NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 E 4.2123 8.2876 120.2264 59.2579 30.1028 177.1350 4 E 3.6919 7.3917 117.5145 55.9184 30.3870 178.2460 5 K 3.9674 10.1629 121.9320 60.5345 33.5600 179.7753 6 K 4.0312 7.6762 115.6705 57.6859 32.0986 176.6374 7 R 4.7613 8.0510 119.6124 57.4290 30.4184 177.0349 8 R 4.4277 8.0216 115.5199 56.0657 32.1131 177.9304 9 A 4.3690 7.5137 118.3539 53.3481 19.4902 178.9479 10 A 3.9849 7.9535 118.9925 54.9672 17.6949 179.5827 11 T 4.0106 7.8401 113.5326 66.1802 68.9358 176.7354 12 A 4.1457 7.3563 122.1882 56.1701 18.1768 179.0776 13 R 4.0012 8.7618 116.3022 58.1701 29.8473 179.9230 14 R 3.7946 7.5894 119.3273 58.9736 30.6251 178.4869 15 Q 4.0603 9.4322 118.0863 58.7374 29.1334 177.7124 16 H 4.2420 10.7044 117.1795 58.9888 29.7682 176.6451 17 L 4.1452 10.8200 121.0234 57.0103 41.8160 178.8836 18 K 3.8391 8.6702 118.8598 59.8425 31.9363 179.0622 19 S 4.1005 8.2445 113.1339 61.2516 61.9490 176.2121 20 A 3.9507 9.2921 122.7048 55.6247 18.5406 178.7548 21 M 3.9111 8.1131 116.1728 59.1928 31.8734 178.7086 22 L 3.9411 8.0240 117.5737 58.1757 41.9159 179.5471 23 Q 3.8756 7.4856 117.3864 58.5809 29.0949 178.0523 24 L 4.2593 7.7775 120.5051 57.7234 42.4126 177.8544 25 A 3.9822 8.0243 119.5075 55.4674 18.3826 179.0577 26 V 3.5908 8.1046 117.5411 65.9874 30.6816 178.5466 27 T 3.7854 7.7911 113.7376 64.1158 66.9695 175.5965 28 E 3.7305 8.3846 120.8883 58.4101 29.4120 178.8486 29 I 3.7056 7.8643 120.8531 64.4605 37.2841 177.5197 30 E 4.4416 7.6358 115.1922 56.9540 29.1778 177.6624 31 K 4.3031 7.6884 119.1077 58.7157 33.5607 177.9304 32 E 4.0360 7.6858 117.7240 58.0432 29.4859 177.4965 33 A 4.3038 7.7416 118.6004 54.7752 19.1516 178.5724 34 A 4.1271 7.6968 116.7764 54.1500 18.3278 179.2823 35 A 4.1154 8.1496 119.5499 54.3364 18.8875 179.2385 36 K 3.7706 7.6525 116.7239 58.3996 32.3195 177.8762 37 E 4.1868 8.8409 119.4819 58.6931 29.7218 177.7013 38 V 3.9785 7.0194 115.0029 64.7768 32.0664 177.2110 39 E 4.2482 8.8313 119.1430 57.2854 29.6941 178.3172 40 K 3.9150 8.2177 116.5792 57.9983 31.3745 178.4698 41 Q 4.0192 5.7400 121.1834 59.1655 29.0536 178.4385 42 N 4.3532 8.8402 118.0272 56.4802 38.5155 176.8101 43 Y 3.8853 8.5460 119.4107 59.7455 39.2079 176.7888 44 L 4.3307 7.5177 120.6307 57.0576 42.6776 177.8441 45 A 4.0586 8.1704 121.5167 54.3202 17.6106 178.4892 46 E 4.4499 7.8965 113.1278 57.0350 31.5669 177.7921 47 H 4.1830 8.2163 115.2884 57.8256 29.1230 175.2594 48 S 4.7158 7.1004 107.6464 57.0650 64.4431 173.0177 49 P 4.9323 0.0000 0.0000 60.6834 32.7494 173.9729 50 P 4.3311 0.0000 0.0000 62.8715 30.7727 175.3114 51 L 3.8335 7.2640 120.1649 54.4283 43.6795 174.9277 52 S 4.7035 8.1809 114.9870 56.2500 65.7347 172.4716 53 L 4.7477 8.1551 122.6641 53.0705 42.2535 175.8165 54 P 4.6755 0.0000 0.0000 62.1964 30.7614 175.2057 55 G 3.7987 8.3080 111.8055 46.8007 0.0000 174.7653 56 S 4.6619 8.4232 112.4251 58.4802 64.8007 176.5393 57 M 4.1439 8.1485 112.9062 52.2853 34.4070 179.7187 58 Q 3.7458 8.9906 116.7226 58.4720 29.8134 178.6244 59 E 4.0696 7.9344 116.6788 59.4828 29.9253 178.7040 60 L 3.9371 7.9817 119.7758 57.8185 41.5497 179.2904 61 Q 3.9358 8.0310 115.8952 59.7992 28.8921 178.8868 62 E 4.0767 8.1806 120.8155 58.1257 29.6025 179.2058 63 L 3.7215 8.2763 119.7396 58.5670 42.9482 178.5965 64 S 4.0689 8.6804 114.0774 61.6356 62.3562 178.1774 65 K 4.4255 8.7781 119.3724 58.3615 32.1556 177.9193 66 K 3.8410 8.1932 119.1918 60.4819 32.1540 178.4462 67 L 3.9064 8.2026 118.1057 58.7123 41.3602 179.0357 68 H 4.0114 8.3677 118.1127 60.1118 30.2979 176.5485 69 A 3.7008 9.7040 