NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 V 4.0128 8.0544 114.0568 60.4955 33.5850 174.7512 2 L 3.9607 7.8082 123.4089 53.3079 42.4246 175.4009 3 S 4.3018 8.5140 120.7481 58.4584 65.2924 174.4538 4 S 4.1927 8.5173 121.0266 61.4613 62.7658 176.5626 5 K 3.9634 7.9768 122.7945 59.3158 32.0143 178.4506 6 D 4.3648 8.0364 118.8278 57.1839 40.9313 178.5932 7 K 3.9854 8.6619 119.4487 59.6221 31.8894 179.6216 8 T 3.8647 7.7673 115.8331 66.8396 68.5328 176.7572 9 N 4.3002 8.4230 118.6628 56.2360 38.4865 177.7618 10 V 3.5826 7.8477 119.7696 65.7426 31.3878 178.2417 11 K 3.9303 7.5989 117.0953 59.5927 32.1911 179.0080 12 T 3.9920 8.1647 110.0071 64.8734 68.6310 175.9487 13 A 3.9635 7.9060 124.1201 54.7912 18.6313 179.1458 14 F 4.2523 8.5329 114.1996 58.7524 38.8771 177.5508 15 G 3.7947 8.0707 105.5036 46.5341 0.0000 175.9515 16 K 4.1949 7.7338 119.7962 59.9283 32.6069 178.5432 17 I 3.8801 7.8958 120.6717 59.3434 36.7195 180.7674 18 G 3.9916 8.9301 108.5659 46.5687 0.0000 174.6496 19 G 3.5723 8.8403 111.5958 46.4238 0.0000 175.2511 20 H 4.1125 7.9258 117.0463 56.9667 28.4885 176.9316 21 A 3.8978 7.2686 123.2988 55.1958 18.1305 179.5303 22 A 4.0785 7.7970 118.6185 55.3913 18.5977 179.5944 23 E 3.9873 7.8215 116.6176 59.5234 29.6033 178.9768 24 Y 4.5149 8.3269 117.6602 60.6969 37.8874 178.0356 25 G 3.7395 8.4072 106.7509 48.0164 0.0000 175.5575 26 A 3.9728 7.8249 123.3696 54.5493 18.3239 179.2926 27 E 3.8665 8.1269 117.1783 59.4167 29.6750 178.9008 28 A 3.9270 8.4923 121.1837 55.0564 18.4344 179.4762 29 L 3.3782 7.9826 117.6186 57.7571 41.6408 179.5067 30 E 4.0157 8.0686 119.0460 59.3103 29.6572 178.7279 31 R 3.8846 8.1216 118.4501 59.7290 30.0906 178.7003 32 M 4.3279 8.1231 117.7666 58.8102 31.8339 178.3407 33 F 4.6622 7.9838 117.9039 60.2799 38.7832 177.5337 34 L 4.2816 8.0761 118.1094 57.2708 41.8540 179.1312 35 G 3.3887 8.3152 105.0426 46.0986 0.0000 173.8612 36 F 4.9288 8.3355 120.4126 53.7057 39.5470 173.5059 37 P 4.6663 0.0000 0.0000 64.5261 30.9608 177.6945 38 T 4.0128 8.1888 108.9732 65.0240 68.1705 176.2049 39 T 4.3078 8.5531 112.3489 64.2835 68.7554 176.7330 40 K 4.0376 8.2547 122.0815 59.4368 31.8170 178.8638 41 T 3.9364 7.5765 108.2761 64.0748 68.6567 175.3063 42 Y 4.0874 7.6934 118.1659 58.8829 38.8378 175.1160 43 F 4.7204 8.4243 120.0941 56.0903 39.8939 175.0143 44 P 4.3156 0.0000 0.0000 65.2890 31.5060 176.6540 45 H 4.6690 8.0659 112.7804 55.6340 29.1310 174.6805 46 F 5.2323 7.6418 119.3921 55.5240 41.1614 174.7219 47 D 4.4134 8.7888 124.4728 54.6101 41.2153 175.7899 48 L 4.4925 8.3317 125.6376 54.2243 42.6961 176.9705 49 S 4.2258 8.1905 114.9172 58.1266 63.3452 173.3558 50 H 4.2244 8.7835 121.4572 58.3052 29.6431 175.4593 51 G 3.8196 8.8138 114.2215 45.7864 0.0000 174.0820 52 S 4.2038 7.7173 115.2287 58.3484 64.7950 175.3353 53 A 4.0113 8.4729 124.8461 54.9996 18.0933 180.3407 54 Q 3.5406 7.7585 116.5089 58.8909 29.0466 178.4243 55 V 3.5624 7.4907 119.1186 65.8450 31.4951 178.2127 56 K 3.9049 8.0407 117.9913 59.4446 31.9707 179.2415 57 A 3.9541 7.8400 121.0467 55.3994 18.2982 179.2217 58 H 4.2858 8.6415 117.4266 59.1637 29.9091 177.5760 59 G 3.7221 8.5503 108.1067 47.6570 0.0000 175.5812 60 K 3.9286 8.0686 121.7144 59.1915 32.2901 178.7252 61 K 3.8433 7.7643 118.4166 59.7887 32.0440 179.3572 62 V 3.7074 7.8731 118.0754 65.9563 31.4373 178.2029 63 G 3.7401 8.2790 105.5747 48.1531 0.0000 175.4289 64 D 4.4073 8.6772 