NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.2826 8.1627 120.5979 55.3407 33.8979 173.4613 2 L 4.7328 8.2183 128.4090 53.4565 43.5589 173.6509 3 Y 4.8656 9.9461 124.4002 56.4956 43.0172 173.9572 4 H 5.0176 8.9821 118.0653 54.1997 31.2205 173.4995 5 L 4.5871 8.4435 127.1953 53.7792 42.7294 175.9127 6 F 4.8778 9.1293 125.6245 56.4786 40.1089 176.3919 7 V 2.6362 8.5965 121.7661 62.7107 31.7800 175.6678 8 N 4.1651 8.1033 117.5557 52.5926 36.8105 172.6186 9 N 4.9462 7.4989 115.2370 53.9702 42.6226 172.2215 10 Q 4.9821 8.3710 115.5414 55.8008 31.9660 173.7605 11 V 4.5221 8.3811 111.8691 59.3419 35.4764 175.0716 12 K 4.5053 8.6300 126.2616 55.5047 32.9991 176.1375 13 L 4.0977 8.4876 128.3428 54.4201 41.7032 177.3496 14 Q 4.1953 10.0278 125.5657 58.5463 29.3226 175.9483 15 N 5.2155 7.8172 112.2301 50.7812 42.6148 173.4531 16 D 4.7125 8.6187 120.0057 54.7485 41.8479 176.0121 17 F 4.6449 9.4923 126.9255 57.7108 40.5712 174.3631 18 K 4.9581 8.4964 125.6959 54.7045 36.4144 173.4962 19 P 4.5033 0.0000 0.0000 64.8789 31.7070 176.4281 20 E 4.0392 9.2252 121.1832 56.4572 29.2365 175.2279 21 S 4.6415 7.7388 115.0183 58.5206 64.1962 173.6395 22 V 5.1116 8.8547 121.5148 61.2908 35.1392 173.7637 23 A 5.2313 9.6610 129.5215 50.3277 21.7365 174.8405 24 A 4.7228 9.3062 126.2114 50.8001 20.6324 175.1653 25 I 4.6650 8.6449 123.4782 61.0146 39.0956 175.6654 26 R 4.6984 9.2020 125.5738 54.3872 34.1833 174.1572 27 S 4.9869 8.6099 118.6871 56.7957 64.1415 174.7968 28 S 4.3798 8.8551 119.9540 59.3402 63.2986 172.9532 29 A 5.3245 7.2685 121.0459 52.4506 22.2653 175.2124 30 F 4.9791 8.7020 120.4401 57.1750 42.2086 174.4105 31 N 4.5774 8.7392 125.7362 50.9653 37.6739 175.5836 32 S 3.6820 8.1233 118.5775 60.8593 63.0308 176.3066 33 K 4.3099 7.6894 117.3956 55.7667 31.9225 176.5936 34 G 3.6362 8.1487 109.3500 45.4675 0.0000 174.0906 35 G 4.1387 8.2679 109.4666 44.2211 0.0000 173.0802 36 T 4.0229 8.3785 118.0492 64.4849 69.0744 173.9780 37 T 4.6396 8.7003 123.0385 61.6027 71.7630 173.3155 38 V 4.9458 8.7528 126.1100 61.0999 35.1323 174.2297 39 F 5.3521 9.1751 124.1061 55.9147 42.6242 173.4649 40 N 5.6966 9.3361 120.9990 51.5069 42.2511 173.6012 41 F 4.6831 9.3449 121.9463 55.9994 40.9435 174.6502 42 L 5.3601 8.8803 124.9714 52.9050 44.5515 177.1332 43 S 4.9211 8.8848 116.6041 56.1634 64.5497 174.9869 44 A 3.9639 8.6762 123.2380 55.1830 17.9940 178.6155 45 G 3.8897 8.0634 102.2137 45.3958 0.0000 173.4825 46 E 3.8201 8.3595 117.5033 57.0476 27.5402 174.1340 47 N 4.6125 7.8765 116.3839 53.0425 39.4600 174.9228 48 I 4.3756 8.3404 124.2641 60.4448 36.6026 176.5693 49 L 4.1908 8.8486 127.5305 57.0962 42.3384 177.6002 50 L 4.6439 7.9670 120.7087 53.5388 45.4228 174.0926 51 H 5.4705 9.2711 126.9496 53.8956 32.1068 173.0803 52 I 4.3585 8.8744 127.5569 59.7373 39.5520 174.8611 53 S 4.6434 8.7978 124.0395 56.4213 64.3767 172.8667 54 I 4.3232 8.6232 130.0148 60.5351 38.4383 175.4716 55 R 4.7312 8.8836 127.9442 53.1857 31.1814 174.7472 56 P 3.2708 0.0000 0.0000 65.0046 31.7434 179.7028 57 G 3.4684 7.8358 107.0461 47.7682 0.0000 173.5541 58 E 4.1673 7.9208 117.6221 55.0659 30.3594 174.5100 59 N 4.1934 7.5702 115.1423 54.5328 37.9422 173.0969 60 V 4.7646 7.7988 114.8949 60.7646 36.0353 173.4895 61 I 4.8411 8.7436 122.1380 59.5223 40.0970 174.8147 62 V 4.7259 8.8058 127.4051 61.0541 34.1882 174.2685 63 F 5.6918 8.5930 125.2766 55.2486 42.4224 173.8963 64 N 5.2364 8.2497 118.8813 54.7460 42.5075 172.4867 65 S 5.5375 8.6127 114.7906 57.7769 67.7868 173.5536 66 R 4.3895 8.4351 115.8053 55.7123 32.7944 174.4503 67 L 4.5902 8.0231 120.2971 53.7463 42.8907 177.8985 68 K 3.7148 8.8942 122.5994 59.4452 32.2090 178.0815 69 N 4.9799 7.9143 113.6134 52.7834 38.9733 173.3502 70 G 4.0781 7.7094 105.2492 43.5064 