NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.2031 8.3001 120.3301 53.9265 34.2094 174.6773 2 A 3.5944 7.9205 119.4594 53.5297 16.3223 175.8674 3 T 4.0542 7.9870 118.6308 64.3529 70.9978 172.9658 4 L 4.6781 8.1700 128.2385 53.7329 43.0928 175.2168 5 L 4.7271 8.7492 128.1339 53.0952 46.0706 174.9949 6 Q 4.5865 8.8568 124.1656 55.3037 30.4995 175.0954 7 L 5.0569 9.4062 127.1961 54.6613 44.8100 173.8932 8 H 5.1102 9.2194 121.4700 54.3396 32.4224 172.5783 9 F 5.2240 8.0205 114.8982 54.7581 41.8854 173.6334 10 A 4.6731 8.7297 120.2320 51.7777 19.0315 177.2135 11 F 4.3535 8.9243 122.9647 58.2725 40.7453 174.5258 12 N 4.0749 7.4515 117.3627 54.4807 36.7688 175.3505 13 G 3.7042 7.4950 104.9168 45.7865 0.0000 173.9677 14 P 4.7338 0.0000 0.0000 60.1954 33.2113 176.0114 15 F 4.1484 8.1414 116.7611 59.6055 39.2745 175.6637 16 G 3.8003 8.4922 114.6505 46.0558 0.0000 175.0998 17 D 4.6304 8.1999 120.9323 56.6565 41.0368 178.3091 18 A 4.2853 8.2338 121.0585 54.9727 18.4550 177.8471 19 M 4.3411 8.4321 115.4008 57.2620 33.1031 178.1823 20 A 4.1890 8.2771 121.0953 54.9165 18.9463 177.2511 21 E 4.5008 8.1621 113.0663 58.1681 31.4808 177.2861 22 Q 4.2833 8.6084 116.3630 57.2830 29.2790 178.1119 23 L 4.1247 7.7757 119.8215 57.5700 42.5330 178.3723 24 K 3.8846 7.8332 119.1342 58.8556 32.0520 175.7684 25 P 4.5608 0.0000 0.0000 63.7754 32.1482 176.7047 26 L 4.5497 7.5271 116.0685 54.1048 42.5122 177.7455 27 A 4.1193 8.0785 122.6494 55.5027 18.3073 179.5957 28 E 4.0569 8.3078 114.6475 58.6450 29.4090 178.5534 29 S 4.4093 7.6438 114.6531 60.1688 64.3130 175.9527 30 I 3.8366 8.2469 115.1471 64.2918 37.6085 177.6060 31 N 4.4950 8.1504 117.0750 52.2252 38.8453 175.2261 32 Q 4.3246 8.0243 115.6523 56.0903 27.9627 172.7950 33 E 4.9679 8.1132 115.3552 54.8394 31.4702 173.5808 34 P 4.2042 0.0000 0.0000 64.8111 32.5267 176.2538 35 G 4.0423 8.2169 110.7823 45.1704 0.0000 174.5779 36 F 3.8676 7.9292 121.1184 57.5310 36.9866 176.3851 37 L 4.3862 7.7827 118.2406 56.2912 41.9945 177.0841 38 W 5.2087 7.5468 110.9374 55.6664 31.0597 172.3252 39 K 4.1170 8.8283 119.0128 54.1179 34.6256 174.9613 40 V 3.6668 7.3856 120.3392 60.2024 32.1127 177.0614 41 W 4.9115 7.6464 125.7747 55.9571 28.0847 175.7179 42 T 4.8134 7.0717 114.3489 62.7744 72.7471 174.5397 43 E 4.5270 8.5020 122.7365 55.7106 33.0345 175.2753 44 S 4.3618 8.7522 123.5905 57.0832 65.7095 174.5670 45 E 2.9822 8.3641 124.4936 58.4051 29.7507 179.9410 46 K 3.9364 7.7874 117.5932 58.8545 32.7797 177.0201 47 N 4.5391 7.8291 116.1204 53.3076 39.7521 173.8301 48 H 4.1315 8.0201 114.3994 56.4553 26.7306 173.8026 49 E 5.0421 8.2468 117.4579 54.7916 33.1345 173.7921 50 A 4.3863 9.7888 127.3827 51.9270 21.1230 175.7354 51 G 4.6092 7.5879 109.1973 44.5237 0.0000 172.9308 52 G 3.9607 7.7458 111.6272 45.5134 0.0000 174.6747 53 I 5.2976 8.3053 126.0087 59.5153 40.6972 173.0266 54 Y 3.5857 8.6171 123.8201 55.3998 42.2638 173.3199 55 L 4.5785 5.7890 119.2504 53.9946 43.1402 176.0135 56 F 4.9415 9.0460 126.4101 56.1559 41.8571 175.7932 57 T 3.7394 7.2741 119.1383 64.7857 67.4990 172.8285 58 D 4.8640 7.4685 118.0118 52.3661 41.5096 176.6355 59 E 3.9281 8.0673 118.0045 58.6748 28.1198 179.0544 60 K 3.9173 7.8559 118.4760 60.2241 32.5401 178.9979 61 S 4.3441 9.3060 114.7136 60.3425 61.6971 175.7626 62 A 3.0901 7.3127 123.6863 54.9351 17.8996 179.6707 63 L 3.9686 7.4704 115.5987 58.4821 40.7173 178.8130 64 A 4.2316 7.5462 121.0172 54.8839 18.6659 178.3639 65 Y 4.2962 8.4966 114.1692 59.0489 38.1270 177.6855 66 L 4.0962 7.6441 121.3555 58.7698 40.5753 178.7178 67 E 4.1490 8.0613 119.7731 58.0267 29.2775 178.7198 68 K 3.7412 7.6517 118.8987 59.8475 32.6884 177.9912 69 H 4.2661 7.9923 115.8913 59.3112 28.6092 177.8831 70 T 3.7255 8.4885 117.5589 66.6328 