120.1114 56.2009 17.3797 178.9377 70 K 3.8248 9.0556 118.0071 58.7354 32.6026 179.1880 71 I 3.8072 8.2085 120.7668 64.8127 37.0286 177.8718 72 D 4.2821 8.0232 119.2048 57.3526 40.8024 178.4730 73 S 4.1203 8.1017 113.2123 62.2312 62.1612 175.2960 74 V 3.8303 9.5509 121.9675 63.5059 31.0029 177.5909 75 D 4.3714 8.4028 117.3657 57.6198 41.8016 178.2149 76 E 3.9037 8.6896 119.9336 60.1398 29.2740 178.7034 77 E 4.3619 7.8375 119.0106 58.9198 29.8351 179.0598 78 R 4.0170 8.4264 119.1586 59.8039 29.9876 177.7090 79 Y 4.1292 8.6223 119.7759 60.5606 38.8319 177.3825 80 D 4.2610 8.6343 120.2290 58.3616 40.9155 178.4563 81 T 4.0363 8.1806 117.4669 64.5711 68.1909 175.7098 82 E 3.9164 8.1831 123.6074 60.4162 29.8754 178.6710 83 V 3.6839 7.4864 118.6989 64.3275 31.1830 176.8330 84 K 3.7530 8.2144 118.8515 58.9914 32.4572 177.8194 85 L 4.2928 8.2753 121.9575 56.6155 41.9701 177.7722 86 Q 4.0206 9.1534 119.2357 59.2915 29.1151 179.0476 87 K 3.8849 8.8367 121.5708 60.0090 32.0437 178.5207 88 T 4.1217 7.7980 114.4415 65.2821 68.1683 176.2726 89 N 4.4929 8.1279 119.3263 55.7184 38.9842 176.9720 90 K 4.0641 8.2097 121.2932 59.2660 32.2881 178.1291 91 E 3.8989 7.9084 119.5882 59.4529 29.4542 178.6752 92 L 3.9579 7.3632 119.4141 59.3501 39.8020 179.2276 93 E 4.0856 8.3524 119.0082 58.3200 27.9832 178.2766 94 D 4.6273 8.3545 118.3612 55.1772 41.2517 177.3180 95 L 4.5659 7.6540 118.6971 54.6378 42.1309 178.2060 96 S 4.2165 7.6433 114.1982 61.3904 62.3170 175.6947 97 Q 4.1636 8.0398 121.8593 58.9979 27.2994 177.6747 98 K 3.8205 7.5481 118.3973 59.4634 32.1524 178.5511 99 L 3.9763 7.6070 118.9952 58.3591 42.1149 178.1937 100 F 4.2168 7.9090 119.4993 61.3736 39.0867 176.5000 101 D 3.3700 7.2156 118.6895 55.5736 38.9004 178.0076 102 L 4.1595 6.7554 119.1710 57.6636 42.7085 177.5992 103 R 3.9045 7.5840 117.1242 57.0663 30.8937 176.9120 104 G 3.7618 7.5097 108.0376 46.2764 0.0000 174.3167 105 K 4.2782 8.0284 118.0340 55.5239 34.0813 178.2050 106 F 3.8690 8.2757 112.7440 57.6873 37.6733 174.5246 107 K 4.5780 8.1222 119.3436 56.1514 32.6427 177.3565 108 R 3.9919 8.2107 120.6386 58.8619 30.1503 176.6222 109 P 4.1551 0.0000 0.0000 65.4770 31.2677 175.3837 110 P 4.3385 0.0000 0.0000 64.8788 31.0424 177.7461 111 L 3.9139 7.2043 116.2245 58.8472 40.3385 179.3366 112 R 3.8427 8.0527 118.2425 58.7090 30.3423 178.5035 113 R 4.0599 8.0730 114.9279 59.3834 30.2495 178.4093 114 V 3.7663 7.7552 116.2844 65.2762 31.8822 178.6123 115 R 3.6549 7.5563 117.4679 59.0065 29.4068 177.6342 116 M 3.8897 8.2312 117.8041 58.0736 31.9999 176.9214 117 S 4.0782 7.2851 110.9916 61.5591 62.7707 173.9404 118 A 4.1737 7.4097 125.3178 52.4235 18.0020 177.0624 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 3 E 8.29 4.21 0.00 2.01 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 2.25 0.00 4 E 7.39 3.69 0.00 2.32 2.27 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 2.34 2.42 0.00 5 K 10.16 3.97 0.00 1.93 2.20 0.00 1.41 0.00 0.00 1.73 0.00 0.00 3.13 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.43 1.58 7.81 6 K 7.68 4.03 0.00 1.81 2.09 0.00 1.32 0.00 0.00 1.57 0.00 0.00 2.92 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.42 1.53 7.81 7 R 8.05 4.76 0.00 1.86 1.96 0.00 3.23 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 1.61 1.59 0.00 8 R 8.02 4.43 0.00 1.93 1.92 0.00 3.23 0.00 0.00 3.45 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.65 0.00 9 A 7.51 4.37 1.35 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 10 A 7.95 3.98 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 11 T 7.84 4.01 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 1.22 0.00 0.00 12 A 7.36 4.15 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 13 R 8.76 4.00 0.00 2.09 1.84 0.00 3.36 0.00 0.00 3.19 8.