NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 E 4.3412 8.4449 121.4738 56.1811 31.5995 176.1238 3 Q 5.1920 7.4868 113.8794 55.8013 31.9881 172.8788 4 Y 3.7368 9.3082 122.6819 56.4073 39.8103 173.2452 5 Y 5.5032 8.2022 125.3236 55.2617 39.3015 174.3424 6 G 4.2105 7.8382 114.6707 44.3288 0.0000 171.6392 7 T 4.1588 8.4607 122.9787 63.4349 69.5036 173.6903 8 G 4.2553 9.0981 114.3033 44.7533 0.0000 172.9439 9 R 4.5626 7.7688 118.2991 55.6876 32.8606 173.7567 10 R 4.1630 9.3806 121.3036 56.6743 33.4700 172.0759 11 K 3.5794 8.2553 129.0511 58.1803 29.4582 174.6062 12 E 3.6868 8.1231 115.4425 56.3744 28.3320 174.0953 13 A 5.1144 8.1272 121.8024 49.7364 20.0789 175.3827 14 V 4.9016 8.1653 122.1748 61.8023 34.3758 174.4863 15 A 5.0601 9.8962 128.5052 50.1175 22.8605 174.8970 16 R 5.3144 8.2431 118.1893 53.5078 33.3916 175.2447 17 V 4.2729 6.9825 122.7241 61.1865 33.4357 173.9091 18 F 5.6723 8.9903 128.0663 56.3137 40.9480 175.3835 19 L 5.0247 8.1400 120.6724 53.3927 46.4028 176.0188 20 R 4.8364 8.2499 115.6041 54.8747 34.3484 172.4789 21 P 4.4295 0.0000 0.0000 60.9292 31.4733 177.7945 22 G 4.1338 7.9928 110.2168 46.4981 0.0000 175.1882 23 N 3.9671 8.2330 120.0551 54.2490 38.6881 176.6181 24 G 4.4599 7.6518 105.6859 45.1652 0.0000 173.6780 25 K 4.0853 7.3286 118.7468 56.9206 32.6900 176.7368 26 V 4.7173 8.2215 126.7592 62.4727 32.5008 174.8728 27 T 5.1457 8.3326 123.2246 62.3583 73.3690 172.6038 28 V 4.7000 8.9284 121.5983 63.4730 35.9421 173.2072 29 N 3.9665 8.9866 117.8209 54.4470 35.5130 175.2361 30 G 3.8891 9.7045 106.2499 45.9279 0.0000 173.7441 31 Q 4.4307 8.4936 118.8406 55.2214 32.9740 172.7886 32 D 5.3801 8.2495 116.1968 51.9125 43.1102 176.2580 33 F 4.0990 8.8100 124.6619 62.5670 39.6464 178.0554 34 N 4.5781 7.7403 118.9213 52.8684 37.9816 175.8920 35 E 4.5661 7.8477 117.2806 56.6801 33.1328 175.0577 36 Y 4.6131 7.9417 118.4243 58.9909 39.3256 175.7247 37 F 4.9928 7.7742 117.9538 57.0397 39.5314 175.8537 38 Q 3.9162 8.0273 122.5952 57.8075 28.9974 174.3987 39 G 4.2643 8.9624 122.3252 45.6340 0.0000 172.7074 40 L 3.8975 7.6763 128.2416 54.0240 40.9209 178.3018 41 V 3.5467 8.2689 124.4128 65.6416 31.9077 178.0999 42 R 3.8605 8.1434 119.1182 58.6835 30.2353 177.4436 43 A 4.0295 7.7583 119.4042 56.1204 18.0940 179.7665 44 V 4.0837 7.7899 109.2663 64.7483 31.6282 178.8168 45 A 4.0287 8.3546 120.5624 55.0527 18.1844 179.0995 46 A 3.9997 8.4480 119.7081 55.3643 18.3210 179.1801 47 L 4.1976 7.6943 115.3580 55.4302 42.1452 178.2914 48 E 3.8115 8.4259 121.0035 58.8864 29.2924 176.5291 49 P 4.0011 0.0000 0.0000 64.2773 31.1364 177.5078 50 L 4.1106 8.5081 120.3984 57.2189 41.8700 178.8309 51 R 4.1172 8.0216 117.6869 58.3572 29.9924 178.1225 52 A 4.3427 8.0969 118.5129 53.7062 18.6183 178.4386 53 V 4.3640 7.3720 107.7943 61.1191 32.9303 175.2384 54 D 5.1125 8.6205 123.9484 53.3787 37.1045 175.8848 55 A 4.9663 8.2609 118.0120 52.1318 19.4925 179.0318 56 L 4.1498 8.1569 123.4299 59.5692 42.3530 177.7480 57 G 4.0858 7.4515 102.2822 45.6990 0.0000 174.6216 58 R 3.9057 7.4623 121.1434 57.4403 30.2747 176.0190 59 F 4.5570 7.9900 116.6554 56.3269 42.7458 174.4047 60 D 4.0502 9.1050 126.5486 56.3225 41.1858 173.6866 61 A 3.5415 8.1656 129.2677 52.0015 16.3429 175.3022 62 Y 4.9400 9.4782 124.8053 57.0468 41.0414 174.7885 63 I 4.4208 7.8758 127.4987 60.1642 40.9309 175.8102 64 T 4.4641 8.6794 120.5751 63.1704 71.7978 173.6791 65 V 4.7379 7.6537 126.2543 60.1138 34.5704 175.5676 66 R 4.2987 8.4815 115.0501 55.9323 35.2772 173.7578 67 G 4.5298 9.4813 110.7299 45.8051 0.0000 173.8474 68 G 3.9182 8.6438 110.8204 46.8735 0.0000 174.6519 69 G 4.2147 8.0714 109.5610 41.6565 0.0000 172.5755 70 K 3.8320 8.5045 122.2492 59.5346 32.4738 178.2449 71 S 4.0532 7.9525 112.6514 61.4113 62.3471 176.2116 72 G 3.7117 7.9846 107.7552 47.7766 0.0000 174.8966 73 Q 4.3002 