NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 R 4.8378 8.0600 119.1020 56.2924 32.2374 176.4588 3 L 4.1058 7.9393 117.1392 54.2687 41.8744 174.8774 4 N 5.1234 7.7996 113.2262 53.3516 39.0942 174.2835 5 T 4.5488 8.2950 107.7978 61.3158 70.2409 173.1283 6 L 4.7368 7.8099 123.1893 54.5416 41.8746 175.9214 7 S 4.7481 8.2084 115.7860 55.4711 66.0412 171.7071 8 P 4.4941 0.0000 0.0000 61.5808 32.2648 175.7644 9 A 4.0334 8.3305 121.1300 51.9996 18.7179 176.7950 10 E 4.0054 8.5642 122.6688 57.6882 30.1081 177.2076 11 G 3.9911 8.9009 114.4097 45.6297 0.0000 173.6856 12 S 4.0151 6.8236 113.8614 61.2788 62.9068 175.1715 13 K 4.2804 7.5082 124.0549 54.9878 30.5580 176.7988 14 K 4.2319 7.8201 122.6207 55.4828 34.6668 179.1758 15 A 4.0200 8.2713 120.9215 52.6705 17.2946 179.7699 16 G 3.7551 9.2094 118.1466 46.0340 0.0000 172.7877 17 K 3.9643 8.2546 126.8767 56.8919 32.7295 176.8540 18 R 4.1811 8.6677 122.1220 57.9584 31.2185 174.5504 19 L 4.0637 8.0332 121.5505 56.0439 43.2123 173.7182 20 G 3.7895 8.9053 112.3548 46.1742 0.0000 174.0564 21 R 4.4953 7.6390 111.3741 55.1408 30.9802 175.3133 22 G 4.0336 8.5468 101.4924 45.1488 0.0000 174.8638 23 I 3.6448 8.4769 121.7273 64.3688 37.3670 178.6882 24 G 3.8135 8.2051 108.0044 48.5972 0.0000 174.3264 25 S 4.0685 7.6413 114.1243 61.3089 62.1762 174.3115 26 G 3.9493 7.1918 111.5332 44.2846 0.0000 173.7457 27 L 4.4263 7.8385 128.4448 53.3593 40.6125 175.9178 28 G 4.2397 7.8903 111.7316 44.5711 0.0000 168.2153 29 K 3.8577 8.7904 127.8250 56.4560 33.1756 176.3633 30 T 3.2080 9.1386 109.9790 62.2862 69.5924 172.2983 31 G 4.1777 12.0000 108.9769 46.4622 0.0000 172.9120 32 G 3.8565 7.9295 99.2178 46.8258 0.0000 174.4299 33 R 4.4563 7.7222 112.8978 54.8344 30.3755 177.7414 34 G 3.7927 7.9446 106.3476 45.9923 0.0000 172.1349 35 H 4.7586 8.6581 117.1081 55.1193 31.0209 175.1774 36 K 3.3877 9.8096 122.3247 57.5458 31.6990 174.3511 37 G 4.1320 8.4400 103.4343 46.1475 0.0000 174.2821 38 Q 3.9830 8.6857 121.8814 58.8263 29.0378 179.1786 39 K 4.2284 7.9528 115.6792 58.2541 33.1055 178.4142 40 S 4.3533 7.7174 117.2397 59.0231 63.5854 169.8689 41 R 3.7931 8.1027 128.9808 55.5023 29.6771 175.6786 42 S 3.9452 8.5780 117.8318 60.5875 62.3377 174.0492 43 G 3.7418 8.9611 118.9560 46.5707 0.0000 172.3961 44 G 4.4126 8.2330 105.0635 41.3849 0.0000 173.3644 45 G 3.9814 7.3842 109.1865 45.2834 0.0000 171.4797 46 V 4.3144 7.6102 111.8270 58.7910 35.0071 176.0825 47 R 4.0683 8.4258 120.2111 56.0980 29.6653 176.0399 48 R 3.9874 8.2469 117.9584 57.7565 30.5569 176.5465 49 G 4.2425 8.9816 110.2401 45.4878 0.0000 173.9494 50 F 4.2547 7.6896 121.9251 58.4580 39.9218 174.7594 51 E 4.5445 7.3679 126.0836 55.6251 29.8875 175.9139 52 G 3.6698 7.1232 107.6909 45.7346 0.0000 173.1552 53 G 3.7025 8.3354 106.1026 46.4179 0.0000 173.8995 54 Q 3.8379 7.7868 120.3626 56.0952 29.5891 176.0237 55 M 4.1249 8.2551 122.5366 54.2927 33.0712 174.5165 56 P 4.4839 0.0000 0.0000 62.0797 32.6201 176.7735 57 L 3.9375 8.5466 124.2202 58.6940 41.9301 179.5186 58 Y 4.4919 8.0516 113.2411 57.0623 37.5748 176.2065 59 R 4.5296 8.0304 118.8564 58.1776 35.4399 177.1135 60 R 4.0136 7.9471 115.6775 58.2384 30.3913 176.6724 61 L 4.5474 7.4996 117.7831 52.6003 42.8639 174.7983 62 P 4.5747 0.0000 0.0000 62.0688 32.3238 176.2203 63 K 4.3947 8.4158 119.4962 56.8725 32.6878 176.8766 64 F 4.8573 7.9077 111.9649 57.3754 40.0611 176.6122 65 G 3.4992 7.4250 112.1800 45.7808 0.0000 172.3655 66 F 4.0388 8.5121 122.8624 57.7629 39.4620 174.2897 67 T 4.1982 8.1381 125.1609 62.6031 69.8037 175.3187 68 