NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.1957 8.3049 118.1927 53.6251 33.0321 171.8143 2 L 3.3508 7.9007 126.1695 53.0949 39.1630 172.9286 3 T 3.9496 8.7368 114.6352 63.9222 70.2504 175.3680 4 D 4.7321 7.6470 127.2721 50.7588 42.1603 173.8740 5 P 4.2325 0.0000 0.0000 65.5118 31.4643 178.2390 6 I 3.6408 7.7915 117.6455 64.5262 37.1771 177.9102 7 A 3.9697 8.7316 121.8516 55.4861 17.9222 179.1017 8 D 4.1632 7.7986 116.3642 57.5713 41.3319 177.7749 9 M 3.9073 8.0288 118.6455 58.8481 31.9389 178.3075 10 L 3.8426 7.7405 118.4952 58.1430 41.7596 179.5065 11 T 3.8201 7.7991 115.4579 66.8346 68.3621 176.5629 12 R 3.8833 8.7088 120.8717 59.4574 30.0641 179.2210 13 I 3.6089 7.7638 119.2762 64.4573 37.0050 178.5318 14 R 3.7922 9.0495 117.7398 58.6752 29.5924 177.6534 15 N 4.5190 8.1756 116.0676 55.6460 39.1013 176.8173 16 A 4.0224 8.0076 122.4610 55.5127 18.3420 179.8171 17 T 3.9747 8.0390 107.9369 65.2108 68.7752 176.8638 18 R 3.8696 7.2444 119.0551 57.4059 30.3103 177.3728 19 V 3.9032 6.9412 109.6734 59.9117 33.4538 172.9320 20 Y 3.2435 7.9935 121.2745 57.3774 34.4740 168.2433 21 K 4.6443 9.7679 124.6776 53.7391 35.1630 175.0095 22 E 4.3094 8.3123 123.9891 58.5358 29.4759 176.3489 23 S 5.1815 7.7593 113.6139 57.0214 66.9727 172.4474 24 T 4.6592 8.4310 115.8113 61.9430 72.7912 173.2683 25 D 5.6107 8.9954 124.1189 51.9539 42.3000 175.5727 26 V 4.1834 8.0735 123.6648 59.5499 33.5702 173.8704 27 P 3.7107 0.0000 0.0000 62.5456 31.7490 175.8331 28 A 3.8605 8.0598 125.3774 52.9863 19.2045 177.4332 29 S 4.2233 8.7056 110.7580 56.4992 64.2500 176.0538 30 R 3.7888 8.3838 128.2629 60.1260 29.6344 177.4477 31 F 4.2382 8.3619 119.4985 61.2254 39.3052 177.4022 32 K 3.7476 8.4913 118.4787 59.4855 31.3827 178.8037 33 E 3.5419 8.0937 118.2042 59.7178 29.1742 178.9829 34 E 3.8995 7.8356 117.6580 59.9170 29.6214 179.5675 35 I 3.5452 7.0155 117.8196 64.5237 36.9727 178.0642 36 L 3.9810 7.7130 120.3670 56.9683 41.2193 178.9656 37 R 4.0073 9.4230 118.4334 60.0880 29.8239 178.3506 38 I 3.8095 8.2454 119.5235 64.5800 37.2183 178.1196 39 L 4.1088 8.0243 120.6610 57.8197 41.5648 178.6964 40 A 4.2267 8.3343 120.6074 54.4692 19.1537 179.1352 41 R 3.9344 8.8617 116.5011 58.6452 30.1518 177.1587 42 E 4.5472 7.6009 115.2205 55.2143 31.0978 175.3414 43 G 3.7221 9.8421 106.1417 46.9656 0.0000 174.5172 44 F 4.8566 8.2041 116.1724 57.3115 41.0256 176.7692 45 I 4.7892 7.4589 112.0314 58.6626 40.4972 174.9506 46 K 4.0348 8.5852 122.7711 58.2122 32.5873 177.9219 47 G 3.9202 7.2384 104.2318 46.2668 0.0000 169.3174 48 Y 5.4485 7.2037 118.4031 56.9672 41.1614 173.5849 49 E 4.9899 9.1250 113.6602 55.6880 32.9352 176.1040 50 R 4.6435 8.9514 121.0678 57.1911 31.1152 176.8250 51 V 4.3624 8.0635 113.3421 62.3037 36.2948 173.2672 52 D 4.5950 8.4704 118.5678 55.0893 43.1417 177.5930 53 V 3.8723 9.0231 131.6880 61.9758 30.0677 174.2247 54 D 4.2015 8.3107 124.6741 54.9317 37.3124 175.1607 55 G 3.9524 8.8028 105.5659 45.6097 0.0000 172.1682 56 K 4.3989 7.4093 120.7004 53.7631 31.6151 172.5736 57 P 5.1173 0.0000 0.0000 62.7012 32.7360 175.0620 58 Y 5.0523 8.6729 123.8420 56.0442 42.3303 174.2014 59 L 4.9731 8.7268 119.7703 53.5598 45.6089 176.6237 60 R 4.2740 9.2069 125.0489 56.2584 31.4387 176.3026 61 V 4.7140 8.9671 124.5238 61.0290 33.9842 173.8449 62 Y 4.6841 9.2901 127.5118 57.8663 38.7361 175.3572 63 L 4.5048 8.8219 125.0333 53.8095 42.6797 176.0340 64 K 4.7106 8.3835 123.3074 55.0659 34.6531 174.4704 65 Y 4.9752 8.8548 