8.6139 119.1551 57.3850 28.6546 177.8063 74 I 4.2594 7.9484 121.5186 63.3274 38.0155 177.6071 75 D 4.4278 7.9016 117.5649 57.0957 40.8930 178.0212 76 A 4.1124 8.7284 122.4971 54.5714 18.4831 179.2257 77 I 3.5390 7.6096 115.7558 64.4946 37.1799 178.1921 78 K 4.1606 7.8316 121.4375 59.0159 31.8835 178.0099 79 L 4.2179 8.3134 120.3348 57.3076 42.2195 178.7309 80 G 3.8573 7.8212 105.3297 48.8560 0.0000 175.6034 81 I 3.6285 8.2760 122.4234 63.6647 36.8804 178.2136 82 A 3.9416 7.2535 119.0700 54.1336 18.4303 178.7576 83 R 4.1417 7.7198 116.9188 58.1716 30.3911 178.3393 84 A 4.0392 7.5591 120.6553 54.8725 18.2757 179.2650 85 L 3.8882 7.7534 116.1860 57.5157 40.4647 178.5931 86 V 4.2719 7.2883 118.9540 63.3483 32.8338 176.8459 87 Q 4.1057 8.1104 120.4722 59.4279 29.0481 178.4969 88 Y 4.1753 8.2855 112.9766 57.0026 37.5388 176.2037 89 N 5.0995 7.6753 127.6442 53.3009 41.6794 172.8484 90 P 4.5945 0.0000 0.0000 63.0264 31.4942 177.1231 91 D 4.6070 8.0643 120.2382 56.8392 42.0106 176.5753 92 Y 4.3076 8.2483 116.7698 58.0415 37.8426 175.5662 93 R 4.3717 7.8859 121.3425 58.3279 31.6422 179.7780 94 A 4.5461 7.7959 119.0394 51.3187 17.5263 177.7558 95 K 4.6612 9.2268 119.4767 59.9225 38.6278 178.2153 96 L 4.1685 8.2027 121.2193 57.8973 42.5551 178.5719 97 K 3.8847 8.2653 119.1452 59.1402 31.7895 176.1100 98 P 4.0644 0.0000 0.0000 66.8056 31.8795 177.2971 99 L 3.9762 8.2854 123.4888 55.8475 39.9576 176.7906 100 G 3.9778 6.6791 106.5221 45.7508 0.0000 171.8880 101 F 5.2438 8.6337 121.2984 56.7002 41.6366 175.3388 102 L 4.5323 7.5999 122.4744 54.4036 42.8771 175.1161 103 T 4.1705 8.0278 119.3971 62.9712 71.6267 174.0968 104 R 3.6520 9.3171 123.1225 58.2830 30.5517 177.6205 105 D 4.0176 7.9639 113.3496 55.1535 37.7079 175.3181 106 A 4.4306 8.4202 130.4055 52.4435 17.8635 177.2162 107 R 4.3401 8.0968 118.4081 57.1797 31.0839 176.9905 108 V 4.1901 7.5097 111.0849 60.8143 34.9215 172.1972 109 V 3.6925 8.5680 124.7510 62.7276 31.9182 175.4347 110 E 4.5101 8.3755 124.9220 54.1281 31.5798 175.4436 111 R 3.9064 8.3026 119.1767 56.7326 30.4680 175.3076 112 K 4.4211 8.3135 123.8395 54.9621 33.5959 176.1091 113 K 4.4190 8.2283 124.7069 54.5984 34.4149 175.0306 114 Y 4.3167 9.0566 118.2688 57.6845 39.0002 175.6800 115 G 3.8692 8.9407 112.2819 46.3298 0.0000 174.3598 116 K 5.1653 7.6987 111.1679 57.7771 33.9560 182.7068 117 H 3.6485 7.0350 112.3235 56.3717 30.5646 175.5796 118 K 4.4861 7.6892 124.1380 57.2708 32.7971 176.2005 119 A 3.8548 7.9711 116.7622 52.0149 16.8316 178.9870 120 R 5.1769 7.5526 130.8508 58.6833 31.0835 173.8011 121 R 4.1085 7.4479 119.1781 55.6273 30.4869 174.4192 122 A 4.8412 8.3873 128.7235 49.4682 20.5798 174.6190 123 P 4.4449 0.0000 0.0000 62.3851 31.7647 175.8924 124 Q 4.0136 8.5000 117.4702 56.5471 28.3723 177.1496 125 Y 4.5105 8.4187 125.6861 56.3351 36.5414 174.8788 126 S 3.8892 7.8603 118.6915 58.5228 63.8067 176.1257 127 K 4.4264 8.2810 124.2964 56.7558 32.3394 176.7924 128 R 4.1081 7.6035 121.1816 56.7504 30.0470 175.9830 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 E 8.44 4.34 0.00 1.96 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 2.18 2.34 0.00 3 Q 7.49 5.19 0.00 1.94 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.94 6.77 0.00 0.00 0.00 0.00 0.00 2.22 2.23 0.00 4 Y 9.31 3.74 0.00 2.52 2.43 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 8.20 5.50 0.00 3.30 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 G 7.84 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 0.00 0.00 0.00 0.00 7 T 8.46 4.16 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 1.39 0.00 0.00 8 G 9.10 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 0.00 0.00 0.00 0.00 9 R 7.77 4.56 0.00 1.73 1.77 0.00 3.31 0.00 0.00 3.16 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.51 0.00 10 R 9.38 4.16 0.00 1.72 1.77 0.00 