S 4.1552 8.4503 118.3568 60.1091 63.2417 175.3268 69 R 4.3970 8.2175 123.3789 57.3990 28.8440 178.4665 70 K 4.0648 7.8308 117.1733 59.3053 31.8156 178.5487 71 A 4.3692 8.7791 122.7329 54.2694 18.0335 179.0504 72 A 4.1922 7.6339 118.3708 53.6507 18.7011 177.8934 73 I 4.6318 7.5736 111.1103 60.5532 39.3088 174.9909 74 T 5.2283 7.9812 112.5747 60.8140 71.5125 172.8822 75 A 5.3233 9.0043 127.9939 49.8739 22.6999 174.1796 76 E 5.1560 8.6216 115.3852 55.0678 32.7382 176.6356 77 I 4.5274 8.6142 121.2956 59.0358 39.3189 174.6986 78 R 4.0717 8.5708 125.5081 56.2574 30.7814 177.6746 79 L 4.0132 8.1552 118.9714 57.8469 42.0890 180.0128 80 S 4.3302 8.1671 111.8691 60.7367 62.8885 174.8938 81 D 4.4950 7.1743 118.6818 54.1477 41.5756 174.4118 82 L 4.1501 8.8921 123.9740 56.2548 41.1722 176.9789 83 A 4.1817 7.1247 120.1656 53.9364 18.3243 177.9635 84 K 4.6410 7.8289 113.4134 56.2835 33.1214 177.6953 85 V 3.5902 7.7401 121.3008 62.9972 31.5509 173.4136 86 E 3.4812 8.3228 123.6748 55.2933 26.7966 171.2702 87 G 3.4474 9.5085 111.9200 47.3611 0.0000 175.5689 88 G 3.3068 7.7908 109.9243 46.9963 0.0000 171.9796 89 V 4.7645 7.8802 124.3140 60.2065 32.6864 175.6385 90 V 4.0046 8.4187 125.3136 62.0479 31.8949 174.9082 91 D 4.8765 8.4892 127.7718 53.0891 41.7466 176.7165 92 L 4.1692 8.6944 120.2412 57.5984 42.6886 178.3844 93 N 4.8113 7.5125 112.8435 51.2321 36.8974 175.6357 94 T 3.6279 8.9506 113.8867 63.6417 67.2863 173.2290 95 L 3.9358 7.9356 120.1512 57.8606 41.5624 179.1012 96 K 3.7908 8.0828 118.4768 59.8577 31.8227 178.4050 97 A 4.1090 7.9026 118.3105 54.5091 18.4396 178.3504 98 A 4.2123 8.0937 117.3416 51.9230 18.4029 177.3833 99 N 4.1802 7.7641 115.4176 54.6904 38.2313 174.9314 100 I 4.0053 7.5544 108.9829 62.2017 37.8939 175.3350 101 I 4.0457 7.1962 118.4678 60.8640 40.3507 174.3709 102 G 4.0168 8.5288 111.0211 44.8143 0.0000 174.0457 103 I 3.6415 8.6844 127.4119 64.6606 37.2016 177.5849 104 Q 4.1131 7.9008 116.7507 57.7873 28.9906 176.6771 105 I 3.8792 7.3914 118.8282 62.0240 37.5404 175.3685 106 E 4.2813 8.7323 122.7669 56.3794 31.6896 176.1193 107 F 5.2374 7.5350 115.8902 55.9160 44.2449 173.8720 108 A 5.0467 8.4925 120.4022 51.1584 22.5203 175.5217 109 K 5.1847 8.8988 121.7039 54.3628 34.9460 177.4173 110 V 3.7999 8.4468 122.5011 64.9319 31.8117 176.1329 111 I 3.5525 7.8962 119.8835 61.5639 36.1694 172.8852 112 L 4.4906 8.1605 125.3490 53.8618 40.4650 176.4159 113 A 4.6147 8.0363 132.4279 51.9161 19.8038 177.5241 114 G 3.6584 8.9499 109.0143 48.1989 0.0000 173.0746 115 E 3.7063 8.4886 115.0101 56.5736 25.8458 172.7755 116 V 4.3311 7.5808 116.7731 60.3099 33.5975 174.5378 117 T 4.4056 7.9568 120.0942 63.9863 71.5582 174.1883 118 T 3.8896 7.7253 113.2731 61.6197 69.2854 171.8814 119 P 5.1666 0.0000 0.0000 61.9422 32.1704 175.8750 120 V 4.5311 8.2346 122.1245 61.1879 35.4496 173.6995 121 T 5.2304 8.1228 120.3823 60.2804 69.8490 172.9310 122 V 4.7976 8.9184 129.3315 59.8413 34.0489 174.5531 123 R 5.1625 8.3569 125.1027 55.0034 31.5308 174.7827 124 G 4.1002 9.4191 114.7902 45.1706 0.0000 173.3145 125 L 4.4602 7.3725 118.3297 53.9771 42.8653 177.0803 126 R 4.3966 8.5210 122.7444 56.4970 31.5688 175.5278 127 V 4.8448 7.9564 122.1227 60.2284 34.4498 174.8367 128 T 4.1077 8.5902 113.4951 61.0862 69.4538 174.4171 129 K 3.8319 8.5552 120.7434 59.9169 31.9098 179.1905 130 G 3.9777 8.0836 104.4490 48.1345 0.0000 175.0880 131 A 3.9602 7.6620 122.3346 54.8698 18.6054 179.4007 132 R 3.8699 8.3863 117.4562 59.7434 29.8301 178.4935 133 A 3.9203 8.0828 119.9946 55.0546 18.4015 179.3010 134 