NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 L 4.2297 8.1801 122.4925 55.3470 42.4240 176.8617 2 A 4.2916 8.1917 129.2406 51.3354 19.8310 171.7308 3 M 4.4378 8.9769 120.7898 54.1462 34.1991 174.8000 4 T 4.1756 8.3232 121.3324 62.8802 69.4831 174.4521 5 M 4.2253 8.6296 126.3811 55.3353 32.0904 175.5423 6 E 4.8023 8.4054 122.9254 54.5194 32.8314 175.9082 7 H 4.5038 8.9261 120.6000 59.0160 31.5557 176.9219 8 K 3.4326 8.2822 109.1395 59.8712 31.2586 177.0838 9 D 4.8309 8.8308 120.4190 53.2889 43.2304 176.8221 10 R 4.1946 8.1981 121.2406 55.7600 30.9703 175.9265 11 P 4.6675 0.0000 0.0000 61.9631 29.7742 173.8070 12 L 5.2419 7.9513 121.3688 52.8862 44.0613 176.0018 13 V 4.5924 9.0458 116.0275 59.5376 35.9048 174.2766 14 R 4.9840 8.0268 121.5744 55.0353 32.0372 175.3203 15 V 4.8578 9.0263 125.1744 61.0897 35.9822 173.5095 16 I 4.4847 8.1694 122.5957 58.8652 41.0100 174.0311 17 L 5.3343 8.5843 127.8591 53.2865 45.8071 175.5580 18 T 4.9299 8.5035 118.9002 61.7003 72.1743 172.8236 19 N 4.1981 8.0785 126.4059 52.4243 38.3936 173.9041 20 T 4.2339 7.8184 116.5725 61.6969 69.4353 175.0601 21 G 3.7181 7.9927 111.1757 45.4973 0.0000 175.6598 22 S 4.5413 8.2817 120.2910 57.3445 61.5911 173.8027 23 H 4.9471 7.5416 114.2649 52.9839 31.6935 172.1792 24 P 4.3396 0.0000 0.0000 63.4194 31.5273 175.9039 25 V 4.5552 7.7921 112.3785 59.3434 35.8265 175.7186 26 K 4.0550 8.5859 122.5017 59.0034 32.1526 177.2658 27 Q 4.5236 7.7710 117.7652 54.3245 31.8041 174.5300 28 R 4.2319 8.8750 124.6394 58.3990 31.5760 176.2567 29 S 5.9775 8.0218 112.8438 55.8619 64.3193 173.9355 30 V 4.6015 8.3262 119.0950 59.8107 35.7040 173.7876 31 Y 4.9921 8.6881 121.6967 56.5648 39.5715 174.9345 32 I 4.8375 8.8146 116.1500 59.8857 41.8202 173.8893 33 T 5.1785 8.5001 118.3282 62.2220 71.0977 173.7549 34 A 4.9093 9.0928 124.5497 50.6763 23.4267 174.6831 35 L 5.0793 8.5928 121.5927 53.1684 44.6618 175.6110 36 L 4.4764 9.0780 127.2229 54.7281 42.4063 176.2268 37 D 4.7308 9.0201 123.5813 52.6543 43.2229 176.0054 38 T 4.0421 8.8237 116.9330 63.5853 69.2818 175.7536 39 G 3.7806 8.0441 109.1183 45.8286 0.0000 172.8539 40 A 4.7465 7.6535 123.0559 50.3334 20.6877 177.1582 41 D 4.4852 8.8265 121.0971 55.4758 42.7354 175.2377 42 D 5.3533 7.9280 116.8807 52.7029 45.7805 174.3200 43 T 4.7172 7.8552 108.5214 60.8522 71.1139 174.1133 44 V 4.5593 8.3615 123.5233 61.4161 34.5032 174.1628 45 I 4.5825 8.2194 129.1747 60.2274 38.9775 175.8738 46 S 4.4720 9.3579 120.6549 57.5867 62.8865 175.2257 47 E 4.1008 8.3437 125.7201 59.2060 29.5702 178.4583 48 E 4.0549 8.3190 118.9786 59.3842 29.6710 177.3915 49 D 4.5300 7.9344 114.8728 54.5226 41.5005 176.2828 50 W 4.2525 7.9265 130.5508 56.0974 31.0949 174.7336 51 P 4.0410 0.0000 0.0000 62.3283 28.7388 174.8874 52 T 4.1164 7.8878 119.1641 63.0780 66.3427 173.3541 53 D 4.5337 7.6894 122.4154 52.6728 41.3000 176.4863 54 W 4.8465 8.0498 120.9804 54.3895 30.0136 174.1780 55 P 4.7493 0.0000 0.0000 63.1423 32.2148 175.4761 56 V 5.1623 8.3958 113.0184 60.0874 36.0386 174.4415 57 M 4.9454 9.1838 120.3685 53.7417 35.3763 177.0799 58 E 4.0533 9.6171 119.5964 58.5428 30.2100 177.2230 59 A 3.4992 7.1098 120.6948 49.8422 21.7449 176.7226 60 A 3.5987 9.7560 125.3145 52.4954 16.2141 179.1180 61 N 4.9428 8.7456 111.9058 50.4589 43.2040 173.0476 62 P 4.7320 0.0000 0.0000 62.0369 29.9679 177.9904 63 Q 4.3220 7.4426 122.0522 53.6373 28.7039 179.5444 64 I 3.1435 8.4255 120.0802 62.8688 33.4004 171.4525 65 H 5.6118 6.9282 117.3521 52.9937 32.2716 173.3705 66 G 3.9016 7.8409 109.4700 45.0432 0.0000 172.7922 67 I 4.0223 8.5436 112.9412 61.5772 36.1549 175.2794 68 G 4.3153 8.2019 124.2639 46.2603 0.0000 171.5103 69 G 4.1998 