3.42 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 1.40 1.65 0.00 11 K 8.26 3.58 0.00 2.00 1.82 0.00 1.91 0.00 0.00 1.81 0.00 0.00 3.04 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.38 1.44 7.81 12 E 8.12 3.69 0.00 2.14 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 2.23 0.00 13 A 8.13 5.11 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 14 V 8.17 4.90 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 1.06 0.00 0.00 0.94 0.00 0.00 15 A 9.90 5.06 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 16 R 8.24 5.31 0.00 1.59 1.85 0.00 2.94 0.00 0.00 3.16 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.43 0.00 17 V 6.98 4.27 1.85 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 0.82 0.00 0.00 0.72 0.00 0.00 18 F 8.99 5.67 0.00 3.41 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 19 L 8.14 5.02 0.00 1.69 0.82 0.51 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 20 R 8.25 4.84 0.00 1.76 1.84 0.00 3.21 0.00 0.00 3.35 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.73 0.00 21 P 0.00 4.43 0.00 1.83 1.69 0.00 4.03 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 1.77 0.00 22 G 7.99 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 23 N 8.23 3.97 0.00 2.79 2.87 0.00 0.00 6.81 8.33 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 24 G 7.65 4.46 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 0.00 25 K 7.33 4.09 0.00 1.62 1.91 0.00 1.61 0.00 0.00 1.63 0.00 0.00 2.75 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.54 1.52 7.81 26 V 8.22 4.72 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 0.62 0.00 0.00 0.86 0.00 0.00 27 T 8.33 5.15 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 1.43 0.00 0.00 28 V 8.93 4.70 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 0.75 0.00 0.00 0.70 0.00 0.00 29 N 8.99 3.97 0.00 2.26 2.84 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 30 G 9.70 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 0.00 0.00 0.00 31 Q 8.49 4.43 0.00 1.99 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.66 0.00 0.00 0.00 0.00 0.00 2.29 2.32 0.00 32 D 8.25 5.38 0.00 2.67 2.52 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 33 F 8.81 4.10 0.00 3.01 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 34 N 7.74 4.58 0.00 2.69 2.73 0.00 0.00 6.56 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 35 E 7.85 4.57 0.00 1.86 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 2.22 2.30 0.00 36 Y 7.94 4.61 0.00 2.74 2.65 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 37 F 7.77 4.99 0.00 2.71 2.75 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 38 Q 8.03 3.92 0.00 2.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.56 0.00 0.00 0.00 0.00 0.00 2.32 2.34 0.00 39 G 8.96 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 0.00 0.00 0.00 0.00 40 L 7.68 3.90 0.00 1.57 1.51 0.64 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 41 V 8.27 3.55 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 0.95 0.00 0.00 0.97 0.00 0.00 42 R 8.14 3.86 0.00 1.84 1.86 0.00 3.24 0.00 0.00 3.28 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.65 0.00 43 A 7.76 4.03 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 44 V 7.79 4.08 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 0.86 0.00 0.00 0.99 0.00 0.00 45 A 8.35 4.03 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.45 4.