123.7106 56.3648 41.9765 174.1906 66 G 4.2700 8.7573 107.9257 45.0359 0.0000 171.8229 67 P 4.7520 0.0000 0.0000 61.8369 33.0961 175.9660 68 R 4.0786 8.5827 121.8500 57.0722 30.6908 175.4349 69 R 4.7233 8.3288 120.3651 54.3057 33.3621 175.3071 70 Q 4.2827 8.4333 118.6384 56.0840 29.9366 176.3641 71 G 3.8477 8.6842 108.0550 43.5500 0.0000 170.9877 72 P 4.1975 0.0000 0.0000 63.7649 32.2531 175.6882 73 D 4.4044 8.6994 117.8008 55.0725 39.0584 173.6410 74 P 4.6813 0.0000 0.0000 62.7627 31.1370 176.6851 75 R 4.2493 8.8585 120.5877 55.6299 30.7087 175.1895 76 P 4.4634 0.0000 0.0000 62.2389 31.6913 175.9666 77 E 4.3086 9.0192 124.1909 56.8266 31.0029 175.0861 78 Q 5.0183 8.4082 121.0203 54.0398 31.2884 176.2694 79 V 3.7456 7.8607 122.1714 65.3928 32.3112 176.0936 80 I 4.2179 7.5829 121.7319 60.0588 37.2166 174.8561 81 H 4.4972 8.5546 122.1927 56.5184 29.3770 175.3398 82 H 4.0971 7.1611 117.6060 55.0457 33.3346 172.2919 83 I 4.4298 7.6686 125.4264 59.2726 41.2933 174.3205 84 R 4.4086 7.9927 127.4178 55.1128 33.7918 174.0740 85 R 3.7659 8.6634 127.1841 57.7356 30.6200 174.3506 86 I 3.8050 8.3892 125.4289 62.0914 37.4841 176.0083 87 S 3.9439 6.6160 126.5892 59.2971 62.8657 173.7025 88 K 4.6040 8.1557 127.3868 53.7358 34.0141 176.1466 89 P 4.1592 0.0000 0.0000 65.5914 31.2389 177.5503 90 G 3.7797 7.8887 105.4844 45.8816 0.0000 173.8873 91 R 4.4205 7.5436 114.5703 55.2088 32.1822 172.9707 92 R 3.6090 8.2941 121.0110 55.9361 30.8460 176.4901 93 V 4.0518 7.8414 122.0087 61.5522 33.2021 173.5567 94 Y 5.2800 8.1592 125.1029 56.5155 40.3816 175.8498 95 V 4.7158 8.3746 114.2810 59.7564 36.5654 175.8356 96 G 4.0678 9.9365 114.1282 44.2401 0.0000 175.1695 97 V 4.2451 8.2141 118.0883 63.8523 31.1605 177.5567 98 K 4.2295 7.9419 117.3440 57.4183 32.3468 177.0801 99 E 4.3573 8.1111 117.6553 56.5732 30.0604 176.8019 100 I 3.7549 7.7189 119.9743 60.8873 37.5933 174.1766 101 P 4.4999 0.0000 0.0000 62.8937 31.8266 176.7910 102 R 4.4763 7.9510 119.5401 53.6005 30.0387 174.3966 103 V 3.4393 8.0116 120.5326 64.1687 32.9040 175.8548 104 R 3.2414 9.1421 126.8110 59.5603 27.8681 175.6529 105 R 3.6578 8.6117 110.7760 57.1212 28.6430 177.1752 106 G 4.1415 8.2166 108.1235 45.8984 0.0000 176.9162 107 L 3.9062 8.2105 119.2484 57.0693 41.7220 177.6942 108 G 4.1588 7.1620 104.5171 44.5004 0.0000 171.7534 109 I 5.2539 8.7940 117.6006 58.5374 40.6682 174.7320 110 A 5.2347 8.2258 121.9045 50.3743 19.4456 175.3828 111 I 4.1170 7.6845 122.9752 61.4566 39.0287 175.8901 112 L 4.8073 8.5833 123.0339 55.0034 44.2636 173.6294 113 S 4.8992 8.8462 116.6169 57.8579 63.8506 173.0021 114 T 5.2335 8.6266 116.3244 59.5434 71.4811 174.1390 115 S 4.1941 8.9545 116.5473 60.7803 63.5404 175.4237 116 K 4.3554 7.9607 120.6197 54.9415 31.3444 174.9845 117 G 3.7745 7.9772 106.5145 44.5857 0.0000 170.8662 118 V 4.6591 7.9974 118.5187 61.6172 32.4585 174.7984 119 L 5.2031 8.3912 128.4729 53.1412 45.8194 175.1339 120 T 5.0526 8.3612 109.3628 59.4894 71.9725 174.7842 121 D 4.3637 8.0642 118.2930 56.4431 39.7190 178.3227 122 R 4.2657 8.1429 116.1008 58.3580 31.8759 177.1476 123 E 3.9329 7.7570 116.2039 60.0794 29.5262 179.2562 124 A 3.9952 8.4907 119.9030 55.5935 18.0559 179.6277 125 R 3.8377 7.9957 116.3353 59.4216 29.9493 178.4398 126 K 3.9536 8.5347 118.8292 59.6279 32.3973 178.6519 127 L 4.1360 8.5009 117.6349 55.0070 42.7772 176.9823 128 G 4.0647 7.9766 107.1362 45.7530 0.0000 172.6438 129 V 4.3121 6.8879 119.5134 60.2740 33.1873 175.7619 130 G 4.0414 