121.5370 56.7262 40.7099 178.7738 65 A 4.0283 8.0654 121.5608 55.2084 18.3859 179.7296 66 L 4.1457 8.1448 117.5839 58.0693 41.4957 179.6017 67 T 3.8827 8.0892 115.1089 66.7457 68.6579 175.9870 68 K 4.0678 8.2387 120.9457 59.5380 32.2274 178.5482 69 A 4.0342 8.5019 121.2002 55.2448 18.0958 179.4701 70 A 3.5602 7.8241 118.1981 54.7034 18.3536 178.6718 71 D 4.5807 7.4924 114.7911 54.8217 42.1802 176.1395 72 H 4.9960 8.0526 117.3434 55.0529 29.6298 175.5672 73 L 4.0820 8.0814 120.2884 57.6816 41.9751 178.3309 74 D 4.8056 8.0089 115.9970 54.2292 40.9995 176.4779 75 D 4.7019 8.2656 116.0256 53.5694 43.4950 176.5639 76 L 3.9287 8.3855 119.5268 57.7739 41.2788 177.2834 77 P 4.1618 0.0000 0.0000 65.9051 31.3687 178.3044 78 S 4.1921 7.9402 109.5556 61.1443 62.4835 175.3864 79 A 4.0088 8.2894 123.0852 54.0215 19.2570 178.8569 80 L 4.5541 8.3410 118.1454 53.8407 38.7258 177.2903 81 S 4.1939 7.5275 117.7525 61.2967 63.4186 174.8662 82 A 4.1118 7.9268 122.7735 54.9147 17.9903 179.3787 83 L 4.0983 7.7837 117.2581 57.7094 41.8424 179.2809 84 S 3.9517 7.5895 113.8533 61.5466 62.8122 176.0583 85 D 4.0763 7.5405 119.1430 57.2744 40.9665 178.0598 86 L 3.9338 7.7551 120.3494 58.7576 42.1283 178.7793 87 H 4.5409 8.6851 115.5620 58.2564 28.0678 176.4761 88 A 4.0606 7.4878 123.7572 53.3799 18.9885 178.9430 89 H 4.2778 8.1874 114.1722 58.4866 29.3674 177.4372 90 K 4.2877 8.0637 116.6773 58.5447 32.6135 177.9669 91 L 4.1798 8.3657 116.4868 55.0610 42.3509 176.9742 92 R 4.0082 7.4756 116.3249 57.0574 28.0808 177.3183 93 V 3.8084 8.4043 117.1336 62.1603 32.2364 174.9066 94 D 4.3950 9.4843 127.5859 54.5368 41.2081 175.2849 95 P 4.6223 0.0000 0.0000 66.2184 31.1475 178.4863 96 V 3.6303 8.0691 116.5392 66.2911 31.3492 177.8785 97 N 4.2110 8.3004 115.9449 56.0831 38.2473 177.3820 98 F 4.1783 7.8018 118.8126 60.2519 38.8618 177.8009 99 K 4.0431 7.9743 118.5149 59.3728 31.8091 179.4195 100 L 3.5278 7.4885 118.8428 57.4753 41.4740 179.1356 101 L 3.9716 7.8651 120.3665 58.0374 41.9980 179.1570 102 S 4.1586 8.1660 115.2707 61.7760 62.8007 175.9115 103 H 4.1862 8.3930 120.9764 59.8239 29.5948 177.0964 104 C 4.1275 8.1086 118.2774 62.5740 27.8584 176.0519 105 L 3.9880 8.3444 121.1627 57.7944 41.1684 179.5512 106 L 3.9540 7.9643 118.8768 57.7153 41.5485 179.6633 107 V 3.3451 7.6974 118.1192 66.1714 31.2034 178.1883 108 T 3.6432 7.7664 115.2937 66.4876 68.2158 176.7020 109 V 3.1657 7.5172 119.7510 65.8401 31.3260 177.6889 110 A 3.2617 6.9169 118.7261 55.0481 18.1327 179.3037 111 A 3.8797 7.6611 117.7152 54.7721 18.4183 178.6355 112 H 4.5083 7.4132 113.0032 56.0477 31.3988 175.1305 113 H 4.9988 8.0290 117.4860 53.4127 28.8965 172.3094 114 P 4.3329 0.0000 0.0000 65.5110 32.0426 179.1902 115 G 3.7307 8.1309 107.0101 47.7557 0.0000 173.8441 116 D 4.6201 8.0296 117.2748 54.7711 42.1448 176.7757 117 F 4.5176 7.8028 124.0130 56.9731 37.9500 175.4460 118 T 4.1106 7.2316 114.8493 60.8414 71.2917 173.2845 119 P 4.1346 0.0000 0.0000 66.0360 31.2715 179.1613 120 S 4.0715 7.8739 113.3036 61.5447 62.7821 176.7927 121 V 3.5048 7.5941 120.7229 65.9280 31.1811 177.1163 122 H 3.3454 7.7639 118.2352 59.3140 29.5041 176.6016 123 A 3.9463 7.9034 121.8769 55.4468 18.1830 179.8314 124 S 4.2396 8.0387 113.5437 61.8084 62.8499 177.0064 125 L 4.2563 8.4605 122.1959 57.7126 41.2709 178.9885 126 D 4.4358 8.5441 118.3516 57.4385 41.2080 178.5671 127 K 4.0047 8.2321 118.9911 59.2526 32.0175 179.0875 