NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 Q 4.6167 8.3449 121.9356 56.3019 30.3802 174.0188 5 Y 4.7568 9.1503 121.5362 55.6335 42.1833 172.3597 6 Y 5.4417 9.2620 122.5782 55.0039 43.4792 174.2845 7 G 4.3366 6.3091 109.3421 45.0461 0.0000 172.8646 8 T 3.8613 8.1453 123.4998 63.2497 68.6959 170.6506 9 G 4.0564 8.6244 116.5114 45.2074 0.0000 172.5376 10 R 5.0825 8.2203 122.2400 54.9072 34.6195 174.7460 11 R 4.4283 8.9035 119.4219 56.2423 34.8787 175.0838 12 K 3.9952 9.5387 126.1380 57.1984 30.9857 176.4003 13 S 4.8821 8.8617 116.8324 57.9447 63.1032 176.0850 14 S 4.9759 8.5532 114.3902 57.8760 68.1331 174.3553 15 A 5.1935 8.6967 124.7844 50.2016 21.8436 175.0997 16 A 5.1110 8.6061 123.4213 49.7248 20.9919 175.4482 17 R 4.0222 9.0931 121.0158 57.0564 31.6808 176.0889 18 V 4.4813 8.3661 124.2614 61.4007 33.8948 174.4166 19 F 5.2853 9.2151 128.5582 55.8020 39.3942 174.5066 20 I 4.1943 8.8739 125.1814 61.1488 38.3771 175.3148 21 K 4.9273 9.2785 125.6949 54.0455 36.7042 173.9453 22 P 4.7077 0.0000 0.0000 63.7212 31.6340 176.1172 23 G 3.5580 8.1710 110.9567 46.9718 0.0000 171.2181 24 N 4.1830 9.1426 115.9306 54.4122 39.2589 176.8200 25 G 5.7532 7.4859 119.9463 45.8838 0.0000 171.6465 26 K 4.5226 7.2876 119.9825 55.7303 34.5464 175.6599 27 I 5.3955 8.2851 122.4828 58.9276 40.6888 175.2122 28 V 4.3553 8.2945 123.8749 61.4369 34.2991 174.5582 29 I 4.1068 9.1511 131.3137 59.4160 37.8989 176.1728 30 N 3.8811 8.3213 127.5553 54.5863 36.1048 175.2618 31 Q 3.7027 8.0899 110.9638 56.4593 27.1837 174.1906 32 R 4.6462 7.5075 116.8050 53.4054 33.6737 175.2725 33 S 4.6470 9.0399 116.0916 58.3723 64.3196 175.4077 34 L 4.0859 8.4971 125.1669 58.3414 41.3639 179.6714 35 E 4.0989 8.2790 117.6425 59.5533 29.1826 179.3629 36 Q 4.0119 7.9837 116.5854 59.3213 28.9997 177.6312 37 Y 4.0151 7.8221 119.0107 60.2110 40.1763 177.0405 38 F 4.5277 7.8699 119.5092 56.1940 37.7864 176.8994 39 G 3.7486 7.6431 109.0875 45.9811 0.0000 172.5004 40 R 3.7550 8.6968 126.6016 56.8656 26.7268 178.5577 41 E 4.5225 7.4153 117.8438 53.3460 30.5138 175.0449 42 T 3.5356 8.4117 122.1301 66.4813 68.7015 175.1740 43 A 4.0026 8.0924 122.2466 54.6763 18.4690 179.2630 44 R 3.4000 8.7751 116.2340 60.0273 29.0688 178.6723 45 M 3.9989 7.7051 118.5674 58.2747 32.0224 178.8760 46 V 3.6409 7.7809 119.0760 64.9403 30.9302 178.4176 47 V 3.5197 7.2727 117.6449 65.3865 31.3928 176.6447 48 R 4.3766 7.7239 115.3027 56.1478 30.5679 177.9486 49 Q 3.9043 7.9723 120.0789 58.6445 28.1956 177.0476 50 P 3.6275 0.0000 0.0000 65.8510 30.8018 178.1809 51 L 3.6980 7.5458 118.3366 57.0443 41.3900 179.0043 52 E 3.8860 8.1870 119.9339 59.0740 29.3887 178.3354 53 L 3.9586 7.8802 117.2301 58.3095 41.6962 178.6977 54 V 3.8572 7.2705 107.7662 60.9743 31.5597 176.0776 55 D 4.4351 7.8569 118.7161 54.9669 39.3634 172.9275 56 M 4.2505 9.4291 121.2252 54.3287 32.7687 181.2364 57 V 2.9248 8.4051 116.3610 63.4569 34.0309 174.8663 58 E 4.1118 8.3061 126.9014 57.6368 30.3001 177.9923 59 K 4.3867 7.8271 117.8363 56.4321 34.1005 174.9970 60 L 5.0529 7.8015 118.1280 52.6945 45.3889 174.9292 61 D 5.2597 9.7366 122.1840 52.4729 44.1365 174.5701 62 L 5.3478 8.4192 123.9509 53.0699 45.6833 174.8172 63 Y 4.9548 8.6810 123.3215 56.1876 41.0625 174.3682 64 I 4.9706 8.4828 128.0960 60.0007 40.6064 175.5575 65 T 4.5127 8.6760 121.0669 62.0181 71.7147 173.2061 66 V 5.5401 8.1805 124.6964 58.9635 34.2942 175.3879 67 K 4.4862 8.6192 119.7893 57.2644 35.5659 176.3035 68 G 4.0178 8.8844 107.5186 46.6165 0.0000 175.1428 69 G 4.3482 7.8267 106.5666 45.1317 0.0000 173.2682 70 G 4.2369 8.1577 105.1574 42.2241 0.0000 173.6488 71 I 4.5369 8.2639 121.9668 63.8710 36.6907 178.4829 72 S 4.1765 8.1887 113.1775 61.5148 62.2833 176.3604 73 G 3.6452 8.0894 107.8161 47.8838 0.0000 175.4161 74 Q 4.1004 8.8173 120.6143 58.6812 28.8619 178.6525 75 A 3.9231 8.3739 122.0319 55.2936 