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.84 0.00 14 R 7.59 3.79 0.00 1.95 1.96 0.00 3.11 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 1.65 1.95 0.00 15 Q 9.43 4.06 0.00 2.23 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.77 0.00 0.00 0.00 0.00 0.00 2.54 2.50 0.00 16 H 10.70 4.24 0.00 3.14 3.50 0.00 5.94 0.00 0.00 0.00 0.00 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 L 10.82 4.15 0.00 1.83 1.63 0.93 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 18 K 8.67 3.84 0.00 1.74 1.90 0.00 1.79 0.00 0.00 1.57 0.00 0.00 2.88 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.47 1.83 7.81 19 S 8.24 4.10 0.00 4.01 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 20 A 9.29 3.95 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 21 M 8.11 3.91 0.00 2.06 2.30 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 2.69 2.66 0.00 22 L 8.02 3.94 0.00 1.70 1.72 0.92 1.07 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 23 Q 7.49 3.88 0.00 2.27 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.83 0.00 0.00 0.00 0.00 0.00 2.38 2.40 0.00 24 L 7.78 4.26 0.00 2.10 1.65 0.91 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 25 A 8.02 3.98 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 26 V 8.10 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 0.84 0.00 0.00 0.93 0.00 0.00 27 T 7.79 3.79 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 1.25 0.00 0.00 28 E 8.38 3.73 0.00 2.22 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 0.00 2.30 2.39 0.00 29 I 7.86 3.71 2.12 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 1.57 1.39 0.91 0.00 0.00 30 E 7.64 4.44 0.00 2.04 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 2.39 2.34 0.00 31 K 7.69 4.30 0.00 1.75 1.86 0.00 1.68 0.00 0.00 1.57 0.00 0.00 2.92 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.37 1.61 7.81 32 E 7.69 4.04 0.00 2.00 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 2.30 2.33 0.00 33 A 7.74 4.30 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 34 A 7.70 4.13 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 35 A 8.15 4.12 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 36 K 7.65 3.77 0.00 2.15 1.80 0.00 1.72 0.00 0.00 1.69 0.00 0.00 2.95 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.42 1.47 7.81 37 E 8.84 4.19 0.00 2.12 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 0.00 2.28 2.35 0.00 38 V 7.02 3.98 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 0.85 0.00 0.00 0.97 0.00 0.00 39 E 8.83 4.25 0.00 2.12 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 2.34 2.35 0.00 40 K 8.22 3.92 0.00 2.09 1.68 0.00 1.73 0.00 0.00 1.66 0.00 0.00 2.97 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.46 1.47 7.81 41 Q 5.74 4.02 0.00 2.22 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.60 0.00 0.00 0.00 0.00 0.00 2.67 2.62 0.00 42 N 8.84 4.35 0.00 2.84 2.89 0.00 0.00 6.51 7.37 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 43 Y 8.55 3.89 0.00 3.04 3.20 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 0.00 0.00 0.00 44 L 7.52 4.33 0.00 1.74 1.79 1.03 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 45 A 8.17 4.06 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 E 7.90 4.45 0.00 2.06 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 0.00 1.99 2.01 0.00 47 H 8.22 4.18 0.00 3.13 3.37 0.00 5.74 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 S 7.10 4.72 0.00 3.81 3.73 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 49 P 0.00 4.93 0.00 2.07 2.03 0.00 3.80 0.00 0.00 4.