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 80 V 8.09 3.60 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 0.79 0.00 0.00 0.93 0.00 0.00 81 R 8.29 4.28 0.00 1.78 1.80 0.00 3.46 0.00 0.00 3.28 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.67 0.00 82 M 8.52 3.20 0.00 2.24 2.17 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.52 0.00 83 G 7.74 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 84 K 7.17 4.15 0.00 1.73 1.63 0.00 1.81 0.00 0.00 1.70 0.00 0.00 3.00 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.17 1.14 7.81 85 G 8.50 3.14 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 0.00 0.00 0.00 86 K 7.53 3.79 0.00 1.71 2.06 0.00 1.79 0.00 0.00 1.69 0.00 0.00 3.24 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.42 1.48 7.81 87 G 8.50 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 88 N 8.21 4.77 0.00 2.99 2.90 0.00 0.00 6.51 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 89 V 9.00 3.54 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 0.54 0.00 0.00 0.88 0.00 0.00 90 E 7.86 3.54 0.00 1.82 1.86 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 2.40 2.26 0.00 91 Y 7.36 4.98 0.00 3.05 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 92 W 8.20 4.43 0.00 3.38 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 93 V 9.00 3.78 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 0.95 0.00 0.00 1.03 0.00 0.00 94 A 8.42 3.60 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 L 7.46 4.52 0.00 1.90 1.81 1.00 0.96 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 96 I 7.41 4.56 1.90 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.75 0.98 0.00 0.00 97 Q 7.76 5.28 0.00 1.88 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 7.05 0.00 0.00 0.00 0.00 0.00 2.29 2.39 0.00 98 P 0.00 5.46 0.00 2.16 2.22 0.00 3.89 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 1.87 0.00 99 G 8.35 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 0.00 0.00 0.00 0.00 100 K 8.28 4.53 0.00 1.80 1.95 0.00 1.80 0.00 0.00 1.72 0.00 0.00 3.07 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.40 1.47 7.81 101 V 8.42 4.63 2.39 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 1.34 0.00 0.00 1.11 0.00 0.00 102 L 8.33 4.21 0.00 1.86 1.21 0.90 0.80 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 0.00 103 Y 8.62 4.57 0.00 3.18 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 0.00 104 E 9.37 4.26 0.00 2.36 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 2.42 2.46 0.00 105 M 9.24 3.98 0.00 2.13 2.09 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.68 0.00 106 D 9.48 4.25 0.00 2.75 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 0.00 107 G 9.12 3.96 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 0.00 0.00 0.00 108 V 8.46 5.13 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 0.75 0.00 0.00 0.92 0.00 0.00 109 P 0.00 2.97 0.00 1.17 1.83 0.00 3.77 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 1.80 1.93 0.00 110 E 7.68 3.04 0.00 1.57 1.79 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 2.22 2.57 0.00 111 E 8.07 3.65 0.00 2.14 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 0.00 2.35 2.36 0.00 112 L 8.14 3.93 0.00 1.66 1.62 1.20 1.19 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 0.00 113 A 7.30 4.03 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 0.00 114 R 8.24 4.02 0.00 1.83 2.08 0.00 3.11 0.00 0.00 3.25 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.42 0.00 115 E 8.20 4.30 0.00 2.18 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 2.37 2.41 0.00 116 A 7.59 4.80 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 0.00 117 F 8.38 4.61 0.00 3.29 3.51 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 0.00 118 K 7.04 3.54 0.00 0.94 1.49 0.00 1.61 0.00 0.00 1.59 0.00 0.00 2.94 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.25 1.27 7.81 119 L 7.95 3.96 0.00 1.65 1.72 0.88 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 120 A 7.43 4.20 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 0.00 121 A 8.73 4.03 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 0.00 122 A 7.74 4.55 1.32 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 0.00 123 K 8.50 4.76 0.00 1.76 1.77 0.00 1.66 0.00 0.00 1.90 0.00 0.00 2.92 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.54 1.47 7.81 124 L 8.42 5.19 0.00 1.67 1.70 1.10 0.80 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 0.00 125 P 0.00 4.54 0.00 2.22 2.21 0.00 3.97 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 1.94 0.00 126 I 8.26 3.39 2.00 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 1.29 0.60 0.92 0.00 0.00 127 K 7.35 3.64 0.00 1.90 1.89 0.00 1.56 0.00 0.00 1.38 0.00 0.00 2.89 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.23 1.42 7.81 128 T 7.02 3.97 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 1.12 0.00 0.00 129 T 7.27 3.72 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 1.12 0.00 0.00 130 F 8.70 4.29 0.00 2.90 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 0.00 131 V 6.70 3.86 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 0.58 0.00 0.00 0.85 0.00 0.00 132 T 7.73 4.20 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 1.01 0.00 0.00 133 K 7.75 4.37 0.00 1.62 1.53 0.00 1.83 0.00 0.00 1.67 0.00 0.00 2.77 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.28 1.35 7.81 134 T 7.96 4.18 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 1.16 0.00 0.00 135 V 8.00 4.27 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 0.75 0.00 0.00 0.92 0.00 0.00 136 M 8.73 3.45 0.00 2.17 2.00 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.51 0.00