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.69 4.20 0.00 1.66 1.60 0.21 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 48 E 8.43 3.81 0.00 2.05 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 2.42 2.54 0.00 49 P 0.00 4.00 0.00 1.52 0.60 0.00 3.76 0.00 0.00 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.71 0.00 50 L 8.51 4.11 0.00 1.71 1.79 0.82 -0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 51 R 8.02 4.12 0.00 2.01 2.01 0.00 3.47 0.00 0.00 3.21 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.65 0.00 52 A 8.10 4.34 1.54 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 0.00 0.00 53 V 7.37 4.36 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 0.99 0.00 0.00 0.98 0.00 0.00 54 D 8.62 5.11 0.00 2.85 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 55 A 8.26 4.97 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 56 L 8.16 4.15 0.00 1.65 1.74 0.95 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 57 G 7.45 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 0.00 0.00 0.00 0.00 58 R 7.46 3.91 0.00 2.16 1.98 0.00 3.11 0.00 0.00 3.27 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 1.33 0.00 59 F 7.99 4.56 0.00 2.85 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 60 D 9.10 4.05 0.00 2.63 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 61 A 8.17 3.54 1.31 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 62 Y 9.48 4.94 0.00 2.98 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 63 I 7.88 4.42 1.64 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.20 0.73 0.00 0.00 64 T 8.68 4.46 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 1.10 0.00 0.00 65 V 7.65 4.74 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 0.82 0.00 0.00 1.03 0.00 0.00 66 R 8.48 4.30 0.00 1.76 1.82 0.00 3.08 0.00 0.00 3.16 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.46 0.00 67 G 9.48 4.53 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 0.00 0.00 0.00 68 G 8.64 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 0.00 0.00 0.00 69 G 8.07 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 0.00 0.00 0.00 0.00 70 K 8.50 3.83 0.00 1.59 1.69 0.00 0.61 0.00 0.00 1.25 0.00 0.00 2.55 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.13 1.17 7.81 71 S 7.95 4.05 0.00 3.79 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 72 G 7.98 3.71 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 Q 8.61 4.30 0.00 2.34 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.56 0.00 0.00 0.00 0.00 0.00 2.52 2.61 0.00 74 I 7.95 4.26 1.83 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 -0.23 0.31 0.86 0.00 0.00 75 D 7.90 4.43 0.00 2.76 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 76 A 8.73 4.11 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.61 3.54 1.94 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 1.41 0.96 0.82 0.00 0.00 78 K 7.83 4.16 0.00 1.87 1.95 0.00 1.65 0.00 0.00 1.68 0.00 0.00 3.00 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.30 1.49 7.81 79 L 8.31 4.22 0.00 1.66 1.73 0.90 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 80 G 7.82 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 81 I 8.28 3.63 1.68 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.92 0.69 0.00 0.00 82 A 7.25 3.94 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 83 R 7.72 4.14 0.00 1.93 2.01 0.00 3.20 0.00 0.00 3.19 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.63 0.00 84 A 7.56 4.04 1.31 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 85 L 7.75 3.89 0.00 1.56 1.55 0.99 0.59 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 86 V 7.29 4.27 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 0.91 0.00 0.00 0.98 0.00 0.00 87 Q 8.11 4.11 0.00 2.23 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.11 7.15 0.00 0.00 0.00 0.00 0.00 2.44 2.39 0.00 88 Y 8.29 4.18 0.00 3.20 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 89 N 7.68 5.10 0.00 2.58 2.81 0.00 0.00 6.82 8.24 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 90 P 0.00 4.59 0.00 2.21 2.16 0.00 3.79 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.96 0.00 91 D 8.06 4.61 0.00 2.94 2.94 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 92 Y 8.25 4.31 0.00 3.21 