NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.3293 8.2493 123.5817 50.9952 19.9478 176.6670 2 P 5.0127 0.0000 0.0000 62.4762 31.7242 174.6626 3 Q 4.5516 9.5431 118.8978 56.0464 30.5133 177.2281 4 S 4.6537 7.2957 113.3443 56.0857 68.1941 174.8294 5 I 3.6915 8.2723 123.9706 64.3554 37.4367 178.3940 6 T 3.8074 7.7735 110.3706 64.8335 68.6297 175.9946 7 E 3.9202 7.9561 121.7727 58.7590 29.7445 178.3607 8 L 4.0349 8.0335 120.6125 58.1783 42.0396 178.1010 9 C 4.3315 8.6292 118.8550 59.4967 43.3014 175.5089 10 S 4.0014 7.5329 115.2519 60.5838 62.4709 175.2443 11 E 4.2039 7.8184 119.6427 55.9809 29.6631 175.5887 12 Y 4.7965 7.0778 116.3650 56.2758 41.1709 174.6824 13 H 4.7883 8.6792 118.6719 56.3322 30.2972 175.9824 14 N 4.4397 9.0187 118.7709 53.9935 35.8244 173.8682 15 T 4.8881 7.0292 109.0718 60.7873 71.3068 173.7158 16 Q 4.4142 8.4453 120.7364 55.1904 33.0056 172.7740 17 I 4.4549 8.0578 126.5506 60.6629 38.8672 174.7804 18 Y 4.6940 8.4905 124.0769 56.3107 40.7864 175.4027 19 T 3.9447 8.6755 122.1651 63.8883 67.9850 175.0536 20 I 3.5322 8.4294 127.5752 63.2910 37.6565 177.5559 21 N 4.1003 7.9010 117.9297 53.5600 37.9849 172.5131 22 D 4.6491 7.6740 113.9845 53.0208 44.9765 174.2596 23 K 4.9541 8.3267 121.6333 55.2504 33.8044 176.8159 24 I 3.4840 8.2025 121.1938 61.5323 37.7585 176.0221 25 L 4.4625 8.5335 128.3762 57.3574 42.7457 177.1209 26 S 4.6440 7.6868 112.2162 56.6586 66.6226 171.8246 27 Y 4.6325 7.9640 123.9187 55.9975 40.4096 174.5598 28 T 4.4362 8.0019 123.0472 61.5067 71.9322 172.6497 29 E 4.7806 8.4767 126.1360 54.2830 32.7482 174.4100 30 S 4.8361 8.9595 121.1115 56.5586 65.6022 173.8998 31 M 4.5449 8.6194 121.4210 54.5458 32.0424 175.6944 32 A 4.0396 7.9382 123.9148 52.0052 19.0909 177.6384 33 G 3.9283 8.5647 110.0381 47.4289 0.0000 174.4211 34 K 4.0447 9.1528 121.5087 57.0752 31.6767 176.9238 35 R 4.6421 7.8424 116.6059 54.8197 31.2433 176.0302 36 E 5.2410 8.0511 121.9667 54.5481 28.1989 174.9913 37 M 4.9162 7.6057 120.0059 53.1295 35.9748 175.4330 38 V 4.7541 7.8905 117.1340 61.2979 35.4616 174.5119 39 I 5.1562 8.6053 127.8394 59.4378 40.4887 174.2925 40 I 5.6336 9.0895 120.9119 58.4113 40.4178 174.7412 41 T 5.1756 7.7819 113.5384 60.0695 72.7479 172.3486 42 F 5.3144 8.6585 119.8811 55.1094 42.9172 176.6091 43 K 4.1697 8.3883 116.6422 59.2916 32.3895 178.6018 44 S 4.1999 8.0978 113.7437 59.5803 63.2669 174.7637 45 G 3.9989 8.1585 108.7125 45.1119 0.0000 174.0554 46 A 3.8857 7.7915 122.6435 52.5271 19.3142 176.7177 47 T 4.8564 7.7793 118.0362 61.6996 71.7919 173.3426 48 F 5.4049 9.2304 123.3858 56.0981 44.0995 173.3253 49 Q 5.5843 9.0725 116.9325 54.5742 32.5350 174.0644 50 V 4.7083 8.2455 120.0835 59.8967 31.9199 174.0477 51 E 4.6265 8.7209 122.9908 54.8424 30.4125 177.5586 52 V 3.6318 8.2562 120.5915 62.0705 32.1444 174.1187 53 P 3.9020 0.0000 0.0000 62.8002 31.9276 175.7887 54 G 4.0552 7.7490 112.1272 44.6741 0.0000 172.5054 55 S 4.1939 8.7707 113.1739 61.1217 63.0219 175.4038 56 Q 4.0084 8.0899 117.5402 57.8981 28.5547 175.4736 57 H 4.9446 7.8881 115.9329 54.2157 29.6924 173.6418 58 I 4.5249 8.0435 114.6854 59.2534 40.1955 176.2320 59 D 4.5536 8.6205 118.9997 57.6264 40.6267 179.1321 60 S 4.1881 8.1595 113.4474 61.3991 63.4200 176.2215 61 Q 3.8575 7.7006 119.4188 57.8125 28.2653 178.7271 62 K 3.9410 7.8769 120.3962 59.5973 32.1327 179.3022 63 K 4.1322 7.6820 118.0339 59.2249 32.0356 179.3175 64 A 4.1882 8.0583 120.5606 55.0084 18.2164 179.7496 65 I 3.7032 7.7164 118.1937 64.7138 37.2970 178.3785 66 E 4.0097 7.7975 118.0451 59.3373 29.2194 179.4509 67 R 4.0395 8.4724 119.1840 59.5882 30.0966 178.1561 68 M 4.0375 8.0265 117.9591 58.8319 32.3038 178.4120 69 K 4.0911 8.1902 118.4906 59.3409 32.1419 179.1788 70 D 4.3566 8.1644 119.2838 57.7621 40.7419 178.8369 71 T 3.9012 8.3148 116.5470 66.7556 68.4721 176.6717 72 L 4.0930 8.3768 121.1963 57.6516 41.5344 179.6144 73 R 3.2010 8.0391 118.5622 59.3417 30.0228 178.4624 74 I 3.6243 7.7289 118.4144 64.3835 37.9773 177.8726 75 T 