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.11 0.00 50 P 0.00 4.33 0.00 2.03 2.07 0.00 3.71 0.00 0.00 3.58 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 51 L 7.26 3.83 0.00 1.70 1.61 0.92 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 52 S 8.18 4.70 0.00 3.80 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 53 L 8.16 4.75 0.00 1.76 1.64 0.92 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 54 P 0.00 4.68 0.00 2.06 2.03 0.00 3.66 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.08 0.00 55 G 8.31 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 0.00 0.00 0.00 56 S 8.42 4.66 0.00 3.92 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 57 M 8.15 4.14 0.00 2.24 2.02 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 2.64 2.59 0.00 58 Q 8.99 3.75 0.00 2.10 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.63 6.97 0.00 0.00 0.00 0.00 0.00 2.43 2.36 0.00 59 E 7.93 4.07 0.00 2.19 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 0.00 2.29 2.34 0.00 60 L 7.98 3.94 0.00 1.71 1.77 0.98 0.82 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 61 Q 8.03 3.94 0.00 2.14 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 7.11 0.00 0.00 0.00 0.00 0.00 2.38 2.47 0.00 62 E 8.18 4.08 0.00 2.15 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 2.30 2.31 0.00 63 L 8.28 3.72 0.00 1.83 1.72 0.92 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 64 S 8.68 4.07 0.00 4.07 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 65 K 8.78 4.43 0.00 2.03 1.73 0.00 1.68 0.00 0.00 1.57 0.00 0.00 2.92 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.45 1.50 7.81 66 K 8.19 3.84 0.00 1.82 2.02 0.00 1.76 0.00 0.00 1.82 0.00 0.00 3.08 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.52 1.56 7.81 67 L 8.20 3.91 0.00 1.86 1.70 0.93 1.13 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 68 H 8.37 4.01 0.00 3.18 3.50 0.00 5.79 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 A 9.70 3.70 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 70 K 9.06 3.82 0.00 1.79 1.84 0.00 1.69 0.00 0.00 1.67 0.00 0.00 2.99 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.44 1.50 7.81 71 I 8.21 3.81 1.97 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 1.50 0.69 0.82 0.00 0.00 72 D 8.02 4.28 0.00 2.83 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 S 8.10 4.12 0.00 3.88 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 74 V 9.55 3.83 2.31 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 0.96 0.00 0.00 0.95 0.00 0.00 75 D 8.40 4.37 0.00 2.93 2.64 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 76 E 8.69 3.90 0.00 2.11 2.11 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 2.57 2.43 0.00 77 E 7.84 4.36 0.00 2.20 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 2.37 2.40 0.00 78 R 8.43 4.02 0.00 1.86 1.97 0.00 3.12 0.00 0.00 3.42 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.71 0.00 79 Y 8.62 4.13 0.00 3.06 3.21 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 80 D 8.63 4.26 0.00 2.84 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 81 T 8.18 4.04 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 1.17 0.00 0.00 82 E 8.18 3.92 0.00 1.95 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 2.31 2.34 0.00 83 V 7.49 3.68 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 0.86 0.00 0.00 -0.22 0.00 0.00 84 K 8.21 3.75 0.00 1.78 1.81 0.00 1.73 0.00 0.00 1.54 