A 3.9010 8.0823 119.0441 55.4072 18.4975 179.4463 135 I 3.6183 8.0788 118.5054 64.8868 37.2122 178.4136 136 E 4.2115 8.3429 119.5101 58.9231 29.2352 179.1646 137 A 4.1723 8.1384 118.3126 53.4616 18.7497 177.4069 138 A 4.5909 7.7661 121.1682 51.7030 19.5601 178.3078 139 G 3.9554 8.5124 108.7236 46.8535 0.0000 174.9806 140 G 3.9552 7.9679 107.6100 46.0795 0.0000 172.6247 141 K 4.7700 9.6381 121.3789 54.5193 36.1816 175.2995 142 I 5.1390 8.3934 125.6103 59.7620 39.9450 174.3299 143 E 4.8209 8.7960 125.5673 54.2044 32.6909 176.3427 144 E 4.2037 8.5778 117.7402 56.6381 30.0550 176.0807 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 2 R 8.06 4.84 0.00 1.89 2.05 0.00 3.37 0.00 0.00 3.29 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.59 0.00 3 L 7.94 4.11 0.00 1.68 1.67 0.92 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 4 N 7.80 5.12 0.00 2.80 2.80 0.00 0.00 5.90 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 5 T 8.29 4.55 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 6 L 7.81 4.74 0.00 1.75 1.70 0.92 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 7 S 8.21 4.75 0.00 3.94 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 8 P 0.00 4.49 0.00 2.20 2.11 0.00 3.78 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 1.96 0.00 9 A 8.33 4.03 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 10 E 8.56 4.01 0.00 1.92 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 2.29 2.37 0.00 11 G 8.90 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 0.00 0.00 0.00 12 S 6.82 4.02 0.00 3.80 3.87 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 0.00 0.00 0.00 0.00 13 K 7.51 4.28 0.00 1.79 1.76 0.00 1.82 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.44 1.36 7.81 14 K 7.82 4.23 0.00 1.71 1.71 0.00 1.81 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.42 1.44 7.81 15 A 8.27 4.02 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 9.21 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 0.00 0.00 0.00 17 K 8.25 3.96 0.00 1.75 1.77 0.00 1.73 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.45 1.47 7.81 18 R 8.67 4.18 0.00 1.79 1.96 0.00 3.26 0.00 0.00 3.15 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.59 0.00 19 L 8.03 4.06 0.00 1.79 1.73 0.98 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 0.00 0.00 0.00 0.00 0.00 0.00 20 G 8.91 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 0.00 0.00 0.00 21 R 7.64 4.50 0.00 1.70 1.83 0.00 3.26 0.00 0.00 3.23 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.68 0.00 22 G 8.55 4.03 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 0.00 0.00 0.00 23 I 8.48 3.64 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 0.78 0.91 0.00 0.00 24 G 8.21 3.81 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 0.00 0.00 0.00 25 S 7.64 4.07 0.00 3.93 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 26 G 7.19 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 27 L 7.84 4.43 0.00 1.87 1.85 0.92 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 28 G 7.89 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 29 K 8.79 3.86 0.00 1.97 1.77 0.00 1.88 0.00 0.00 1.87 0.00 0.00 2.97 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.37 1.41 7.81 30 T 9.14 3.21 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 1.10 0.00 0.00 31 G 12.00 4.18 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 0.00 32 G 7.93 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 0.00 0.00 0.00 33 R 7.72 4.46 0.00 1.85 1.98 0.00 3.15 0.00 0.00 3.22 