0.0000 172.0691 71 A 4.3672 8.0732 121.8730 50.4185 20.0256 177.2486 72 W 4.3394 8.4701 119.3169 57.1556 30.0521 176.9395 73 G 4.3923 8.4803 110.3965 44.3588 0.0000 171.5041 74 P 4.6701 0.0000 0.0000 63.1019 31.8512 176.1137 75 E 4.7647 8.7805 121.3898 55.8990 31.2346 175.5236 76 E 4.8477 9.0349 121.4464 54.8614 32.6151 175.2504 77 R 5.4031 8.8988 123.3641 54.5136 33.2002 175.1835 78 I 4.8830 8.4708 114.2433 58.5147 41.6897 172.9182 79 P 4.6012 0.0000 0.0000 62.9845 31.8753 176.2131 80 Y 4.2123 8.6116 122.2921 59.8122 39.3196 176.1559 81 A 3.7811 7.9781 120.7294 53.5298 19.1581 176.4001 82 E 3.5896 8.3754 117.7221 58.0025 27.4645 175.1896 83 K 4.2255 7.5610 116.9037 57.5114 34.8565 176.8116 84 F 5.1303 7.5375 115.4085 55.8059 40.2440 175.5096 85 R 4.5103 8.5711 125.2175 53.6786 30.0415 173.7081 86 P 4.7356 0.0000 0.0000 62.0463 32.1802 174.8133 87 P 4.6884 0.0000 0.0000 63.8350 32.4006 174.9536 88 N 6.3000 7.5369 115.7400 50.0633 37.6160 172.4859 89 P 4.9121 0.0000 0.0000 63.1804 33.6074 176.8757 90 S 5.0083 9.7482 115.0662 57.1497 67.3567 172.6895 91 I 4.7419 8.6685 120.6004 59.9687 41.4408 174.5222 92 T 4.9924 8.9028 123.3142 61.6714 71.8229 172.9452 93 V 4.8362 8.7962 126.6950 61.0726 34.2657 174.1978 94 I 5.0256 8.8381 128.5780 59.5234 40.7289 174.0499 95 D 4.7531 8.6703 126.7139 53.1233 42.1827 176.2113 96 H 4.8178 8.9389 124.8226 55.5551 28.6387 175.8911 97 G 3.9712 8.1399 115.0637 44.4831 0.0000 174.5048 98 D 4.7898 7.4573 117.6266 52.7518 41.3942 175.3427 99 R 4.9332 7.4079 114.7073 55.6948 32.8460 173.4032 100 F 5.3050 9.2876 119.0370 56.0670 41.6992 174.6309 101 Q 4.7757 9.3407 124.1169 54.4136 31.3137 174.1076 102 I 4.6970 8.5598 127.2952 59.4661 40.2629 174.6117 103 R 4.5169 8.7947 126.2941 54.4618 32.9614 175.5708 104 F 4.9830 8.0184 121.9840 55.9108 40.9930 175.0758 105 D 4.3049 8.2716 120.9346 57.0969 40.9836 175.8772 106 Y 4.7120 7.2318 114.1493 56.7584 41.6199 175.5791 107 G 3.9979 8.7684 110.0980 44.8650 0.0000 173.3762 108 T 4.2162 8.0543 108.5233 60.9148 69.6157 174.6346 109 S 4.2718 8.3353 118.3380 58.9046 63.8478 173.6261 110 I 4.3900 8.2744 123.5034 59.7875 39.5458 174.2039 111 Y 5.1169 8.4721 123.2492 56.2821 40.2703 174.3531 112 Y 4.6803 8.9313 125.5008 55.4763 41.2612 174.4887 113 N 4.6142 8.5642 124.6310 53.2056 39.2979 175.4440 114 K 4.2968 8.5978 122.8387 56.9317 32.2393 177.2107 115 R 4.4485 8.9533 121.0951 56.0955 32.5859 175.9654 116 I 4.4766 7.8160 117.8763 59.2366 38.9268 175.9382 117 K 4.3847 8.4916 126.4121 55.4641 31.2342 175.6776 118 E 4.7659 7.9180 124.7401 55.7581 33.7763 174.4678 119 N 5.0790 8.5706 117.4596 52.3808 41.1100 174.0385 120 A 4.8903 8.9091 122.8052 51.5424 20.3477 177.8234 121 A 4.7581 9.5126 122.3305 51.9010 21.1287 175.7187 122 A 4.8370 7.5455 115.5740 50.9140 23.2086 175.1891 123 I 4.6030 8.1110 118.7294 59.3816 40.6435 174.9921 124 A 5.1964 9.0990 128.5863 50.4367 22.4948 174.8248 125 Y 4.9948 8.7764 120.1299 56.2028 41.9741 173.8625 126 N 5.3266 8.7467 123.2533 51.2642 43.0885 173.5222 127 A 4.3431 8.0190 120.9818 51.9854 22.1092 176.7037 128 E 4.0293 9.0009 121.5969 58.7418 30.5591 177.1903 129 N 4.8171 7.4291 116.0178 50.6992 39.0777 172.3343 130 S 4.0961 7.9315 113.8009 58.5180 63.3766 174.1207 131 L 3.7752 8.4514 128.6178 56.7500 42.8262 175.8427 132 F 5.6883 7.6509 116.1027 55.1190 42.4338 175.0275 133 S 4.5328 9.2074 115.4922 58.7102 63.9079 173.9022 134 S 4.7512 8.3667 114.7341 56.1880 64.6632 171.9824 135 P 4.6701 0.0000 0.0000 62.1952 33.6370 175.3164 136 V 4.5210 8.2215 111.6304 60.0460 35.0512 175.5392 137 T 4.5162 8.6760 121.3199 63.2947 69.9570 173.9783 138 V 4.7352 8.6857 125.5899 61.3186 34.9378 173.6265 139 D 5.3716 8.9799 128.4012 52.7066 42.9443 175.4155 140 V 5.0459 8.7334 124.5694 