3.8942 8.3286 117.0604 66.6723 68.1567 175.9536 76 Y 4.0231 7.9997 121.3556 60.8046 38.7237 177.7583 77 L 3.7200 7.9284 119.0489 57.7150 41.8635 178.8806 78 T 4.1913 8.0206 106.7120 60.8466 69.2204 174.2941 79 E 3.7805 7.9352 119.8907 57.6988 28.1585 174.7789 80 T 4.1140 7.6845 114.6952 63.4020 69.8529 173.9298 81 K 4.1759 8.5685 127.3280 56.1026 33.3077 175.9915 82 I 3.8481 8.6396 129.1801 61.0590 38.1521 175.3750 83 D 4.5739 9.2793 128.6929 55.1706 41.3623 176.2161 84 K 5.1606 8.4764 114.7424 54.5196 37.4147 174.8399 85 L 4.7634 8.2861 119.9302 53.5121 45.9223 174.9725 86 C 4.8780 8.7479 125.5385 55.6037 45.3083 172.7385 87 V 4.7731 8.3860 119.2583 59.1525 35.9371 175.3103 88 W 5.1057 9.1896 123.9053 55.9546 29.4458 176.7975 89 N 4.7707 9.0657 122.8894 53.5743 37.4456 175.3499 90 N 4.9376 8.1797 116.6743 53.2526 38.8402 174.5977 91 K 4.7032 7.8630 116.1794 54.8717 35.9868 175.9537 92 T 4.4794 8.2912 117.5410 61.0295 70.5260 172.4281 93 P 4.6370 0.0000 0.0000 61.7410 33.3893 175.5870 94 N 4.8086 8.6524 116.9513 53.8652 39.4794 174.7831 95 S 4.9749 8.8453 119.6360 58.2388 63.8716 173.1256 96 I 4.3080 8.8567 128.4367 61.3113 37.0331 175.5347 97 A 4.4144 8.7082 127.6857 52.6398 21.2301 175.9639 98 A 4.5680 7.3373 114.3792 51.1917 22.9109 175.1292 99 I 5.0254 7.9971 118.3465 59.6063 41.3810 174.2124 100 S 4.8675 8.8427 121.8383 56.9238 66.6073 172.6863 101 M 5.0952 8.5528 120.0021 53.7727 35.6926 174.3930 102 E 4.6417 8.8818 121.8756 54.6922 32.7300 177.0712 103 K 4.5414 8.1966 124.0538 55.5080 31.7043 177.8052 104 L 3.6815 7.5798 119.7872 57.4682 42.3155 180.0428 105 A 4.2513 7.4323 117.6804 52.9909 17.8890 177.6176 106 G 3.7515 8.1704 113.2444 46.6965 0.0000 174.2929 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 A 8.25 4.33 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 2 P 0.00 5.01 0.00 2.45 2.21 0.00 3.36 0.00 0.00 4.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.04 0.00 3 Q 9.54 4.55 0.00 2.04 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.78 0.00 0.00 0.00 0.00 0.00 2.27 2.34 0.00 4 S 7.30 4.65 0.00 3.79 3.67 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 5 I 8.27 3.69 1.82 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.49 0.86 0.00 0.00 6 T 7.77 3.81 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 1.16 0.00 0.00 7 E 7.96 3.92 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 2.36 2.35 0.00 8 L 8.03 4.03 0.00 1.86 1.81 0.95 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 9 C 8.63 4.33 0.00 3.13 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 10 S 7.53 4.00 0.00 4.09 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 11 E 7.82 4.20 0.00 1.81 1.61 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 2.23 2.49 0.00 12 Y 7.08 4.80 0.00 2.80 2.98 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 13 H 8.68 4.79 0.00 3.31 3.26 0.00 5.70 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 N 9.02 4.44 0.00 3.23 3.14 0.00 0.00 6.73 7.05 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 15 T 7.03 4.89 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 0.75 0.00 0.00 16 Q 8.45 4.41 0.00 1.95 1.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.95 0.00 0.00 0.00 0.00 0.00 1.64 2.06 0.00 17 I 8.06 4.45 1.74 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.86 0.83 0.00 0.00 18 Y 8.49 4.69 0.00 2.81 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 19 T 8.68 3.94 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 1.19 0.00 0.00 20 I 8.43 3.53 1.85 0.00 0.00 0.53 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 0.26 -0.01 0.00 0.00 21 N 7.90 4.10 0.00 2.70 2.77 0.00 0.00 7.07 8.