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.46 0.00 34 G 7.94 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 0.00 0.00 0.00 35 H 8.66 4.76 0.00 3.11 3.20 0.00 6.05 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 K 9.81 3.39 0.00 1.86 1.81 0.00 1.78 0.00 0.00 1.72 0.00 0.00 3.01 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.39 1.44 7.81 37 G 8.44 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 38 Q 8.69 3.98 0.00 2.09 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.88 0.00 0.00 0.00 0.00 0.00 2.43 2.40 0.00 39 K 7.95 4.23 0.00 1.80 1.86 0.00 1.81 0.00 0.00 1.78 0.00 0.00 3.09 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.46 1.44 7.81 40 S 7.72 4.35 0.00 3.99 3.82 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 41 R 8.10 3.79 0.00 1.97 2.06 0.00 3.33 0.00 0.00 3.15 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.74 0.00 42 S 8.58 3.95 0.00 3.82 3.81 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 43 G 8.96 3.74 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 0.00 0.00 0.00 44 G 8.23 4.41 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 0.00 0.00 0.00 45 G 7.38 3.98 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 0.00 46 V 7.61 4.31 2.18 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 0.67 0.00 0.00 1.03 0.00 0.00 47 R 8.43 4.07 0.00 2.01 2.08 0.00 3.16 0.00 0.00 3.43 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.85 0.00 48 R 8.25 3.99 0.00 1.76 1.89 0.00 3.24 0.00 0.00 3.21 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.69 0.00 49 G 8.98 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 50 F 7.69 4.25 0.00 3.04 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 51 E 7.37 4.54 0.00 1.92 1.86 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 2.29 2.09 0.00 52 G 7.12 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 0.00 0.00 0.00 53 G 8.34 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 54 Q 7.79 3.84 0.00 1.92 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.89 0.00 0.00 0.00 0.00 0.00 2.28 2.33 0.00 55 M 8.26 4.12 0.00 1.93 1.89 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.54 0.00 56 P 0.00 4.48 0.00 1.40 1.99 0.00 3.45 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.92 0.00 57 L 8.55 3.94 0.00 1.76 1.80 0.94 0.83 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 58 Y 8.05 4.49 0.00 3.15 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 59 R 8.03 4.53 0.00 1.60 1.76 0.00 3.19 0.00 0.00 3.02 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 1.09 0.00 60 R 7.95 4.01 0.00 1.78 1.96 0.00 3.17 0.00 0.00 3.19 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.73 0.00 61 L 7.50 4.55 0.00 1.87 1.65 0.93 1.09 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 62 P 0.00 4.57 0.00 2.25 2.08 0.00 3.79 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.01 0.00 63 K 8.42 4.39 0.00 1.81 1.79 0.00 1.79 0.00 0.00 1.78 0.00 0.00 3.05 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.48 1.46 7.81 64 F 7.91 4.86 0.00 3.07 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 65 G 7.42 3.50 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 0.00 0.00 0.00 66 F 8.51 4.04 0.00 2.95 3.32 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 67 T 8.14 4.20 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 1.17 0.00 0.00 68 S 8.45 4.16 0.00 3.62 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 69 R 8.22 4.40 0.00 2.13 2.11 0.00 3.22 0.00 0.00 3.30 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.64 0.00 70 K 7.83 