61.5900 33.2791 174.5545 141 H 5.0424 9.8117 125.8019 54.0847 31.1477 175.9990 142 G 3.7021 8.9041 110.0037 47.4540 0.0000 173.4373 143 L 5.0715 7.3768 116.4636 55.0929 42.6084 174.1871 144 L 3.7792 8.5539 121.8769 55.1762 42.1268 175.4074 145 P 4.6208 0.0000 0.0000 60.8768 32.6373 173.9301 146 P 4.3040 0.0000 0.0000 62.9337 31.6911 175.9941 147 L 4.6203 8.1338 121.7211 52.3612 42.9781 174.9952 148 P 4.5288 0.0000 0.0000 61.6687 32.1433 175.5574 149 P 4.2663 0.0000 0.0000 65.2700 31.5364 176.5071 150 A 4.1160 7.5362 124.6056 52.7098 19.4503 175.7765 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 8.16 4.28 0.00 2.18 1.95 0.00 0.00 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 2.27 0.00 2 L 8.22 4.73 0.00 1.65 1.39 0.88 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 3 Y 9.95 4.87 0.00 2.88 2.77 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 4 H 8.98 5.02 0.00 3.15 3.09 0.00 5.71 0.00 0.00 0.00 0.00 6.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 L 8.44 4.59 0.00 1.85 1.61 1.16 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 6 F 9.13 4.88 0.00 2.98 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 7 V 8.60 2.64 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 0.58 0.00 0.00 0.28 0.00 0.00 8 N 8.10 4.17 0.00 2.73 2.83 0.00 0.00 6.68 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 9 N 7.50 4.95 0.00 2.95 2.91 0.00 0.00 6.59 7.11 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 10 Q 8.37 4.98 0.00 2.20 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.46 0.00 0.00 0.00 0.00 0.00 2.24 2.39 0.00 11 V 8.38 4.52 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 0.92 0.00 0.00 0.63 0.00 0.00 12 K 8.63 4.51 0.00 1.75 1.74 0.00 1.93 0.00 0.00 1.71 0.00 0.00 2.93 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.42 1.56 7.81 13 L 8.49 4.10 0.00 1.63 1.77 1.03 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 14 Q 10.03 4.20 0.00 2.09 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.71 0.00 0.00 0.00 0.00 0.00 2.41 2.44 0.00 15 N 7.82 5.22 0.00 2.76 2.71 0.00 0.00 6.92 8.06 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 16 D 8.62 4.71 0.00 2.60 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 17 F 9.49 4.64 0.00 3.27 3.17 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 18 K 8.50 4.96 0.00 1.83 1.94 0.00 1.40 0.00 0.00 1.66 0.00 0.00 2.79 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.24 1.34 7.81 19 P 0.00 4.50 0.00 1.98 1.97 0.00 3.65 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 1.97 2.16 0.00 20 E 9.23 4.04 0.00 2.04 2.15 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 2.12 2.35 0.00 21 S 7.74 4.64 0.00 2.72 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 22 V 8.85 5.11 2.15 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 1.00 0.00 0.00 0.93 0.00 0.00 23 A 9.66 5.23 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 24 A 9.31 4.72 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 25 I 8.64 4.66 1.61 0.00 0.00 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.54 0.42 0.00 0.00 26 R 9.20 4.70 0.00 1.60 1.70 0.00 3.07 0.00 0.00 3.06 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.48 0.00 27 S 8.61 4.99 0.00 3.62 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 S 8.86 4.38 0.00 4.06 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 29 A 7.27 5.32 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 30 F 8.70 4.98 0.00 3.10 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 31 N 8.74 4.58 0.00 2.49 2.57 0.00 0.00 6.26 7.33 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 32 S 8.12 3.68 0.00 4.04 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 33 K 7.69 4.31 0.00 1.67 1.79 0.00 1.71 0.00 0.00 1.67 0.00 0.00 