5.5903 111.4481 44.9487 0.0000 173.4147 70 G 4.5158 8.2488 112.1362 44.2635 0.0000 171.0496 71 I 4.8383 8.8518 121.8420 58.3875 41.0708 173.7813 72 P 4.4542 0.0000 0.0000 63.2974 31.9078 175.8431 73 V 4.7807 8.1310 113.7586 59.9435 36.0787 174.4244 74 R 4.9655 8.7522 120.5573 54.5167 35.2067 174.2599 75 K 5.0326 9.1814 118.7403 55.0020 36.1296 176.0372 76 S 4.7381 8.6609 118.7647 59.3001 62.9773 174.2302 77 R 4.1771 9.1545 125.5254 59.7982 29.9471 176.3865 78 D 4.6543 8.0994 118.1364 53.8667 41.8156 175.6334 79 M 3.0521 8.5193 122.8076 55.5524 33.4746 174.6893 80 I 4.5198 9.0474 127.2443 59.4669 40.6438 173.9221 81 E 4.8681 8.6484 126.8952 54.5296 31.7261 174.1708 82 L 5.2359 9.1794 129.2620 53.1643 45.3295 175.0503 83 G 4.3403 8.7500 112.9735 44.3974 0.0000 171.9589 84 V 4.2135 8.3866 125.0373 61.6675 30.9997 174.3906 85 I 4.6123 8.2722 130.7488 60.5915 38.4231 176.2970 86 N 4.8917 9.2138 125.5114 50.9342 39.1130 174.9587 87 R 4.2348 8.3700 118.9185 56.1507 27.6903 175.7885 88 D 5.6565 8.9214 135.0000 53.4749 38.4499 178.7107 89 G 3.9491 8.3278 109.7583 45.0732 0.0000 173.7994 90 S 4.2058 8.2494 116.2380 58.0394 63.2188 173.9214 91 L 4.7101 8.2991 125.8644 55.1228 41.4368 177.1769 92 E 4.5757 8.6067 124.4146 56.8535 31.4498 175.9477 93 R 4.4736 8.4767 126.3140 55.4970 31.4730 175.1422 94 P 4.6420 0.0000 0.0000 62.6137 32.1672 175.6475 95 L 4.9096 8.6025 123.3319 52.9174 45.5110 175.4406 96 L 5.2485 8.2597 119.9924 53.2916 44.8539 175.8486 97 L 4.4012 8.6271 124.0362 55.2435 43.8662 174.3880 98 F 5.0837 8.6988 113.3822 54.9798 39.5635 172.9910 99 P 4.4740 0.0000 0.0000 62.7507 33.1271 175.0985 100 L 4.8010 8.1166 121.0659 53.9252 43.9698 176.0993 101 V 4.5665 8.4462 121.0073 61.1855 34.4303 174.3266 102 A 4.7940 8.1216 127.3812 50.7036 23.2042 175.8848 103 M 4.5550 8.1048 119.4678 55.1984 30.2357 175.7497 104 T 4.3433 7.3812 118.6829 61.8295 70.2108 174.9273 105 P 4.0515 0.0000 0.0000 65.1605 31.6185 176.1931 106 V 4.6017 7.0018 116.5120 60.0596 35.1062 174.2588 107 N 4.8736 8.7221 118.7786 52.9375 40.1599 174.1146 108 I 4.7661 9.0779 125.0404 59.6587 40.1486 174.9490 109 L 4.3619 8.9941 128.1577 53.0660 42.1453 176.8711 110 G 4.2099 8.2657 113.0630 43.8992 0.0000 172.7944 111 R 3.9254 9.2915 118.9798 59.2813 29.4673 178.8598 112 D 4.4133 7.6021 118.8051 56.7438 38.4229 178.0057 113 C 4.4344 7.8856 113.6784 58.0930 30.2902 174.3557 114 L 4.3140 7.7558 124.1031 56.7804 41.7534 177.2534 115 Q 4.5921 8.4048 115.7321 56.4817 29.2393 176.8651 116 G 3.8755 7.3760 106.7643 45.7782 0.0000 174.8887 117 L 4.5023 7.3236 116.2627 54.1872 42.4013 177.5408 118 G 3.9652 7.9931 106.6221 44.8744 0.0000 173.8129 119 L 4.1140 7.0084 118.4470 55.2954 42.2013 176.8819 120 R 4.6719 8.0175 116.6526 54.8617 32.1733 174.4857 121 L 4.3931 8.2793 120.4517 54.6405 42.7562 176.0368 122 T 4.5936 7.8754 115.0776 61.6228 69.9659 172.5537 123 N 5.0659 8.5924 120.8984 52.3006 38.4696 174.3323 124 L 4.3062 7.8713 124.5136 56.4067 40.5697 175.9628 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 L 8.18 4.23 0.00 1.92 1.69 0.93 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 2 A 8.19 4.29 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 M 8.98 4.44 0.00 2.02 2.03 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.55 0.00 4 T 8.32 4.18 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 1.22 0.00 0.00 5 M 8.63 4.23 0.00 2.02 2.04 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.51 0.00 6 E 8.41 4.80 0.00 1.93 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 2.21 2.25 0.00 7 H 8.93 4.50 0.00 3.08 3.32 0.00 5.79 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 K 8.28 3.43 0.00 1.87 1.59 