4.06 0.00 1.88 1.84 0.00 1.75 0.00 0.00 1.81 0.00 0.00 2.69 0.00 0.00 2.68 0.00 0.00 0.00 0.00 1.57 1.70 7.81 71 A 8.78 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 72 A 7.63 4.19 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 73 I 7.57 4.63 1.87 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 1.54 1.56 0.95 0.00 0.00 74 T 7.98 5.23 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 1.56 0.00 0.00 75 A 9.00 5.32 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 76 E 8.62 5.16 0.00 1.94 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 2.16 2.30 0.00 77 I 8.61 4.53 1.88 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 1.23 1.13 0.91 0.00 0.00 78 R 8.57 4.07 0.00 1.76 1.88 0.00 3.14 0.00 0.00 3.34 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.70 0.00 79 L 8.16 4.01 0.00 1.93 1.71 0.92 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 80 S 8.17 4.33 0.00 4.00 4.29 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 81 D 7.17 4.49 0.00 2.79 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 82 L 8.89 4.15 0.00 1.87 1.82 0.92 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 0.00 0.00 0.00 0.00 0.00 0.00 83 A 7.12 4.18 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 84 K 7.83 4.64 0.00 1.82 1.84 0.00 1.58 0.00 0.00 1.75 0.00 0.00 3.03 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.28 1.37 7.81 85 V 7.74 3.59 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 0.77 0.00 0.00 0.93 0.00 0.00 86 E 8.32 3.48 0.00 2.12 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 2.17 2.29 0.00 87 G 9.51 3.45 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 0.00 88 G 7.79 3.31 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 0.00 0.00 0.00 89 V 7.88 4.76 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 0.79 0.00 0.00 0.93 0.00 0.00 90 V 8.42 4.00 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 0.98 0.00 0.00 0.93 0.00 0.00 91 D 8.49 4.88 0.00 2.60 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 92 L 8.69 4.17 0.00 1.62 1.75 0.93 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 93 N 7.51 4.81 0.00 2.79 2.22 0.00 0.00 5.95 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 94 T 8.95 3.63 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 1.24 0.00 0.00 95 L 7.94 3.94 0.00 1.80 1.72 0.92 0.56 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 96 K 8.08 3.79 0.00 1.80 1.81 0.00 1.69 0.00 0.00 1.95 0.00 0.00 2.94 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.50 1.51 7.81 97 A 7.90 4.11 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 98 A 8.09 4.21 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 99 N 7.76 4.18 0.00 2.86 2.91 0.00 0.00 7.10 8.01 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 0.00 100 I 7.55 4.01 2.02 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 0.71 0.98 0.00 0.00 101 I 7.20 4.05 1.93 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 1.34 0.80 0.89 0.00 0.00 102 G 8.53 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 0.00 103 I 8.68 3.64 1.85 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 1.40 0.56 0.89 0.00 0.00 104 Q 7.90 4.11 0.00 2.02 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.53 6.89 0.00 0.00 0.00 0.00 0.00 2.34 2.30 0.00 105 I 7.39 3.88 1.96 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 0.72 0.92 0.00 0.00 106 E 8.73 4.28 0.00 1.16 1.12 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 1.97 2.00 0.00 107 F 7.53 5.24 0.00 2.96 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 