8.1611 116.8069 45.9934 0.0000 171.6082 131 G 4.2971 7.1229 105.4248 44.7640 0.0000 170.3685 132 E 4.3083 8.4112 120.9840 56.6733 30.6078 177.0207 133 L 4.8619 9.0379 131.7482 54.9646 39.7355 176.8326 134 I 3.8074 8.3006 124.9990 63.2101 37.9435 174.8204 135 C 5.1494 7.6888 113.8881 59.3884 34.3305 171.7693 136 E 4.8833 7.4426 113.2002 56.0233 32.4383 174.4956 137 V 4.2558 9.2813 121.5291 59.6672 34.9773 175.4436 138 W 4.0708 7.3248 118.4220 57.1473 28.9663 174.3711 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 4.20 0.00 2.13 2.24 0.00 0.00 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.50 0.00 2 L 7.90 3.35 0.00 1.89 1.77 0.88 0.63 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 3 T 8.74 3.95 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 4 D 7.65 4.73 0.00 2.75 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 5 P 0.00 4.23 0.00 2.20 2.07 0.00 3.66 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 2.10 2.17 0.00 6 I 7.79 3.64 1.94 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 0.76 0.92 0.00 0.00 7 A 8.73 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 8 D 7.80 4.16 0.00 2.74 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 9 M 8.03 3.91 0.00 2.16 2.01 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.52 0.00 10 L 7.74 3.84 0.00 1.75 1.57 0.83 0.70 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 11 T 7.80 3.82 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 1.16 0.00 0.00 12 R 8.71 3.88 0.00 1.88 1.97 0.00 3.12 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.78 0.00 13 I 7.76 3.61 2.00 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.65 0.78 0.00 0.00 14 R 9.05 3.79 0.00 1.76 1.97 0.00 3.16 0.00 0.00 3.11 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.52 0.00 15 N 8.18 4.52 0.00 2.71 2.78 0.00 0.00 6.68 8.30 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 16 A 8.01 4.02 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 17 T 8.04 3.97 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 1.12 0.00 0.00 18 R 7.24 3.87 0.00 1.94 1.93 0.00 3.05 0.00 0.00 3.29 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.64 0.00 19 V 6.94 3.90 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 0.63 0.00 0.00 0.97 0.00 0.00 20 Y 7.99 3.24 0.00 2.97 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 21 K 9.77 4.64 0.00 1.59 1.73 0.00 1.82 0.00 0.00 1.64 0.00 0.00 2.86 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.49 1.35 7.81 22 E 8.31 4.31 0.00 2.20 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 2.52 2.62 0.00 23 S 7.76 5.18 0.00 3.18 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 24 T 8.43 4.66 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 1.18 0.00 0.00 25 D 9.00 5.61 0.00 2.52 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 26 V 8.07 4.18 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 0.74 0.00 0.00 0.84 0.00 0.00 27 P 0.00 3.71 0.00 1.69 1.53 0.00 3.55 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 1.79 1.35 0.00 28 A 8.06 3.86 1.24 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 29 S 8.71 4.22 0.00 3.78 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 30 R 8.38 3.79 0.00 1.94 1.99 0.00 3.29 0.00 0.00 3.30 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.77 0.00 31 F 8.36 4.24 0.00 3.12 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 32 K 8.49 3.75 0.00 1.85 1.68 0.00 1.79 0.00 0.00 1.55 0.00 0.00 3.00 