NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 N 4.7005 8.4093 119.2059 53.6772 40.1138 173.8628 5 I 4.0802 8.1645 118.1123 60.5888 39.3108 173.2803 6 L 5.2988 8.9018 126.8154 53.8235 45.6570 176.1803 7 S 5.3460 8.9012 121.7741 56.9773 66.8033 173.5682 8 V 5.1233 8.7347 114.2990 59.4716 36.3694 173.9383 9 H 5.4138 8.4680 116.2194 54.6712 32.4241 172.0062 10 I 4.7514 8.6579 119.6265 59.3939 40.6044 174.1402 11 L 4.8662 8.9290 129.5386 53.0944 44.5685 174.7429 12 N 5.1086 8.9621 125.9369 53.3217 39.0507 175.3506 13 Q 4.2964 9.2950 126.6152 57.8740 28.6403 177.7767 14 Q 4.2927 8.7418 118.2593 57.3854 29.2260 176.6665 15 T 4.3893 8.1410 105.3769 60.3636 70.2222 174.5992 16 G 4.0293 8.2222 109.8921 46.4117 0.0000 173.2437 17 K 4.8111 7.6558 117.1573 53.2298 36.7500 174.4263 18 P 4.8080 0.0000 0.0000 63.0018 32.3933 176.2108 19 A 4.4286 8.5410 124.4035 50.7112 19.6669 176.4274 20 A 4.4587 8.5480 123.3852 51.8332 20.8032 175.7554 21 D 4.3175 8.5361 117.0141 55.2510 40.5083 173.6898 22 V 4.1803 7.5170 117.5324 61.2840 33.0984 175.1619 23 T 4.5716 8.4979 124.9995 63.7448 69.9538 173.4782 24 V 4.7567 9.0428 125.7313 61.3669 34.8564 174.4391 25 T 4.9281 8.4805 117.9798 60.1116 71.7994 173.1374 26 L 5.1586 8.6125 124.7152 53.4207 45.0181 175.0881 27 E 5.2350 9.3102 124.8349 54.4845 34.2177 174.3710 28 K 4.7160 8.9856 123.3169 54.3540 34.7839 175.2900 29 K 3.5090 8.1037 128.6361 55.9309 32.9452 176.3519 30 A 4.1872 8.3890 128.7685 52.4858 22.5756 176.1662 31 D 4.2985 9.5201 124.0381 55.5278 38.4853 174.5731 32 N 4.2629 8.1583 112.5373 53.3749 37.2359 174.4312 33 G 4.4829 7.6839 106.9857 44.2092 0.0000 171.7031 34 W 5.5523 8.5531 118.3691 54.8995 33.0984 174.5061 35 L 4.6215 9.0865 127.1829 53.1761 43.5024 175.2372 36 Q 4.4692 8.7789 128.1438 56.4980 29.0062 175.3000 37 L 4.5268 8.7392 125.9247 55.6754 44.0606 175.7118 38 N 4.5442 7.5932 114.7231 53.3560 42.3507 172.9422 39 T 5.0503 8.2517 115.3564 60.9405 70.8574 172.1497 40 A 4.6190 8.7381 128.1562 51.2694 23.5840 174.6015 41 K 5.1258 8.2966 117.6105 54.4752 35.0566 177.0858 42 T 4.2138 8.5817 115.4484 62.0363 69.9886 174.6132 43 D 4.9828 8.9510 124.7646 52.4031 41.0046 176.7927 44 K 3.9510 8.5470 117.1965 59.8532 32.4736 177.1337 45 D 4.5589 8.3087 117.5981 53.8088 41.1791 176.7106 46 G 3.9990 8.5333 108.1319 46.1703 0.0000 173.4905 47 R 5.0448 8.3974 118.2734 54.0372 32.6864 175.6176 48 I 4.6463 8.3158 121.8728 59.3894 38.2032 176.7891 49 K 4.0097 8.6964 125.9110 58.5530 32.1986 177.6394 50 A 4.7560 7.4871 120.4369 50.2101 18.9249 174.5324 51 L 4.2224 9.0096 123.4674 56.1199 42.9926 177.4914 52 W 3.9440 8.1472 128.7139 56.2588 30.9960 173.7692 53 P 4.4419 0.0000 0.0000 62.8844 31.9503 176.1146 54 E 4.5424 8.3473 118.5124 55.6210 28.4890 175.9057 55 Q 4.7045 7.4637 115.2943 54.0005 32.4740 175.3953 56 T 3.9475 8.4832 113.6117 61.9638 67.9864 173.9252 57 A 4.5271 8.3841 131.5798 52.2066 19.0817 176.6584 58 T 4.7838 7.7971 108.1759 59.4428 71.6151 174.3354 59 T 4.2931 8.3509 112.5658 61.2447 69.6870 174.6544 60 G 3.9117 7.2365 109.5652 45.0725 0.0000 170.7676 61 D 5.3670 7.5132 118.5686 52.8629 43.5957 175.5763 62 Y 5.2590 8.3938 118.2623 56.4719 43.1738 174.3859 63 R 4.8179 8.9175 120.8393 55.0860 33.4857 174.0683 64 V 4.5585 8.7854 120.2539 59.9760 34.0867 175.3754 65 V 4.5936 8.1164 124.3741 61.0249 34.1451 174.4309 