0.00 1.81 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.46 1.63 7.81 9 D 8.83 4.83 0.00 2.66 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 R 8.20 4.19 0.00 1.81 1.87 0.00 3.21 0.00 0.00 3.23 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.65 0.00 11 P 0.00 4.67 0.00 2.08 2.01 0.00 3.57 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.12 0.00 12 L 7.95 5.24 0.00 1.52 1.59 0.93 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 13 V 9.05 4.59 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 0.74 0.00 0.00 1.02 0.00 0.00 14 R 8.03 4.98 0.00 1.95 1.85 0.00 3.09 0.00 0.00 3.12 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.79 0.00 15 V 9.03 4.86 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 0.94 0.00 0.00 1.04 0.00 0.00 16 I 8.17 4.48 1.52 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.27 1.22 0.80 0.00 0.00 17 L 8.58 5.33 0.00 1.82 1.71 1.23 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 18 T 8.50 4.93 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 19 N 8.08 4.20 0.00 1.44 1.82 0.00 0.00 7.20 5.12 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 20 T 7.82 4.23 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 1.13 0.00 0.00 21 G 7.99 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 22 S 8.28 4.54 0.00 3.85 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 23 H 7.54 4.95 0.00 3.17 3.18 0.00 5.56 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 P 0.00 4.34 0.00 2.18 2.10 0.00 3.73 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.00 0.00 25 V 7.79 4.56 2.33 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 0.55 0.00 0.00 0.90 0.00 0.00 26 K 8.59 4.05 0.00 1.92 1.82 0.00 1.75 0.00 0.00 1.63 0.00 0.00 2.76 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.45 1.51 7.81 27 Q 7.77 4.52 0.00 1.99 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.57 6.85 0.00 0.00 0.00 0.00 0.00 2.43 2.38 0.00 28 R 8.87 4.23 0.00 1.78 1.88 0.00 3.21 0.00 0.00 3.29 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.55 0.00 29 S 8.02 5.98 0.00 3.88 3.76 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 0.00 0.00 0.00 0.00 30 V 8.33 4.60 1.98 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 0.55 0.00 0.00 0.81 0.00 0.00 31 Y 8.69 4.99 0.00 2.93 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 32 I 8.81 4.84 2.03 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.35 0.94 0.00 0.00 33 T 8.50 5.18 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 1.29 0.00 0.00 34 A 9.09 4.91 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 L 8.59 5.08 0.00 1.79 1.52 0.95 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 36 L 9.08 4.48 0.00 1.55 1.61 0.93 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 37 D 9.02 4.73 0.00 2.77 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 T 8.82 4.04 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 1.22 0.00 0.00 39 G 8.04 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 40 A 7.65 4.75 1.30 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 41 D 8.83 4.49 0.00 2.82 2.66 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 0.00 0.00 0.00 0.00 42 D 7.93 5.35 0.00 2.57 2.48 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 0.00 43 T 7.86 4.72 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 44 V 8.36 4.56 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 0.89 0.00 0.00 0.90 0.00 0.00 45 I 8.22 4.58 1.69 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 1.09 1.37 1.27 0.00 0.00 46 S 9.36 4.47 0.00 3.87 3.76 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 0.00 0.00 0.00 0.00 47 E 8.34 4.10 0.00 1.98 