68.0403 176.3069 71 A 3.6175 8.1145 121.8648 54.5524 18.5105 179.5502 72 R 4.0744 7.7602 117.0195 58.9133 30.5644 178.8625 73 L 4.0364 7.5597 118.9222 58.0699 40.5009 178.9592 74 K 3.9150 8.4808 120.0302 59.4332 32.5025 178.5801 75 N 4.4221 7.9503 117.5513 55.8175 39.3292 175.3539 76 L 4.6692 7.8943 117.0660 55.2420 43.9885 176.9375 77 G 4.0691 8.2491 108.1665 44.8132 0.0000 174.6786 78 V 4.1605 9.0358 118.3849 60.9241 33.1602 175.8470 79 E 4.4593 8.6443 115.5066 55.4048 33.1348 175.8917 80 E 4.7019 8.0954 119.7985 55.1835 34.4332 175.3625 81 V 4.1094 8.4986 123.2362 61.6236 32.8430 175.8895 82 V 4.1135 9.0755 124.6154 61.9363 32.4874 174.6394 83 A 5.6296 8.3163 129.2507 49.4989 21.6069 174.9213 84 K 4.6383 8.5955 120.5089 54.8671 37.4084 175.3205 85 V 4.4531 8.3444 122.0282 61.2607 33.2431 175.2437 86 F 4.8455 8.0833 123.2808 55.2790 40.2010 173.5228 87 D 4.8749 8.4624 118.6313 52.3258 44.2075 174.5660 88 V 4.0520 8.1861 122.3895 61.7575 31.5475 175.4213 89 N 4.7638 8.4555 126.8878 51.9190 38.2084 174.6199 90 E 4.1139 8.5602 126.0311 58.4005 29.4598 176.8613 91 P 4.2470 0.0000 0.0000 65.4800 31.4029 177.3555 92 L 4.4307 7.4501 115.5910 54.8747 41.8671 177.8094 93 S 4.3506 8.2571 114.4870 59.8936 62.1403 175.4318 94 Q 3.9512 8.0238 121.6747 59.4323 28.9695 176.5488 95 I 4.2451 7.5629 115.6783 61.2310 37.5479 175.6543 96 N 4.6501 7.9449 120.3002 54.7751 39.3554 175.5975 97 Q 4.1896 7.9798 115.7561 56.4743 28.9119 176.7104 98 A 4.3703 7.8992 121.3905 53.8758 19.7534 179.4196 99 K 4.2702 7.8673 114.4004 57.6442 33.0390 176.7544 100 L 4.5336 7.8742 116.9444 54.5636 41.8658 176.2703 101 A 4.3394 7.8963 127.5103 52.3357 19.2008 177.1125 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 1.96 2.08 0.00 0.00 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.50 0.00 2 A 7.92 3.59 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.99 4.05 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 1.07 0.00 0.00 4 L 8.17 4.68 0.00 1.51 1.19 0.95 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 5 L 8.75 4.73 0.00 1.37 1.07 0.44 -0.02 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 6 Q 8.86 4.59 0.00 2.23 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.56 6.60 0.00 0.00 0.00 0.00 0.00 2.60 2.67 0.00 7 L 9.41 5.06 0.00 1.45 1.67 1.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 8 H 9.22 5.11 0.00 3.10 3.33 0.00 5.26 0.00 0.00 0.00 0.00 6.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 F 8.02 5.22 0.00 3.07 3.11 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 0.00 0.00 0.00 0.00 10 A 8.73 4.67 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 11 F 8.92 4.35 0.00 2.98 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 12 N 7.45 4.07 0.00 2.93 2.97 0.00 0.00 6.89 7.97 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 13 G 7.49 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 14 P 0.00 4.73 0.00 2.16 2.04 0.00 3.76 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 1.91 2.13 0.00 15 F 8.14 4.15 0.00 3.06 3.09 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 16 G 8.49 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 0.00 0.00 0.00 17 D 8.20 4.63 0.00 2.88 2.81 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 18 A 8.23 4.29 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 19 M 8.43 4.34 0.00 2.09 2.42 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.77 0.00 20 A 8.28 4.19 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 0.00 0.00 21 E 8.16 4.50 0.00 1.99 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 0.00 2.29 2.32 0.00 22 Q 8.61 4.28 0.00 2.29 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.04 6.62 0.00 0.00 0.00 0.00 0.00 2.42 2.49 0.00 23 L 7.78 4.12 0.00 2.07 1.78 