66 F 4.5579 8.9891 128.7112 56.2929 39.3892 176.9581 67 K 4.6786 8.7814 128.5296 55.7280 28.5306 177.7226 68 T 4.2544 7.7033 112.3666 63.7613 69.7935 177.3392 69 G 3.9448 8.0653 109.9403 47.4305 0.0000 175.2592 70 D 4.4058 8.1174 120.8208 57.0908 40.4016 177.9292 71 Y 4.0770 7.6120 119.1751 60.9260 38.7822 178.4193 72 F 4.4091 8.2628 118.7413 60.3223 39.0132 177.6204 73 K 3.9864 8.3887 119.4457 59.4753 31.7586 178.8742 74 K 3.9884 7.9238 117.8995 59.0616 31.9073 178.1030 75 Q 4.4058 7.1275 116.5015 54.3848 29.1435 174.8540 76 N 4.1842 7.8988 116.6928 54.6371 38.1115 173.7081 77 L 4.7651 7.8100 114.7823 52.4563 44.0761 176.8406 78 E 4.2991 8.5329 122.4658 56.0849 30.4168 176.0704 79 S 4.0532 7.9359 114.5806 55.9245 65.6638 173.8725 80 F 4.1974 7.3298 128.4646 60.2278 39.1972 175.2836 81 F 4.8317 7.2991 119.2399 54.7695 40.2186 174.1155 82 P 4.4353 0.0000 0.0000 65.3862 31.6381 175.3798 83 E 4.8839 7.5471 114.1097 55.6512 32.4160 175.2539 84 I 4.3822 8.5202 120.8200 58.7981 39.8141 173.1846 85 P 4.9264 0.0000 0.0000 62.0960 32.9425 175.8262 86 V 4.4812 8.9221 121.9631 61.3918 34.4933 173.7680 87 E 5.3448 9.0025 127.6105 55.0064 31.2287 175.3663 88 F 5.1300 8.7803 118.0535 55.5859 41.9415 173.3199 89 H 4.9084 8.9946 117.5119 55.9292 29.9100 175.2098 90 I 4.2360 8.9102 123.6948 60.0715 38.1839 175.7968 91 N 4.5864 9.0970 124.9667 53.6701 39.4526 175.8252 92 K 4.5863 8.1237 117.2643 54.5326 34.2214 177.3842 93 V 3.5361 8.4741 117.7686 63.4006 31.8292 176.9712 94 N 4.5638 8.0881 115.3812 53.4055 38.9242 174.3338 95 E 4.4824 7.3528 116.0546 54.6027 31.9339 174.3202 96 H 4.8975 8.1995 118.9483 55.2798 31.2002 173.5671 97 Y 4.5338 8.8763 123.1510 56.3261 41.2117 174.1974 98 H 5.1275 8.5255 122.3913 54.6504 33.1888 171.9414 99 V 4.5424 8.6417 125.2403 59.2901 32.8052 172.9348 100 P 4.4063 0.0000 0.0000 61.5254 33.4649 174.6676 101 L 4.5004 8.3477 122.9566 53.3466 45.3437 174.9855 102 L 5.0053 8.8708 127.0244 53.4064 43.3513 175.2769 103 L 5.1761 9.0880 126.7003 53.3972 45.3365 175.4347 104 S 5.3141 9.2209 120.6626 56.7010 67.5923 175.2028 105 Q 3.3402 9.6405 120.3534 58.6672 28.4044 178.2414 106 Y 4.6058 7.7147 112.4706 56.9288 39.2710 175.0396 107 G 4.3453 8.2695 106.3119 45.5558 0.0000 172.3427 108 Y 5.3390 7.6571 117.4538 56.3021 40.9903 173.6243 109 S 4.8465 9.2230 114.7066 57.4300 67.4991 173.3428 110 T 5.1372 8.5795 115.8618 60.9644 70.7750 171.4489 111 Y 4.6907 7.6112 121.4394 56.3809 41.2986 172.6809 112 R 4.3107 8.8366 120.7325 55.5845 30.5664 176.2534 113 G 4.1456 8.5686 115.5186 44.9779 0.0000 173.4545 114 S 4.4626 8.4183 113.3687 58.4574 63.4096 174.0900 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 N 8.41 4.70 0.00 2.74 2.85 0.00 0.00 7.01 7.06 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 5 I 8.16 4.08 1.97 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.49 0.79 0.00 0.00 6 L 8.90 5.30 0.00 1.98 1.82 0.99 1.21 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 7 S 8.90 5.35 0.00 3.48 3.58 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 8 V 8.73 5.12 2.42 0.00 0.00 0.00 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 0.98 0.00 0.00 9 H 8.47 5.41 0.00 3.28 3.37 0.00 5.39 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 I 8.66 4.75 1.68 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 0.75 0.70 0.66 0.00 0.00 11 L 8.93 