3.03 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.34 1.37 7.81 34 G 8.15 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 0.00 0.00 0.00 35 G 8.27 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 36 T 8.38 4.02 4.13 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 0.00 0.00 1.10 0.00 0.00 37 T 8.70 4.64 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 1.25 0.00 0.00 38 V 8.75 4.95 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 1.01 0.00 0.00 0.85 0.00 0.00 39 F 9.18 5.35 0.00 3.15 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 40 N 9.34 5.70 0.00 2.67 2.79 0.00 0.00 6.45 7.95 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 41 F 9.34 4.68 0.00 2.84 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 42 L 8.88 5.36 0.00 1.56 1.57 0.92 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 43 S 8.88 4.92 0.00 4.08 4.08 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 0.00 0.00 0.00 0.00 44 A 8.68 3.96 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 45 G 8.06 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 0.00 0.00 0.00 46 E 8.36 3.82 0.00 2.12 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 0.00 2.23 2.27 0.00 47 N 7.88 4.61 0.00 2.94 2.75 0.00 0.00 7.04 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 I 8.34 4.38 1.83 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 1.27 0.49 1.19 0.00 0.00 49 L 8.85 4.19 0.00 1.85 2.02 1.24 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 50 L 7.97 4.64 0.00 1.02 1.06 0.54 -0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 51 H 9.27 5.47 0.00 3.63 3.44 0.00 5.83 0.00 0.00 0.00 0.00 6.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 I 8.87 4.36 2.21 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 1.39 0.69 1.12 0.00 0.00 53 S 8.80 4.64 0.00 3.49 3.58 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 54 I 8.62 4.32 1.96 0.00 0.00 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 1.54 0.78 1.08 0.00 0.00 55 R 8.88 4.73 0.00 1.64 1.69 0.00 3.02 0.00 0.00 3.11 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.56 0.00 56 P 0.00 3.27 0.00 1.95 1.67 0.00 3.42 0.00 0.00 3.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.78 0.00 57 G 7.84 3.47 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 0.00 0.00 0.00 58 E 7.92 4.17 0.00 1.85 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 2.19 2.23 0.00 59 N 7.57 4.19 0.00 2.91 2.85 0.00 0.00 6.92 7.04 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 60 V 7.80 4.76 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 0.71 0.00 0.00 1.00 0.00 0.00 61 I 8.74 4.84 1.84 0.00 0.00 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.89 0.61 0.00 0.00 62 V 8.81 4.73 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 0.78 0.00 0.00 0.85 0.00 0.00 63 F 8.59 5.69 0.00 3.06 2.31 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 64 N 8.25 5.24 0.00 2.72 2.68 0.00 0.00 7.45 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 65 S 8.61 5.54 0.00 4.04 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 66 R 8.44 4.39 0.00 1.57 1.43 0.00 2.21 0.00 0.00 2.25 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.92 0.00 67 L 8.02 4.59 0.00 1.67 1.58 0.91 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 68 K 8.89 3.71 0.00 1.89 1.83 0.00 1.90 0.00 0.00 1.69 0.00 0.00 2.96 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.42 1.41 7.81 69 N 7.91 4.98 0.00 2.68 2.72 0.00 0.00 6.60 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 70 G 7.71 4.08 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 A 8.07 4.37 1.27 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 72 W 8.47 4.34 0.00 3.23 3.16 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 73 G 8.48 