1.02 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 24 K 7.83 3.88 0.00 1.75 2.04 0.00 1.86 0.00 0.00 1.78 0.00 0.00 3.06 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.48 1.43 7.81 25 P 0.00 4.56 0.00 2.23 2.17 0.00 3.89 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.99 0.00 26 L 7.53 4.55 0.00 1.86 1.73 0.99 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 27 A 8.08 4.12 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 0.00 0.00 28 E 8.31 4.06 0.00 2.20 2.21 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 2.36 2.40 0.00 29 S 7.64 4.41 0.00 3.97 3.93 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 30 I 8.25 3.84 1.88 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 1.55 0.61 0.92 0.00 0.00 31 N 8.15 4.49 0.00 2.97 2.83 0.00 0.00 7.30 7.88 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 32 Q 8.02 4.32 0.00 2.38 2.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.55 0.00 0.00 0.00 0.00 0.00 2.19 2.14 0.00 33 E 8.11 4.97 0.00 2.63 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 0.00 2.06 2.27 0.00 34 P 0.00 4.20 0.00 1.79 1.98 0.00 4.02 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.12 0.00 35 G 8.22 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 36 F 7.93 3.87 0.00 3.01 3.23 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 37 L 7.78 4.39 0.00 1.82 2.01 1.02 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 38 W 7.55 5.21 0.00 3.72 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 K 8.83 4.12 0.00 1.74 1.79 0.00 1.48 0.00 0.00 1.78 0.00 0.00 2.97 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.30 1.28 7.81 40 V 7.39 3.67 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 0.64 0.00 0.00 0.86 0.00 0.00 41 W 7.65 4.91 0.00 3.56 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 42 T 7.07 4.81 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 1.20 0.00 0.00 43 E 8.50 4.53 0.00 1.98 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 0.00 2.13 2.46 0.00 44 S 8.75 4.36 0.00 3.82 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 45 E 8.36 2.98 0.00 1.71 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 2.14 2.10 0.00 46 K 7.79 3.94 0.00 1.85 1.93 0.00 1.50 0.00 0.00 1.52 0.00 0.00 2.87 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.36 1.34 7.81 47 N 7.83 4.54 0.00 2.65 2.95 0.00 0.00 7.00 8.03 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 48 H 8.02 4.13 0.00 3.45 3.49 0.00 5.65 0.00 0.00 0.00 0.00 7.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 E 8.25 5.04 0.00 1.99 1.72 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 2.19 2.44 0.00 50 A 9.79 4.39 1.18 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 0.00 0.00 51 G 7.59 4.61 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 G 7.75 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 53 I 8.31 5.30 1.94 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 1.38 1.03 1.02 0.00 0.00 54 Y 8.62 3.59 0.00 1.57 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 55 L 5.79 4.58 0.00 0.88 1.44 1.12 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 56 F 9.05 4.94 0.00 2.69 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 57 T 7.27 3.74 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 0.65 0.00 0.00 58 D 7.47 4.86 0.00 2.83 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 59 E 8.07 3.93 0.00 1.97 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 2.28 2.29 0.00 60 K 7.86 3.92 0.00 1.95 2.04 0.00 1.46 0.00 0.00 1.71 0.00 0.00 2.82 0.00 0.00 3.24 0.00 0.00 0.00 0.00 1.44 1.62 7.81 61 S 9.31 4.34 0.00 3.76 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 62 A 7.31 3.09 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 L 7.47 3.97 0.00 1.79 