4.87 0.00 1.74 1.53 0.96 0.47 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 12 N 8.96 5.11 0.00 2.91 2.97 0.00 0.00 6.80 6.45 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 13 Q 9.30 4.30 0.00 2.05 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.73 0.00 0.00 0.00 0.00 0.00 2.46 2.59 0.00 14 Q 8.74 4.29 0.00 2.32 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.74 0.00 0.00 0.00 0.00 0.00 2.47 2.55 0.00 15 T 8.14 4.39 4.30 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 1.30 0.00 0.00 16 G 8.22 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 17 K 7.66 4.81 0.00 1.67 1.68 0.00 1.71 0.00 0.00 1.67 0.00 0.00 2.90 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.37 1.63 7.81 18 P 0.00 4.81 0.00 1.93 2.14 0.00 3.68 0.00 0.00 3.67 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 19 A 8.54 4.43 0.61 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 20 A 8.55 4.46 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 21 D 8.54 4.32 0.00 2.80 2.78 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 22 V 7.52 4.18 1.96 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 0.86 0.00 0.00 0.46 0.00 0.00 23 T 8.50 4.57 4.22 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 1.17 0.00 0.00 24 V 9.04 4.76 1.93 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 0.42 0.00 0.00 0.87 0.00 0.00 25 T 8.48 4.93 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 26 L 8.61 5.16 0.00 1.62 1.33 0.97 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 27 E 9.31 5.23 0.00 1.96 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 2.31 2.17 0.00 28 K 8.99 4.72 0.00 1.83 1.57 0.00 1.76 0.00 0.00 1.55 0.00 0.00 2.82 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.00 0.56 7.81 29 K 8.10 3.51 0.00 0.79 1.01 0.00 0.95 0.00 0.00 1.24 0.00 0.00 2.74 0.00 0.00 2.49 0.00 0.00 0.00 0.00 0.89 0.50 7.81 30 A 8.39 4.19 1.07 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 31 D 9.52 4.30 0.00 2.68 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 32 N 8.16 4.26 0.00 2.83 2.95 0.00 0.00 6.95 7.65 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 33 G 7.68 4.48 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 0.00 0.00 0.00 34 W 8.55 5.55 0.00 3.07 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 35 L 9.09 4.62 0.00 1.67 1.48 0.90 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 36 Q 8.78 4.47 0.00 2.08 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.79 6.66 0.00 0.00 0.00 0.00 0.00 2.28 2.48 0.00 37 L 8.74 4.53 0.00 1.31 1.34 0.62 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 38 N 7.59 4.54 0.00 2.59 2.44 0.00 0.00 6.62 7.22 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 39 T 8.25 5.05 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 1.17 0.00 0.00 40 A 8.74 4.62 1.19 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 41 K 8.30 5.13 0.00 1.59 1.68 0.00 1.76 0.00 0.00 1.91 0.00 0.00 2.75 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.30 1.37 7.81 42 T 8.58 4.21 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 1.25 0.00 0.00 43 D 8.95 4.98 0.00 2.90 2.88 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 44 K 8.55 3.95 0.00 1.89 2.00 0.00 1.57 0.00 0.00 1.71 0.00 0.00 2.97 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.41 1.47 7.81 45 D 8.31 4.56 0.00 2.84 