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.38 1.49 7.81 33 E 8.09 3.54 0.00 2.06 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 2.11 2.48 0.00 34 E 7.84 3.90 0.00 1.86 1.89 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 2.52 2.55 0.00 35 I 7.02 3.55 1.73 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.15 0.78 0.00 0.00 36 L 7.71 3.98 0.00 1.51 1.32 0.45 0.59 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 37 R 9.42 4.01 0.00 2.01 2.16 0.00 3.15 0.00 0.00 3.22 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.80 0.00 38 I 8.25 3.81 1.95 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 1.43 0.86 0.96 0.00 0.00 39 L 8.02 4.11 0.00 2.07 1.78 0.85 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 40 A 8.33 4.23 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.86 3.93 0.00 1.76 2.08 0.00 3.25 0.00 0.00 3.25 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.71 0.00 42 E 7.60 4.55 0.00 2.07 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 0.00 2.48 2.51 0.00 43 G 9.84 3.72 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 0.00 0.00 0.00 44 F 8.20 4.86 0.00 3.41 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 45 I 7.46 4.79 2.24 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.81 0.97 0.00 0.00 46 K 8.59 4.03 0.00 1.88 1.97 0.00 1.94 0.00 0.00 1.72 0.00 0.00 2.92 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.54 1.52 7.81 47 G 7.24 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 0.00 0.00 0.00 48 Y 7.20 5.45 0.00 3.18 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 49 E 9.13 4.99 0.00 2.11 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 2.51 2.37 0.00 50 R 8.95 4.64 0.00 1.80 1.98 0.00 3.25 0.00 0.00 3.29 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.82 0.00 51 V 8.06 4.36 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 0.88 0.00 0.00 1.09 0.00 0.00 52 D 8.47 4.60 0.00 2.59 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 53 V 9.02 3.87 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 0.68 0.00 0.00 0.48 0.00 0.00 54 D 8.31 4.20 0.00 2.92 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 55 G 8.80 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 56 K 7.41 4.40 0.00 1.95 2.10 0.00 1.88 0.00 0.00 1.82 0.00 0.00 3.02 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.45 1.73 7.81 57 P 0.00 5.12 0.00 2.15 2.36 0.00 3.87 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 1.86 0.00 58 Y 8.67 5.05 0.00 2.85 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 59 L 8.73 4.97 0.00 1.47 1.50 0.72 0.93 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 60 R 9.21 4.27 0.00 1.88 1.36 0.00 3.06 0.00 0.00 3.17 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.78 0.00 61 V 8.97 4.71 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 0.98 0.00 0.00 0.90 0.00 0.00 62 Y 9.29 4.68 0.00 3.12 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 63 L 8.82 4.50 0.00 1.93 1.21 0.88 0.97 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 64 K 8.38 4.71 0.00 1.94 1.65 0.00 1.67 0.00 0.00 1.84 0.00 0.00 2.83 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.45 1.49 7.81 65 Y 8.85 4.98 0.00 2.81 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 66 G 8.76 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 0.00 0.00 0.00 0.00 67 P 0.00 4.75 0.00 2.13 2.19 0.00 3.75 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 1.97 0.00 68 R 8.58 4.08 0.00 1.79 1.86 0.00 3.12 0.00 