18.3877 180.0294 76 G 3.5627 7.9093 103.5639 47.5433 0.0000 175.9125 77 A 3.9852 8.1218 123.0805 55.2729 18.4710 179.7039 78 I 3.6133 8.2550 118.6980 64.4295 37.0260 178.4003 79 R 3.9105 7.8099 119.0093 59.8375 29.8261 177.8115 80 H 4.2853 7.6955 119.1321 58.7393 29.8574 177.2760 81 G 3.4948 8.2209 107.3415 47.8341 0.0000 175.7554 82 I 3.6654 7.7841 122.2098 64.1609 36.9418 178.3519 83 T 3.7764 7.9766 111.1674 65.0324 68.3563 176.5925 84 R 3.9431 8.1055 119.7531 58.4765 28.9870 178.5930 85 A 4.2414 7.6965 122.3116 54.4029 18.5313 179.4241 86 L 3.9722 8.0031 117.6241 57.9043 41.3598 179.5720 87 M 4.0482 7.4521 118.2129 58.4760 31.9943 178.1663 88 E 4.1849 8.1365 116.8749 59.5464 29.7806 178.2582 89 Y 3.7003 6.9248 117.0644 59.0982 39.0792 176.1472 90 D 4.2004 7.8709 122.6883 51.7798 42.9359 174.9655 91 E 4.0031 8.8803 127.2039 59.7761 29.1053 178.9519 92 S 4.2426 8.1919 115.5561 61.0991 62.7243 176.5208 93 L 3.9046 8.0537 121.8908 57.1995 41.2341 179.3031 94 R 4.1000 8.2116 119.0323 59.7365 29.8883 178.8683 95 S 4.3495 7.2827 112.7279 61.2187 61.6074 175.6443 96 E 4.4528 7.9168 120.2657 57.3922 30.5043 177.2673 97 L 4.3161 8.8027 121.0818 57.5466 42.1029 178.9301 98 R 4.2273 8.5882 118.7330 58.8259 29.8794 178.5793 99 K 3.8753 7.3951 115.3483 59.4688 32.0574 178.4991 100 A 4.0723 7.3628 120.2442 52.6624 18.8298 178.4366 101 G 3.8272 8.1802 105.7179 45.5167 0.0000 175.4710 102 F 4.4362 7.6406 119.2149 59.9932 39.0466 176.6886 103 V 3.8937 7.8308 118.3575 64.3846 31.7556 175.5999 104 T 4.3482 7.4738 116.6164 62.7175 69.3145 174.0252 105 R 4.1000 8.2841 126.5053 54.5882 30.9036 175.0308 106 D 4.2698 8.6306 124.9168 54.5218 41.0291 175.6679 107 A 4.2103 8.4790 129.5929 53.2249 18.9878 177.6002 108 R 3.9844 8.0576 115.8866 56.5016 30.5692 176.1040 109 Q 4.3870 8.3008 122.2661 53.9358 31.9395 174.2158 110 V 3.7126 8.4493 125.4796 63.1910 30.2228 174.7035 111 E 4.1340 8.2008 125.6545 54.7473 30.4559 176.4351 112 R 3.8947 8.5526 124.4221 56.6707 30.5360 178.0882 113 K 4.3631 8.5338 125.6845 56.0585 29.7959 176.1710 114 K 4.0064 7.5843 125.6190 57.0010 33.5622 176.1419 115 V 4.4174 7.8514 113.4813 60.6052 33.8588 176.1128 116 G 4.1322 9.0227 109.1778 45.7235 0.0000 173.7253 117 L 4.8436 7.3018 117.2548 53.2577 45.7364 176.2860 118 R 4.2785 8.1039 117.8436 57.4010 30.6493 177.9919 119 K 4.4197 7.8008 116.0224 55.5974 32.8376 178.0170 120 A 3.7675 8.2380 125.9771 52.6492 17.5462 178.7652 121 R 4.3643 8.2393 111.9485 57.6855 31.9504 176.4250 122 R 3.8964 7.7566 117.8261 56.4650 30.4894 176.0902 123 R 4.2828 8.2836 122.0847 54.1423 31.0476 174.4561 124 P 4.3799 0.0000 0.0000 62.2483 31.2466 176.7413 125 Q 4.1473 8.3148 124.4781 55.1842 29.5889 175.3983 126 F 5.0181 7.0962 112.1088 55.0740 40.6896 174.4917 127 S 4.2757 8.7052 116.4433 58.0524 62.6225 174.3149 128 K 4.2091 8.4179 125.2304 56.2736 29.9714 176.4501 129 R 4.0512 8.5080 122.6509 56.1273 29.8852 176.1918 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 4 Q 8.34 4.62 0.00 2.10 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.63 6.74 0.00 0.00 0.00 0.00 0.00 2.37 2.68 0.00 5 Y 9.15 4.76 0.00 2.99 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 6 Y 9.26 5.44 0.00 2.52 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 7 G 6.31 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 8 T 8.15 3.86 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 1.28 0.00 0.00 9 G 8.62 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 10 R 8.22 5.08 0.00 1.75 1.79 0.00 3.28 0.00 0.00 3.17 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.64 0.00 11 R 8.90 4.43 0.00 1.89 1.87 0.00 3.29 0.00 0.00 3.17 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.64 0.00 12 K 9.54 4.00 0.00 1.96 1.64 0.00 1.76 0.00 0.00 1.77 0.00 0.00 2.84 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.35 1.41 7.81 13 S 