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 D 7.67 4.65 0.00 2.90 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 23 K 8.33 4.95 0.00 1.95 1.84 0.00 1.24 0.00 0.00 2.36 0.00 0.00 2.80 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.46 1.49 7.81 24 I 8.20 3.48 2.09 0.00 0.00 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 1.27 0.69 0.83 0.00 0.00 25 L 8.53 4.46 0.00 1.64 1.73 0.96 0.81 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 26 S 7.69 4.64 0.00 3.80 3.84 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 27 Y 7.96 4.63 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 0.00 0.00 0.00 28 T 8.00 4.44 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 1.08 0.00 0.00 29 E 8.48 4.78 0.00 1.49 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 2.14 2.25 0.00 30 S 8.96 4.84 0.00 3.85 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 31 M 8.62 4.54 0.00 2.12 2.10 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 2.44 2.48 0.00 32 A 7.94 4.04 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 33 G 8.56 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 0.00 0.00 0.00 34 K 9.15 4.04 0.00 1.94 1.99 0.00 1.67 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.35 1.53 7.81 35 R 7.84 4.64 0.00 1.70 1.79 0.00 3.18 0.00 0.00 3.21 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.62 0.00 36 E 8.05 5.24 0.00 1.81 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 2.24 2.32 0.00 37 M 7.61 4.92 0.00 2.03 2.24 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.60 0.00 38 V 7.89 4.75 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 0.79 0.00 0.00 0.87 0.00 0.00 39 I 8.61 5.16 1.74 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.70 0.90 0.00 0.00 40 I 9.09 5.63 1.72 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 1.12 0.93 0.00 0.00 41 T 7.78 5.18 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 1.12 0.00 0.00 42 F 8.66 5.31 0.00 3.14 3.05 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 0.00 43 K 8.39 4.17 0.00 1.89 2.02 0.00 1.65 0.00 0.00 1.79 0.00 0.00 3.00 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.74 1.45 7.81 44 S 8.10 4.20 0.00 4.01 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 45 G 8.16 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 46 A 7.79 3.89 1.13 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 0.00 0.00 0.00 47 T 7.78 4.86 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 1.11 0.00 0.00 48 F 9.23 5.40 0.00 3.04 3.05 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 0.00 49 Q 9.07 5.58 0.00 2.19 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.79 0.00 0.00 0.00 0.00 0.00 2.46 2.24 0.00 50 V 8.25 4.71 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 1.10 0.00 0.00 1.00 0.00 0.00 51 E 8.72 4.63 0.00 2.03 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 0.00 2.37 2.28 0.00 52 V 8.26 3.63 2.07 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 0.85 0.00 0.00 0.98 0.00 0.00 53 P 0.00 3.90 0.00 2.01 1.88 0.00 3.67 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 1.99 2.02 0.00 54 G 7.75 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 55 S 8.77 4.19 0.00 3.98 4.01 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 56 Q 8.09 4.01 0.00 1.92 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.87 0.00 0.00 0.00 0.00 0.00 2.26 2.11 0.00 57 H 7.89 4.94 0.00 3.13 3.40 0.00 5.64 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 58 I 8.04 4.52 1.90 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.96 0.94 0.00 0.00 59 D 8.62 4.55 0.00 2.75 2.76 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 60 S 8.16 4.19 0.00 4.03 4.15 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 61 Q 7.70 3.86 0.00 2.46 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.82 0.00 0.00 0.00 0.00 0.00 2.48 2.48 0.00 62 K 7.88 3.94 0.00 1.90 1.87 0.00 1.66 0.00 0.00 1.63 0.00 0.00 2.94 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.73 1.64 7.81 63 K 7.68 4.13 0.00 1.65 1.86 0.00 1.69 0.00 0.00 1.66 0.00 0.00 2.97 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.47 1.46 7.81 64 A 8.06 4.19 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 65 I 7.72 3.70 2.09 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.01 0.93 0.00 0.00 66 E 7.80 4.01 0.00 2.21 