0.00 3.19 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.75 0.00 69 R 8.33 4.72 0.00 1.79 1.79 0.00 3.28 0.00 0.00 3.45 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.72 0.00 70 Q 8.43 4.28 0.00 2.04 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.39 0.00 0.00 0.00 0.00 0.00 2.31 2.29 0.00 71 G 8.68 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 0.00 0.00 0.00 72 P 0.00 4.20 0.00 2.06 2.02 0.00 3.84 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.09 0.00 73 D 8.70 4.40 0.00 2.88 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 74 P 0.00 4.68 0.00 2.19 2.23 0.00 3.82 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 1.97 1.98 0.00 75 R 8.86 4.25 0.00 1.80 2.07 0.00 3.43 0.00 0.00 3.38 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.96 0.00 76 P 0.00 4.46 0.00 2.04 1.90 0.00 2.70 0.00 0.00 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 1.24 0.00 77 E 9.02 4.31 0.00 2.14 1.94 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 2.47 2.47 0.00 78 Q 8.41 5.02 0.00 1.93 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.75 6.85 0.00 0.00 0.00 0.00 0.00 2.75 2.59 0.00 79 V 7.86 3.75 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 1.04 0.00 0.00 0.98 0.00 0.00 80 I 7.58 4.22 1.66 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.72 0.54 0.00 0.00 81 H 8.55 4.50 0.00 3.04 3.39 0.00 5.93 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 82 H 7.16 4.10 0.00 2.18 1.31 0.00 5.72 0.00 0.00 0.00 0.00 6.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 I 7.67 4.43 1.52 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.81 0.68 0.00 0.00 84 R 7.99 4.41 0.00 1.66 1.61 0.00 3.16 0.00 0.00 3.14 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.52 0.00 85 R 8.66 3.77 0.00 1.82 1.78 0.00 3.39 0.00 0.00 3.20 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.73 0.00 86 I 8.39 3.81 2.09 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 1.19 1.01 0.91 0.00 0.00 87 S 6.62 3.94 0.00 3.91 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 88 K 8.16 4.60 0.00 1.81 1.66 0.00 1.70 0.00 0.00 1.84 0.00 0.00 2.93 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.42 1.54 7.81 89 P 0.00 4.16 0.00 2.15 2.16 0.00 3.73 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.95 0.00 90 G 7.89 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 91 R 7.54 4.42 0.00 1.67 1.75 0.00 3.25 0.00 0.00 3.18 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.45 0.00 92 R 8.29 3.61 0.00 1.41 1.30 0.00 3.47 0.00 0.00 3.13 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.61 0.00 93 V 7.84 4.05 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 1.05 0.00 0.00 0.94 0.00 0.00 94 Y 8.16 5.28 0.00 2.93 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 95 V 8.37 4.72 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 0.87 0.00 0.00 1.02 0.00 0.00 96 G 9.94 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 97 V 8.21 4.25 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 0.77 0.00 0.00 0.98 0.00 0.00 98 K 7.94 4.23 0.00 1.78 1.91 0.00 1.74 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.43 1.46 7.81 99 E 8.11 4.36 0.00 2.20 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 2.31 2.29 0.00 100 I 7.72 3.75 1.89 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 1.45 0.66 0.94 0.00 0.00 101 P 0.00 4.50 0.00 2.08 2.01 0.00 3.65 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.13 0.00 102 R 7.95 4.48 0.00 1.72 