0.00 0.00 2.85 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.41 1.51 7.81 85 L 8.28 4.29 0.00 1.75 1.63 0.89 0.90 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 86 Q 9.15 4.02 0.00 2.12 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.56 0.00 0.00 0.00 0.00 0.00 2.38 2.37 0.00 87 K 8.84 3.88 0.00 1.75 1.82 0.00 1.60 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.42 1.47 7.81 88 T 7.80 4.12 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 1.20 0.00 0.00 89 N 8.13 4.49 0.00 2.88 2.86 0.00 0.00 6.89 8.12 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 90 K 8.21 4.06 0.00 1.97 1.91 0.00 1.56 0.00 0.00 1.57 0.00 0.00 2.97 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.43 1.48 7.81 91 E 7.91 3.90 0.00 2.09 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 2.32 2.35 0.00 92 L 7.36 3.96 0.00 1.93 1.93 0.92 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 93 E 8.35 4.09 0.00 2.22 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 2.33 2.52 0.00 94 D 8.35 4.63 0.00 2.86 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 95 L 7.65 4.57 0.00 1.84 1.68 0.92 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 96 S 7.64 4.22 0.00 4.04 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 0.00 97 Q 8.04 4.16 0.00 2.25 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.64 0.00 0.00 0.00 0.00 0.00 2.48 2.56 0.00 98 K 7.55 3.82 0.00 1.84 1.93 0.00 1.68 0.00 0.00 1.57 0.00 0.00 2.88 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.43 1.45 7.81 99 L 7.61 3.98 0.00 2.04 1.68 0.91 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 100 F 7.91 4.22 0.00 3.15 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 0.00 101 D 7.22 3.37 0.00 2.64 2.40 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 0.00 102 L 6.76 4.16 0.00 1.72 1.63 0.88 0.90 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 0.00 103 R 7.58 3.90 0.00 2.09 1.84 0.00 3.34 0.00 0.00 3.20 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.70 0.00 104 G 7.51 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 0.00 105 K 8.03 4.28 0.00 1.79 1.93 0.00 1.89 0.00 0.00 1.76 0.00 0.00 3.04 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.38 1.41 7.81 106 F 8.28 3.87 0.00 3.19 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 0.00 107 K 8.12 4.58 0.00 1.67 1.77 0.00 1.69 0.00 0.00 1.77 0.00 0.00 2.89 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.19 1.34 7.81 108 R 8.21 3.99 0.00 1.74 1.92 0.00 3.24 0.00 0.00 3.31 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.41 0.00 109 P 0.00 4.16 0.00 2.17 2.22 0.00 3.71 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.02 0.00 110 P 0.00 4.34 0.00 2.23 2.35 0.00 3.94 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 1.96 0.00 111 L 7.20 3.91 0.00 1.82 1.98 0.86 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 112 R 8.05 3.84 0.00 1.80 2.03 0.00 3.36 0.00 0.00 3.19 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.59 0.00 113 R 8.07 4.06 0.00 1.79 1.98 0.00 3.22 0.00 0.00 3.27 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.61 0.00 114 V 7.76 3.77 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 0.78 0.00 0.00 0.93 0.00 0.00 115 R 7.56 3.65 0.00 2.09 2.23 0.00 2.96 0.00 0.00 3.09 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.98 0.00 116 M 8.23 3.89 0.00 1.99 2.15 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 2.59 2.49 0.00 117 S 7.29 4.08 0.00 3.70 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 0.00 118 A 7.41 4.17 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