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 0.00 0.00 0.00 0.00 74 P 0.00 4.67 0.00 2.17 2.14 0.00 3.88 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 2.09 2.07 0.00 75 E 8.78 4.76 0.00 1.91 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 2.25 2.36 0.00 76 E 9.03 4.85 0.00 2.30 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 0.00 2.37 2.51 0.00 77 R 8.90 5.40 0.00 1.72 1.86 0.00 3.18 0.00 0.00 3.28 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.63 0.00 78 I 8.47 4.88 2.01 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.78 1.16 0.00 0.00 79 P 0.00 4.60 0.00 2.06 2.04 0.00 3.71 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 2.05 2.10 0.00 80 Y 8.61 4.21 0.00 2.82 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 81 A 7.98 3.78 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 82 E 8.38 3.59 0.00 1.96 1.78 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 1.99 2.16 0.00 83 K 7.56 4.23 0.00 0.90 0.74 0.00 1.48 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.36 0.84 7.81 84 F 7.54 5.13 0.00 2.85 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 85 R 8.57 4.51 0.00 1.37 1.63 0.00 3.08 0.00 0.00 3.36 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.67 0.00 86 P 0.00 4.74 0.00 2.32 2.00 0.00 3.80 0.00 0.00 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.90 0.00 87 P 0.00 4.69 0.00 2.30 2.39 0.00 3.66 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 2.08 2.01 0.00 88 N 7.54 6.30 0.00 2.43 2.76 0.00 0.00 6.97 7.90 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 89 P 0.00 4.91 0.00 2.23 2.32 0.00 3.91 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 2.03 2.47 0.00 90 S 9.75 5.01 0.00 3.89 3.86 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 91 I 8.67 4.74 1.61 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.64 0.77 0.00 0.00 92 T 8.90 4.99 4.12 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 1.18 0.00 0.00 93 V 8.80 4.84 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 0.67 0.00 0.00 0.74 0.00 0.00 94 I 8.84 5.03 1.86 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 1.13 0.53 0.74 0.00 0.00 95 D 8.67 4.75 0.00 2.62 2.41 0.00 0.00 0.00 0.00 0.00 0.00 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 H 8.94 4.82 0.00 3.27 3.22 0.00 5.72 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 G 8.14 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 0.00 0.00 0.00 98 D 7.46 4.79 0.00 2.70 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 99 R 7.41 4.93 0.00 2.06 1.99 0.00 2.93 0.00 0.00 3.25 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.74 0.00 100 F 9.29 5.30 0.00 3.14 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 0.00 101 Q 9.34 4.78 0.00 2.34 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.74 0.00 0.00 0.00 0.00 0.00 2.02 1.77 0.00 102 I 8.56 4.70 1.54 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 1.15 0.35 0.43 0.00 0.00 103 R 8.79 4.52 0.00 1.48 1.62 0.00 3.02 0.00 0.00 3.09 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.38 0.00 104 F 8.02 4.98 0.00 2.81 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 0.00 105 D 8.27 4.30 0.00 2.55 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 0.00 0.00 0.00 106 Y 7.23 4.71 0.00 3.04 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 0.00 107 G 8.77 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 0.00 108 T 8.05 4.22 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 1.24 0.00 0.00 109 S 8.34 4.27 0.00 3.48 3.26 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 0.00 110 I 8.27 4.39 1.67 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 1.47 0.58 0.58 0.00 0.00 111 Y 8.47 5.12 0.00 2.81 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 