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 2.35 2.20 0.00 48 E 8.32 4.05 0.00 1.94 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 2.30 2.35 0.00 49 D 7.93 4.53 0.00 2.91 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 50 W 7.93 4.25 0.00 3.47 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 51 P 0.00 4.04 0.00 0.49 1.25 0.00 2.20 0.00 0.00 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 1.25 0.00 52 T 7.89 4.12 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 1.34 0.00 0.00 53 D 7.69 4.53 0.00 2.72 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 54 W 8.05 4.85 0.00 2.71 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 55 P 0.00 4.75 0.00 2.23 2.31 0.00 4.05 0.00 0.00 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.13 0.00 56 V 8.40 5.16 2.16 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 0.87 0.00 0.00 1.00 0.00 0.00 57 M 9.18 4.95 0.00 1.86 1.90 0.00 0.00 0.00 0.00 0.00 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.50 0.00 58 E 9.62 4.05 0.00 1.95 1.98 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 2.31 2.25 0.00 59 A 7.11 3.50 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 60 A 9.76 3.60 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 61 N 8.75 4.94 0.00 2.63 2.63 0.00 0.00 6.94 7.69 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 62 P 0.00 4.73 0.00 2.06 1.98 0.00 3.74 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 2.01 2.08 0.00 63 Q 7.44 4.32 0.00 2.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.63 6.69 0.00 0.00 0.00 0.00 0.00 2.37 2.34 0.00 64 I 8.43 3.14 2.08 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 1.35 0.90 0.87 0.00 0.00 65 H 6.93 5.61 0.00 3.10 3.16 0.00 5.79 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 66 G 7.84 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 67 I 8.54 4.02 1.87 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 1.35 0.91 0.91 0.00 0.00 68 G 8.20 4.32 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 0.00 69 G 5.59 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 0.00 0.00 0.00 0.00 70 G 8.25 4.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.85 4.84 1.83 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.96 0.88 0.00 0.00 72 P 0.00 4.45 0.00 1.91 1.97 0.00 3.60 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.11 0.00 73 V 8.13 4.78 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 0.70 0.00 0.00 0.88 0.00 0.00 74 R 8.75 4.97 0.00 1.63 1.82 0.00 3.25 0.00 0.00 3.15 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.66 0.00 75 K 9.18 5.03 0.00 1.71 1.80 0.00 1.27 0.00 0.00 1.61 0.00 0.00 2.89 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.29 1.38 7.81 76 S 8.66 4.74 0.00 4.45 4.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 R 9.15 4.18 0.00 2.12 2.10 0.00 3.32 0.00 0.00 3.26 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.67 0.00 78 D 8.10 4.65 0.00 2.50 2.45 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 79 M 8.52 3.05 0.00 1.81 1.62 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 2.20 0.00 80 I 9.05 4.52 1.92 0.00 0.00 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 1.39 1.39 1.00 0.00 0.00 81 E 8.65 4.87 0.00 1.96 1.71 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 2.18 2.32 0.00 82 L 9.18 5.24 0.00 1.70 1.47 0.97 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 83 G 8.75 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 V 8.39 4.21 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 1.00 0.00 0.00 0.95 0.00 0.00 85 I 8.27 4.61 2.10 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.67 0.95 0.00 0.00 86 N 9.21 4.89 0.00 2.82 2.98 0.00 