1.76 0.90 0.89 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 64 A 7.55 4.23 1.52 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 65 Y 8.50 4.30 0.00 2.97 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 66 L 7.64 4.10 0.00 1.94 1.89 0.90 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 67 E 8.06 4.15 0.00 1.98 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 2.26 2.27 0.00 68 K 7.65 3.74 0.00 1.46 1.77 0.00 1.45 0.00 0.00 1.47 0.00 0.00 2.45 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.01 1.68 7.81 69 H 7.99 4.27 0.00 3.28 3.16 0.00 5.68 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 70 T 8.49 3.73 4.35 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 1.16 0.00 0.00 71 A 8.11 3.62 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 72 R 7.76 4.07 0.00 2.00 1.87 0.00 3.09 0.00 0.00 3.25 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.61 0.00 73 L 7.56 4.04 0.00 1.70 1.58 0.86 -0.11 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 74 K 8.48 3.91 0.00 1.84 1.93 0.00 1.55 0.00 0.00 1.59 0.00 0.00 2.94 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.58 1.39 7.81 75 N 7.95 4.42 0.00 2.77 3.01 0.00 0.00 6.74 7.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 L 7.89 4.67 0.00 1.64 1.66 0.77 0.52 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 77 G 8.25 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 78 V 9.04 4.16 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 0.96 0.00 0.00 79 E 8.64 4.46 0.00 1.94 1.76 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 2.19 2.29 0.00 80 E 8.10 4.70 0.00 1.89 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 2.19 2.27 0.00 81 V 8.50 4.11 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 0.55 0.00 0.00 1.17 0.00 0.00 82 V 9.08 4.11 1.87 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 0.92 0.00 0.00 0.89 0.00 0.00 83 A 8.32 5.63 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 K 8.60 4.64 0.00 1.76 1.67 0.00 1.51 0.00 0.00 1.77 0.00 0.00 2.89 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.44 1.48 7.81 85 V 8.34 4.45 1.99 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 0.85 0.00 0.00 0.77 0.00 0.00 86 F 8.08 4.85 0.00 3.10 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 87 D 8.46 4.87 0.00 2.64 2.60 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.19 4.05 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 1.00 0.00 0.00 89 N 8.46 4.76 0.00 2.85 2.71 0.00 0.00 7.19 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 90 E 8.56 4.11 0.00 2.06 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 2.42 2.39 0.00 91 P 0.00 4.25 0.00 2.22 2.21 0.00 3.82 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 2.04 2.08 0.00 92 L 7.45 4.43 0.00 1.72 1.72 0.92 0.60 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 93 S 8.26 4.35 0.00 3.91 3.94 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 94 Q 8.02 3.95 0.00 2.04 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.84 0.00 0.00 0.00 0.00 0.00 2.35 2.45 0.00 95 I 7.56 4.25 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 1.18 0.58 0.91 0.00 0.00 96 N 7.94 4.65 0.00 2.83 2.98 0.00 0.00 7.22 7.01 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 97 Q 7.98 4.19 0.00 2.09 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.63 6.69 0.00 0.00 0.00 0.00 0.00 2.36 2.62 0.00 98 A 7.90 4.37 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 99 K 7.87 4.27 0.00 1.71 1.85 0.00 1.66 0.00 0.00 1.71 0.00 0.00 3.12 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.37 1.52 7.81 100 L 7.87 4.53 0.00 1.92 1.68 1.05 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 101 A 7.90 4.34 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