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 46 G 8.53 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 47 R 8.40 5.04 0.00 2.12 1.83 0.00 3.03 0.00 0.00 3.16 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.76 0.00 48 I 8.32 4.65 1.87 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 1.39 0.74 0.93 0.00 0.00 49 K 8.70 4.01 0.00 1.75 1.87 0.00 1.69 0.00 0.00 1.71 0.00 0.00 2.96 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.44 1.44 7.81 50 A 7.49 4.76 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 51 L 9.01 4.22 0.00 1.58 1.88 0.85 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 52 W 8.15 3.94 0.00 3.53 3.02 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 53 P 0.00 4.44 0.00 2.12 2.05 0.00 2.37 0.00 0.00 3.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.64 0.00 54 E 8.35 4.54 0.00 1.98 2.01 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 2.30 2.40 0.00 55 Q 7.46 4.70 0.00 2.18 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.92 0.00 0.00 0.00 0.00 0.00 2.22 2.37 0.00 56 T 8.48 3.95 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 1.26 0.00 0.00 57 A 8.38 4.53 0.35 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 58 T 7.80 4.78 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 1.32 0.00 0.00 59 T 8.35 4.29 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 1.30 0.00 0.00 60 G 7.24 3.91 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 0.00 0.00 0.00 0.00 0.00 0.00 61 D 7.51 5.37 0.00 2.39 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 62 Y 8.39 5.26 0.00 1.91 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 R 8.92 4.82 0.00 0.87 1.15 0.00 2.41 0.00 0.00 2.25 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 1.18 0.00 64 V 8.79 4.56 1.56 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 0.67 0.00 0.00 0.99 0.00 0.00 65 V 8.12 4.59 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 0.92 0.00 0.00 0.77 0.00 0.00 66 F 8.99 4.56 0.00 2.83 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 67 K 8.78 4.68 0.00 1.80 1.76 0.00 1.65 0.00 0.00 1.67 0.00 0.00 2.90 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.46 1.55 7.81 68 T 7.70 4.25 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 69 G 8.07 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 0.00 0.00 0.00 70 D 8.12 4.41 0.00 2.91 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 71 Y 7.61 4.08 0.00 2.90 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 72 F 8.26 4.41 0.00 3.15 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 73 K 8.39 3.99 0.00 2.01 1.98 0.00 1.66 0.00 0.00 1.67 0.00 0.00 2.96 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.45 1.50 7.81 74 K 7.92 3.99 0.00 1.89 1.83 0.00 1.77 0.00 0.00 1.71 0.00 0.00 3.04 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.48 1.64 7.81 75 Q 7.13 4.41 0.00 2.30 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.05 6.69 0.00 0.00 0.00 0.00 0.00 2.20 2.20 0.00 76 N 7.90 4.18 0.00 2.80 2.83 0.00 0.00 6.90 7.07 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 77 L 7.81 4.77 0.00 1.90 1.44 1.10 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 78 E 8.53 4.30 0.00 2.03 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 2.33 2.32 0.00 79 S 7.94 4.05 0.00 3.66 3.69 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 0.00 0.00 