0.00 6.20 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 87 R 8.37 4.23 0.00 1.80 1.93 0.00 3.40 0.00 0.00 3.28 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.63 0.00 88 D 8.92 5.66 0.00 2.92 2.83 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.33 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 90 S 8.25 4.21 0.00 4.04 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 91 L 8.30 4.71 0.00 1.67 1.74 0.93 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 92 E 8.61 4.58 0.00 1.89 1.81 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 2.47 2.41 0.00 93 R 8.48 4.47 0.00 1.82 1.82 0.00 3.40 0.00 0.00 3.22 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.59 0.00 94 P 0.00 4.64 0.00 1.96 1.95 0.00 3.67 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 2.02 2.11 0.00 95 L 8.60 4.91 0.00 1.59 1.52 0.97 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 96 L 8.26 5.25 0.00 1.40 1.40 0.87 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 97 L 8.63 4.40 0.00 1.77 1.81 0.99 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 98 F 8.70 5.08 0.00 2.80 3.18 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 0.00 0.00 0.00 0.00 99 P 0.00 4.47 0.00 1.96 1.99 0.00 3.76 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.22 0.00 100 L 8.12 4.80 0.00 1.49 1.49 0.89 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 101 V 8.45 4.57 1.67 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 0.31 0.00 0.00 -0.29 0.00 0.00 102 A 8.12 4.79 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 0.00 103 M 8.10 4.56 0.00 1.96 2.00 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.61 0.00 104 T 7.38 4.34 4.45 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 1.22 0.00 0.00 105 P 0.00 4.05 0.00 2.18 2.19 0.00 3.73 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.95 0.00 106 V 7.00 4.60 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 0.69 0.00 0.00 0.94 0.00 0.00 107 N 8.72 4.87 0.00 2.84 2.82 0.00 0.00 6.97 7.73 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 0.00 108 I 9.08 4.77 1.87 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 1.23 1.20 0.99 0.00 0.00 109 L 8.99 4.36 0.00 1.58 1.64 0.94 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 110 G 8.27 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 R 9.29 3.93 0.00 1.98 2.02 0.00 3.13 0.00 0.00 3.38 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.67 0.00 112 D 7.60 4.41 0.00 2.75 2.96 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 0.00 113 C 7.89 4.43 0.00 3.19 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 0.00 114 L 7.76 4.31 0.00 1.95 1.76 0.96 1.06 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 0.00 115 Q 8.40 4.59 0.00 2.20 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.62 0.00 0.00 0.00 0.00 0.00 2.46 2.37 0.00 116 G 7.38 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 0.00 0.00 0.00 117 L 7.32 4.50 0.00 1.65 1.73 1.01 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 118 G 7.99 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 0.00 119 L 7.01 4.11 0.00 1.90 1.64 0.93 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 120 R 8.02 4.67 0.00 1.87 1.85 0.00 3.03 0.00 0.00 3.23 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.65 0.00 121 L 8.28 4.39 0.00 1.64 1.63 0.93 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 122 T 7.88 4.59 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 1.21 0.00 0.00 123 N 8.59 5.07 0.00 2.80 2.79 0.00 0.00 5.91 7.79 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 0.00 124 L 7.87 4.31 0.00 1.76 1.65 0.92 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00