8.86 4.88 0.00 3.82 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 14 S 8.55 4.98 0.00 3.82 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 15 A 8.70 5.19 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 16 A 8.61 5.11 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 17 R 9.09 4.02 0.00 2.14 2.28 0.00 3.59 0.00 0.00 3.34 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.76 0.00 18 V 8.37 4.48 1.95 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 1.01 0.00 0.00 0.88 0.00 0.00 19 F 9.22 5.29 0.00 3.34 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 20 I 8.87 4.19 2.01 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 1.23 0.73 0.87 0.00 0.00 21 K 9.28 4.93 0.00 1.79 1.69 0.00 1.71 0.00 0.00 1.67 0.00 0.00 2.77 0.00 0.00 3.29 0.00 0.00 0.00 0.00 1.45 1.76 7.81 22 P 0.00 4.71 0.00 1.95 2.01 0.00 3.77 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.09 0.00 23 G 8.17 3.56 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 0.00 0.00 0.00 24 N 9.14 4.18 0.00 2.77 2.68 0.00 0.00 6.71 8.25 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 25 G 7.49 5.75 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 26 K 7.29 4.52 0.00 1.86 1.95 0.00 1.47 0.00 0.00 1.83 0.00 0.00 3.07 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.55 1.52 7.81 27 I 8.29 5.40 1.91 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 1.06 0.97 0.00 0.00 28 V 8.29 4.36 2.32 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 1.14 0.00 0.00 1.02 0.00 0.00 29 I 9.15 4.11 1.38 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 1.16 0.72 -0.19 0.00 0.00 30 N 8.32 3.88 0.00 2.48 2.71 0.00 0.00 7.06 8.89 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 31 Q 8.09 3.70 0.00 2.20 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.33 6.71 0.00 0.00 0.00 0.00 0.00 2.34 2.39 0.00 32 R 7.51 4.65 0.00 2.01 1.79 0.00 3.25 0.00 0.00 3.14 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.70 0.00 33 S 9.04 4.65 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 34 L 8.50 4.09 0.00 1.87 1.89 1.02 0.92 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 35 E 8.28 4.10 0.00 2.01 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 0.00 2.45 2.39 0.00 36 Q 7.98 4.01 0.00 2.22 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 7.05 0.00 0.00 0.00 0.00 0.00 2.38 2.44 0.00 37 Y 7.82 4.02 0.00 2.63 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 38 F 7.87 4.53 0.00 3.29 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 39 G 7.64 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 40 R 8.70 3.75 0.00 1.99 2.04 0.00 3.16 0.00 0.00 3.15 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.61 0.00 41 E 7.42 4.52 0.00 1.97 1.82 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 2.25 2.31 0.00 42 T 8.41 3.54 4.23 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 1.20 0.00 0.00 43 A 8.09 4.00 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 44 R 8.78 3.40 0.00 1.82 2.22 0.00 2.89 0.00 0.00 3.39 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.70 0.00 45 M 7.71 4.00 0.00 2.04 2.14 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.69 0.00 46 V 7.78 3.64 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 0.75 0.00 0.00 0.99 0.00 0.00 47 V 7.27 3.52 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 0.81 0.00 0.00 0.58 0.00 0.00 48 R 7.72 4.38 0.00 1.87 1.86 0.00 3.18 0.00 0.00 3.18 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.55 0.00 49 Q 7.97 3.90 0.00 1.94 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.74 0.00 0.00 0.00 0.00 0.00 2.36 2.61 0.00 50 P 0.00 3.63 0.00 1.96 1.58 0.00 3.32 0.00 0.00 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.89 0.00 51 L 7.55 3.70 0.00 1.75 1.68 0.87 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 52 E 8.19 3.89 0.00 2.03 