0.00 0.00 80 F 7.33 4.20 0.00 2.38 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 F 7.30 4.83 0.00 3.17 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 82 P 0.00 4.44 0.00 2.22 2.30 0.00 3.79 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 1.92 0.00 83 E 7.55 4.88 0.00 1.92 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 2.14 2.28 0.00 84 I 8.52 4.38 1.59 0.00 0.00 0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.20 0.48 0.08 0.00 0.00 85 P 0.00 4.93 0.00 1.92 1.87 0.00 3.68 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.88 0.00 86 V 8.92 4.48 2.28 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 1.12 0.00 0.00 1.12 0.00 0.00 87 E 9.00 5.34 0.00 1.96 1.96 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 2.04 2.17 0.00 88 F 8.78 5.13 0.00 3.17 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 H 8.99 4.91 0.00 3.23 3.34 0.00 5.65 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 I 8.91 4.24 1.95 0.00 0.00 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.05 0.79 0.66 0.00 0.00 91 N 9.10 4.59 0.00 2.82 2.93 0.00 0.00 6.94 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 92 K 8.12 4.59 0.00 1.85 1.73 0.00 1.69 0.00 0.00 1.67 0.00 0.00 2.91 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.40 1.56 7.81 93 V 8.47 3.54 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 0.68 0.00 0.00 0.92 0.00 0.00 94 N 8.09 4.56 0.00 2.68 2.83 0.00 0.00 6.83 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 95 E 7.35 4.48 0.00 2.00 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 1.81 1.62 0.00 96 H 8.20 4.90 0.00 3.09 3.14 0.00 5.69 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 Y 8.88 4.53 0.00 2.88 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 98 H 8.53 5.13 0.00 3.01 3.12 0.00 5.63 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 V 8.64 4.54 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 1.08 0.00 0.00 0.43 0.00 0.00 100 P 0.00 4.41 0.00 1.42 1.36 0.00 2.75 0.00 0.00 3.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.70 0.00 101 L 8.35 4.50 0.00 0.55 0.67 0.51 0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 102 L 8.87 5.01 0.00 1.70 1.64 1.00 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 103 L 9.09 5.18 0.00 1.61 1.60 1.09 0.42 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 0.00 104 S 9.22 5.31 0.00 4.07 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 0.00 105 Q 9.64 3.34 0.00 2.04 1.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.83 6.82 0.00 0.00 0.00 0.00 0.00 1.16 1.76 0.00 106 Y 7.71 4.61 0.00 2.84 2.78 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 0.00 107 G 8.27 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 0.00 108 Y 7.66 5.34 0.00 2.95 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 0.00 109 S 9.22 4.85 0.00 3.83 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 0.00 110 T 8.58 5.14 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 1.33 0.00 0.00 111 Y 7.61 4.69 0.00 3.09 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 0.00 112 R 8.84 4.31 0.00 1.88 1.96 0.00 3.29 0.00 0.00 3.24 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.60 0.00 113 G 8.57 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 0.00 0.00 0.00 114 S 8.42 4.46 0.00 4.01 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