0.00 112 Y 8.93 4.68 0.00 2.75 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 0.00 113 N 8.56 4.61 0.00 2.44 2.62 0.00 0.00 7.20 7.61 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 0.00 114 K 8.60 4.30 0.00 1.59 1.77 0.00 1.64 0.00 0.00 1.62 0.00 0.00 2.13 0.00 0.00 2.46 0.00 0.00 0.00 0.00 1.30 1.11 7.81 115 R 8.95 4.45 0.00 1.92 2.02 0.00 3.41 0.00 0.00 3.35 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.67 0.00 116 I 7.82 4.48 2.00 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.73 0.98 0.00 0.00 117 K 8.49 4.38 0.00 1.88 1.86 0.00 1.57 0.00 0.00 1.71 0.00 0.00 2.95 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.40 1.47 7.81 118 E 7.92 4.77 0.00 2.01 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 2.26 2.38 0.00 119 N 8.57 5.08 0.00 2.85 2.98 0.00 0.00 6.70 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 0.00 120 A 8.91 4.89 1.54 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 0.00 0.00 121 A 9.51 4.76 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 0.00 122 A 7.55 4.84 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 0.00 123 I 8.11 4.60 1.51 0.00 0.00 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.03 0.15 0.43 0.00 0.00 124 A 9.10 5.20 1.21 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 0.00 0.00 0.00 125 Y 8.78 4.99 0.00 2.87 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 N 8.75 5.33 0.00 2.58 2.54 0.00 0.00 6.31 7.43 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 0.00 127 A 8.02 4.34 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 E 9.00 4.03 0.00 1.88 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 2.24 2.21 0.00 129 N 7.43 4.82 0.00 2.64 2.51 0.00 0.00 6.81 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 0.00 130 S 7.93 4.10 0.00 3.68 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 0.00 131 L 8.45 3.78 0.00 1.18 0.25 0.67 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 132 F 7.65 5.69 0.00 3.16 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 0.00 133 S 9.21 4.53 0.00 3.89 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 0.00 134 S 8.37 4.75 0.00 3.89 3.80 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 0.00 135 P 0.00 4.67 0.00 1.71 0.49 0.00 3.51 0.00 0.00 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.17 0.00 136 V 8.22 4.52 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 0.85 0.00 0.00 0.89 0.00 0.00 137 T 8.68 4.52 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 1.20 0.00 0.00 138 V 8.69 4.74 2.15 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 0.99 0.00 0.00 0.90 0.00 0.00 139 D 8.98 5.37 0.00 2.74 2.51 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 0.00 140 V 8.73 5.05 2.42 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 1.13 0.00 0.00 1.11 0.00 0.00 141 H 9.81 5.04 0.00 3.06 3.33 0.00 5.66 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 G 8.90 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 L 7.38 5.07 0.00 1.68 1.57 0.91 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 144 L 8.55 3.78 0.00 1.59 1.62 0.91 0.90 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 0.00 145 P 0.00 4.62 0.00 2.20 2.04 0.00 3.70 0.00 0.00 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.74 0.00 146 P 0.00 4.30 0.00 2.05 2.03 0.00 3.66 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.11 0.00 147 L 8.13 4.62 0.00 1.61 1.57 0.91 1.02 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 0.00 148 P 0.00 4.53 0.00 2.21 2.16 0.00 3.70 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 1.97 0.00 149 P 0.00 4.27 0.00 2.05 2.17 0.00 3.71 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.09 0.00 150 A 7.54 4.12 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