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 2.54 2.48 0.00 67 R 8.47 4.04 0.00 1.86 2.11 0.00 3.12 0.00 0.00 3.11 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.66 0.00 68 M 8.03 4.04 0.00 2.37 2.17 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.68 0.00 69 K 8.19 4.09 0.00 2.05 1.93 0.00 1.75 0.00 0.00 1.66 0.00 0.00 3.08 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.51 1.71 7.81 70 D 8.16 4.36 0.00 2.90 2.73 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 0.00 0.00 0.00 0.00 71 T 8.31 3.90 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 1.24 0.00 0.00 72 L 8.38 4.09 0.00 1.98 1.90 1.01 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 73 R 8.04 3.20 0.00 1.78 2.02 0.00 3.00 0.00 0.00 3.04 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.93 0.00 74 I 7.73 3.62 1.86 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.27 1.00 0.00 0.00 75 T 8.33 3.89 4.49 0.00 0.00 0.00 0.00 0.00 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 76 Y 8.00 4.02 0.00 3.12 3.08 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 77 L 7.93 3.72 0.00 1.70 1.66 0.87 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 78 T 8.02 4.19 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 1.19 0.00 0.00 79 E 7.94 3.78 0.00 2.04 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 0.00 2.03 2.10 0.00 80 T 7.68 4.11 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 1.23 0.00 0.00 81 K 8.57 4.18 0.00 1.79 1.74 0.00 1.77 0.00 0.00 1.91 0.00 0.00 2.91 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.43 1.55 7.81 82 I 8.64 3.85 2.06 0.00 0.00 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 1.20 1.16 0.94 0.00 0.00 83 D 9.28 4.57 0.00 2.79 2.63 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 0.00 0.00 0.00 0.00 84 K 8.48 5.16 0.00 1.68 1.58 0.00 1.63 0.00 0.00 1.60 0.00 0.00 2.78 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.29 1.33 7.81 85 L 8.29 4.76 0.00 1.30 1.18 0.29 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 86 C 8.75 4.88 0.00 2.85 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 87 V 8.39 4.77 2.38 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 0.54 0.00 0.00 1.29 0.00 0.00 88 W 9.19 5.11 0.00 3.39 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 89 N 9.07 4.77 0.00 2.87 3.12 0.00 0.00 7.01 8.15 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 90 N 8.18 4.94 0.00 2.80 2.91 0.00 0.00 6.75 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 91 K 7.86 4.70 0.00 1.79 1.70 0.00 1.68 0.00 0.00 1.70 0.00 0.00 2.95 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.35 1.35 7.81 92 T 8.29 4.48 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 93 P 0.00 4.64 0.00 2.16 2.01 0.00 3.78 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 1.97 0.00 94 N 8.65 4.81 0.00 3.07 3.16 0.00 0.00 6.47 7.38 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 95 S 8.85 4.97 0.00 4.06 4.11 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 96 I 8.86 4.31 1.94 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 1.08 0.89 0.90 0.00 0.00 97 A 8.71 4.41 -0.19 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 98 A 7.34 4.57 1.06 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 99 I 8.00 5.03 1.84 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.81 0.91 0.00 0.00 100 S 8.84 4.87 0.00 3.88 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 0.00 101 M 8.55 5.10 0.00 1.86 1.95 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 2.69 0.00 102 E 8.88 4.64 0.00 1.90 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 2.18 2.39 0.00 103 K 8.20 4.54 0.00 1.76 1.75 0.00 1.69 0.00 0.00 1.82 0.00 0.00 2.92 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.44 1.37 7.81 104 L 7.58 3.68 0.00 1.75 1.72 0.92 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 105 A 7.43 4.25 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 0.00 106 G 8.17 3.75 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00