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 0.00 2.30 2.39 0.00 53 L 7.88 3.96 0.00 1.68 1.79 1.12 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 54 V 7.27 3.86 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 0.67 0.00 0.00 1.01 0.00 0.00 55 D 7.86 4.44 0.00 2.77 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 56 M 9.43 4.25 0.00 1.87 1.68 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.56 0.00 57 V 8.41 2.92 2.06 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 0.65 0.00 0.00 0.91 0.00 0.00 58 E 8.31 4.11 0.00 1.91 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 2.32 2.22 0.00 59 K 7.83 4.39 0.00 1.78 1.70 0.00 1.70 0.00 0.00 1.75 0.00 0.00 2.81 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.33 1.40 7.81 60 L 7.80 5.05 0.00 1.58 1.44 0.75 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 61 D 9.74 5.26 0.00 2.55 2.62 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.42 5.35 0.00 1.68 1.56 0.90 0.52 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 63 Y 8.68 4.95 0.00 2.95 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 64 I 8.48 4.97 1.71 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 1.19 1.45 0.91 0.00 0.00 65 T 8.68 4.51 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 1.19 0.00 0.00 66 V 8.18 5.54 2.06 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 0.66 0.00 0.00 1.06 0.00 0.00 67 K 8.62 4.49 0.00 1.80 1.90 0.00 1.54 0.00 0.00 2.04 0.00 0.00 2.92 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.42 1.41 7.81 68 G 8.88 4.02 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 0.00 0.00 0.00 0.00 0.00 0.00 69 G 7.83 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 0.00 0.00 0.00 0.00 70 G 8.16 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 0.00 0.00 0.00 0.00 71 I 8.26 4.54 1.92 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.47 1.33 0.00 0.00 72 S 8.19 4.18 0.00 3.90 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 73 G 8.09 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 0.00 0.00 0.00 74 Q 8.82 4.10 0.00 2.56 2.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.72 0.00 0.00 0.00 0.00 0.00 2.50 2.74 0.00 75 A 8.37 3.92 1.16 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 76 G 7.91 3.56 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 0.00 0.00 0.00 77 A 8.12 3.99 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 78 I 8.26 3.61 1.90 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.93 0.92 0.00 0.00 79 R 7.81 3.91 0.00 2.03 2.18 0.00 3.46 0.00 0.00 3.22 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.62 0.00 80 H 7.70 4.29 0.00 3.32 3.47 0.00 5.89 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 G 8.22 3.49 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 0.00 0.00 0.00 0.00 82 I 7.78 3.67 1.91 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.78 0.80 0.00 0.00 83 T 7.98 3.78 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 1.16 0.00 0.00 84 R 8.11 3.94 0.00 1.97 2.06 0.00 2.48 0.00 0.00 3.05 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.50 0.00 85 A 7.70 4.24 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 L 8.00 3.97 0.00 1.85 1.70 0.84 0.66 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 87 M 7.45 4.05 0.00 1.94 2.33 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.88 2.59 0.00 88 E 8.14 4.18 0.00 2.35 2.37 0.00 0.00 0.00 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 2.63 0.00 89 Y 6.92 3.70 0.00 1.83 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 90 D 7.87 4.20 0.00 2.17 2.36 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 91 E 8.88 4.00 0.00 2.22 2.20 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 2.33 2.39 0.00 92 S 8.19 4.24 0.00 4.09 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 93 L 8.05 3.90 0.00 1.73 1.73 1.02 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 