1.83 0.00 3.26 0.00 0.00 3.15 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.63 0.00 103 V 8.01 3.44 2.29 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 1.31 0.00 0.00 1.03 0.00 0.00 104 R 9.14 3.24 0.00 1.42 1.72 0.00 2.54 0.00 0.00 2.25 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 1.30 0.00 105 R 8.61 3.66 0.00 1.81 1.90 0.00 3.35 0.00 0.00 3.19 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.49 0.00 106 G 8.22 4.14 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 0.00 107 L 8.21 3.91 0.00 1.62 1.77 0.88 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 108 G 7.16 4.16 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 I 8.79 5.25 2.10 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.63 1.29 0.00 0.00 110 A 8.23 5.23 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 0.00 111 I 7.68 4.12 1.86 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 1.42 1.13 0.88 0.00 0.00 112 L 8.58 4.81 0.00 2.00 1.88 0.98 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 113 S 8.85 4.90 0.00 4.22 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 0.00 114 T 8.63 5.23 4.39 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 1.28 0.00 0.00 115 S 8.95 4.19 0.00 3.99 4.04 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 0.00 116 K 7.96 4.36 0.00 1.79 1.82 0.00 1.69 0.00 0.00 1.72 0.00 0.00 2.99 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.39 1.36 7.81 117 G 7.98 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 0.00 118 V 8.00 4.66 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 0.91 0.00 0.00 1.01 0.00 0.00 119 L 8.39 5.20 0.00 1.60 1.62 0.96 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 120 T 8.36 5.05 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 1.29 0.00 0.00 121 D 8.06 4.36 0.00 2.91 3.06 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 0.00 122 R 8.14 4.27 0.00 1.87 1.98 0.00 3.18 0.00 0.00 3.35 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.70 0.00 123 E 7.76 3.93 0.00 2.25 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 0.00 2.36 2.40 0.00 124 A 8.49 4.00 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 0.00 125 R 8.00 3.84 0.00 2.01 2.19 0.00 3.20 0.00 0.00 3.27 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.71 0.00 126 K 8.53 3.95 0.00 1.86 1.99 0.00 1.87 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.46 1.49 7.81 127 L 8.50 4.14 0.00 1.77 1.73 0.93 0.98 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 0.00 128 G 7.98 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 0.00 129 V 6.89 4.31 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 0.86 0.00 0.00 0.99 0.00 0.00 130 G 8.16 4.04 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 0.00 0.00 0.00 131 G 7.12 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 0.00 0.00 0.00 0.00 132 E 8.41 4.31 0.00 2.36 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 2.20 0.00 133 L 9.04 4.86 0.00 1.78 1.64 0.94 0.90 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 0.00 134 I 8.30 3.81 2.09 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.19 0.95 0.00 0.00 135 C 7.69 5.15 0.00 3.24 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 136 E 7.44 4.88 0.00 2.46 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 2.25 2.31 0.00 137 V 9.28 4.26 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 0.04 0.00 0.00 0.71 0.00 0.00 138 W 7.32 4.07 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