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 93 R 7.89 4.37 0.00 1.93 1.92 0.00 3.27 0.00 0.00 3.39 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.69 0.00 94 A 7.80 4.55 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 95 K 9.23 4.66 0.00 1.91 1.98 0.00 1.41 0.00 0.00 1.70 0.00 0.00 3.08 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.26 1.41 7.81 96 L 8.20 4.17 0.00 2.00 1.80 1.04 0.45 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 97 K 8.27 3.88 0.00 1.91 1.81 0.00 1.72 0.00 0.00 1.85 0.00 0.00 2.98 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.52 1.53 7.81 98 P 0.00 4.06 0.00 2.06 2.02 0.00 3.83 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.11 0.00 99 L 8.29 3.98 0.00 1.49 1.49 0.10 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 100 G 6.68 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 0.00 101 F 8.63 5.24 0.00 3.12 2.85 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 0.00 102 L 7.60 4.53 0.00 1.61 1.59 0.96 0.96 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 0.00 103 T 8.03 4.17 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 1.25 0.00 0.00 104 R 9.32 3.65 0.00 1.80 2.00 0.00 3.57 0.00 0.00 3.23 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.63 0.00 105 D 7.96 4.02 0.00 2.83 2.97 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 0.00 106 A 8.42 4.43 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 0.00 107 R 8.10 4.34 0.00 1.76 1.86 0.00 3.36 0.00 0.00 3.22 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.60 0.00 108 V 7.51 4.19 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 0.59 0.00 0.00 0.93 0.00 0.00 109 V 8.57 3.69 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 0.81 0.00 0.00 0.93 0.00 0.00 110 E 8.38 4.51 0.00 2.10 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 2.21 2.28 0.00 111 R 8.30 3.91 0.00 1.77 1.88 0.00 3.17 0.00 0.00 3.11 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.60 0.00 112 K 8.31 4.42 0.00 1.75 1.66 0.00 1.95 0.00 0.00 1.70 0.00 0.00 3.00 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.36 1.45 7.81 113 K 8.23 4.42 0.00 1.88 2.04 0.00 1.70 0.00 0.00 1.79 0.00 0.00 3.17 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.46 1.49 7.81 114 Y 9.06 4.32 0.00 2.96 2.90 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 0.00 115 G 8.94 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 0.00 0.00 0.00 116 K 7.70 5.17 0.00 1.95 1.85 0.00 2.00 0.00 0.00 1.79 0.00 0.00 2.94 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.67 1.44 7.81 117 H 7.04 3.65 0.00 3.25 3.59 0.00 5.68 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 K 7.69 4.49 0.00 1.76 1.83 0.00 1.90 0.00 0.00 1.72 0.00 0.00 3.03 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.38 1.45 7.81 119 A 7.97 3.85 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 R 7.55 5.18 0.00 1.84 2.09 0.00 3.24 0.00 0.00 3.16 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.38 0.00 121 R 7.45 4.11 0.00 1.88 1.94 0.00 3.45 0.00 0.00 3.43 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.58 0.00 122 A 8.39 4.84 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 0.00 123 P 0.00 4.44 0.00 2.25 2.23 0.00 3.79 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 2.00 1.99 0.00 124 Q 8.50 4.01 0.00 2.10 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.54 7.46 0.00 0.00 0.00 0.00 0.00 2.39 2.31 0.00 125 Y 8.42 4.51 0.00 2.87 2.79 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 0.00 126 S 7.86 3.89 0.00 4.01 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 0.00 127 K 8.28 4.43 0.00 1.54 1.89 0.00 1.33 0.00 0.00 1.53 0.00 0.00 2.96 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.26 1.49 7.81 128 R 7.60 4.11 0.00 1.87 1.87 0.00 3.39 0.00 0.00 3.43 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.76 0.00