94 R 8.21 4.10 0.00 1.85 2.00 0.00 3.16 0.00 0.00 3.17 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.89 0.00 95 S 7.28 4.35 0.00 4.02 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 96 E 7.92 4.45 0.00 2.02 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 2.31 2.34 0.00 97 L 8.80 4.32 0.00 1.81 1.78 1.00 0.94 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 98 R 8.59 4.23 0.00 1.92 1.96 0.00 3.21 0.00 0.00 3.19 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.74 0.00 99 K 7.40 3.88 0.00 1.69 1.88 0.00 1.70 0.00 0.00 1.70 0.00 0.00 3.03 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.63 1.62 7.81 100 A 7.36 4.07 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 G 8.18 3.83 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 0.00 0.00 0.00 102 F 7.64 4.44 0.00 3.10 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 0.00 103 V 7.83 3.89 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 0.84 0.00 0.00 0.99 0.00 0.00 104 T 7.47 4.35 4.37 0.00 0.00 0.00 0.00 0.00 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 0.00 105 R 8.28 4.10 0.00 1.53 1.76 0.00 3.19 0.00 0.00 3.12 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.75 0.00 106 D 8.63 4.27 0.00 2.66 2.59 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 0.00 0.00 0.00 0.00 107 A 8.48 4.21 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 0.00 108 R 8.06 3.98 0.00 1.90 1.90 0.00 3.10 0.00 0.00 3.14 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.70 0.00 109 Q 8.30 4.39 0.00 1.94 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 7.25 0.00 0.00 0.00 0.00 0.00 2.23 2.33 0.00 110 V 8.45 3.71 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 0.82 0.00 0.00 0.93 0.00 0.00 111 E 8.20 4.13 0.00 1.97 1.83 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 2.29 2.29 0.00 112 R 8.55 3.89 0.00 1.81 1.85 0.00 3.53 0.00 0.00 3.28 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.59 0.00 113 K 8.53 4.36 0.00 1.88 1.84 0.00 1.56 0.00 0.00 1.70 0.00 0.00 3.08 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.41 1.52 7.81 114 K 7.58 4.01 0.00 2.05 1.81 0.00 1.69 0.00 0.00 1.97 0.00 0.00 2.98 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.54 1.58 7.81 115 V 7.85 4.42 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 0.71 0.00 0.00 0.93 0.00 0.00 116 G 9.02 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 0.00 0.00 0.00 0.00 117 L 7.30 4.84 0.00 1.53 1.73 0.97 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 118 R 8.10 4.28 0.00 1.82 1.97 0.00 3.10 0.00 0.00 3.22 7.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.59 0.00 119 K 7.80 4.42 0.00 1.89 1.74 0.00 1.65 0.00 0.00 1.81 0.00 0.00 2.96 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.40 1.44 7.81 120 A 8.24 3.77 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 0.00 121 R 8.24 4.36 0.00 1.73 1.91 0.00 3.33 0.00 0.00 3.15 7.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.66 0.00 122 R 7.76 3.90 0.00 1.79 1.81 0.00 3.31 0.00 0.00 3.37 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.55 0.00 123 R 8.28 4.28 0.00 1.95 1.90 0.00 3.09 0.00 0.00 3.27 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.58 0.00 124 P 0.00 4.38 0.00 2.21 2.13 0.00 3.81 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 2.00 2.04 0.00 125 Q 8.31 4.15 0.00 1.87 1.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.82 0.00 0.00 0.00 0.00 0.00 2.17 2.23 0.00 126 F 7.10 5.02 0.00 3.04 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 0.00 127 S 8.71 4.28 0.00 3.91 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 0.00 128 K 8.42 4.21 0.00 1.79 1.80 0.00 1.86 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.47 1.49 7.81 129 R 8.51 4.05 0.00 1.51 1.77 0.00 3.11 0.00 0.00 2.68 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.41 0.00