0.00 108 A 8.49 5.05 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 0.00 109 K 8.90 5.18 0.00 1.73 1.71 0.00 1.66 0.00 0.00 1.67 0.00 0.00 2.80 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.37 1.21 7.81 110 V 8.45 3.80 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 0.93 0.00 0.00 0.94 0.00 0.00 111 I 7.90 3.55 1.88 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 1.30 0.42 0.91 0.00 0.00 112 L 8.16 4.49 0.00 1.60 1.60 0.92 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 113 A 8.04 4.61 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 0.00 114 G 8.95 3.66 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 0.00 0.00 0.00 115 E 8.49 3.71 0.00 2.20 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 2.30 2.40 0.00 116 V 7.58 4.33 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 0.76 0.00 0.00 0.93 0.00 0.00 117 T 7.96 4.41 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 0.00 118 T 7.73 3.89 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 0.00 119 P 0.00 5.17 0.00 2.06 2.09 0.00 3.66 0.00 0.00 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.02 0.00 120 V 8.23 4.53 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 1.06 0.00 0.00 0.97 0.00 0.00 121 T 8.12 5.23 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 1.26 0.00 0.00 122 V 8.92 4.80 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 0.94 0.00 0.00 123 R 8.36 5.16 0.00 1.82 1.82 0.00 3.07 0.00 0.00 3.09 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.39 0.00 124 G 9.42 4.10 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 0.00 125 L 7.37 4.46 0.00 1.56 1.80 0.93 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 126 R 8.52 4.40 0.00 1.96 1.80 0.00 3.04 0.00 0.00 3.20 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.58 0.00 127 V 7.96 4.84 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 0.78 0.00 0.00 0.95 0.00 0.00 128 T 8.59 4.11 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 0.00 129 K 8.56 3.83 0.00 1.81 1.87 0.00 1.71 0.00 0.00 1.82 0.00 0.00 2.94 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.54 1.54 7.81 130 G 8.08 3.98 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 0.00 131 A 7.66 3.96 1.38 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 0.00 0.00 0.00 0.00 0.00 0.00 132 R 8.39 3.87 0.00 1.85 2.14 0.00 3.10 0.00 0.00 3.17 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.68 0.00 133 A 8.08 3.92 1.38 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 0.00 0.00 0.00 0.00 0.00 0.00 134 A 8.08 3.90 1.33 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 0.00 0.00 0.00 135 I 8.08 3.62 2.00 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 1.52 0.42 0.91 0.00 0.00 136 E 8.34 4.21 0.00 2.12 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 2.33 2.26 0.00 137 A 8.14 4.17 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 0.00 138 A 7.77 4.59 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 0.00 139 G 8.51 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 0.00 140 G 7.97 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 0.00 141 K 9.64 4.77 0.00 1.76 1.59 0.00 1.47 0.00 0.00 1.65 0.00 0.00 2.90 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.32 1.44 7.81 142 I 8.39 5.14 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 1.40 0.79 0.98 0.00 0.00 143 E 8.80 4.82 0.00 2.07 2.04 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 2.34 2.23 0.00 144 E 8.58 4.20 0.00 2.08 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 0.00 2.24 2.36 0.00