128 F 4.2437 8.7098 121.3634 61.5466 39.2968 177.3179 129 L 3.7432 8.3630 118.3472 57.3677 41.2903 179.3487 130 A 3.9542 8.2621 121.2077 55.2482 18.3232 179.4624 131 N 4.2022 8.1397 115.0362 56.1843 38.4643 177.9070 132 V 3.3374 7.3807 119.6609 65.9358 31.6164 178.0413 133 S 3.8077 8.0313 115.0996 61.9308 62.4833 176.7194 134 T 3.7346 7.5798 116.7344 66.7641 68.6196 176.3266 135 V 3.6176 7.5509 119.7106 66.0976 31.3479 178.1051 136 L 3.8543 7.7281 117.5346 56.8635 41.7455 178.4669 137 T 4.2210 7.3469 108.4950 61.7207 69.2612 176.7048 138 S 4.1373 7.6254 117.4441 61.1620 63.2513 175.9467 139 K 4.1908 7.6111 118.0589 57.6047 31.6318 177.0621 140 Y 4.5656 7.7529 116.9734 59.1528 38.3777 175.9709 141 R 4.2733 7.8742 123.8321 56.2068 30.5886 175.4176 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 1 V 8.05 4.01 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 0.86 0.00 0.00 0.93 0.00 0.00 2 L 7.81 3.96 0.00 1.70 1.61 1.07 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 3 S 8.51 4.30 0.00 3.93 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 4 S 8.52 4.19 0.00 4.08 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 5 K 7.98 3.96 0.00 1.84 1.84 0.00 1.71 0.00 0.00 1.81 0.00 0.00 2.93 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.50 1.52 7.81 6 D 8.04 4.36 0.00 2.91 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 7 K 8.66 3.99 0.00 1.97 1.85 0.00 1.66 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.46 1.65 7.81 8 T 7.77 3.86 4.32 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 1.20 0.00 0.00 9 N 8.42 4.30 0.00 2.71 2.86 0.00 0.00 6.75 7.85 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 10 V 7.85 3.58 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 0.41 0.00 0.00 1.00 0.00 0.00 11 K 7.60 3.93 0.00 1.94 1.84 0.00 1.69 0.00 0.00 1.74 0.00 0.00 3.03 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.78 1.56 7.81 12 T 8.16 3.99 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 1.29 0.00 0.00 13 A 7.91 3.96 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 14 F 8.53 4.25 0.00 3.17 3.07 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 15 G 8.07 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 0.00 0.00 0.00 16 K 7.73 4.19 0.00 1.79 1.77 0.00 1.77 0.00 0.00 1.71 0.00 0.00 3.30 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.61 1.42 7.81 17 I 7.90 3.88 1.61 0.00 0.00 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.61 0.78 0.00 0.00 18 G 8.93 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 19 G 8.84 3.57 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 0.00 20 H 7.93 4.11 0.00 2.55 2.07 0.00 5.66 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 21 A 7.27 3.90 1.42 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 0.00 0.00 0.00 0.00 0.00 0.00 22 A 7.80 4.08 1.29 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 0.00 0.00 23 E 7.82 3.99 0.00 1.94 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 2.34 2.26 0.00 24 Y 8.33 4.51 0.00 2.89 2.87 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 25 G 8.41 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 26 A 7.82 3.97 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 27 E 8.13 3.87 0.00 2.12 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 0.00 2.29 2.34 0.00 28 A 8.49 3.93 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 29 L 7.98 3.38 0.00 1.74 1.26 0.96 0.61 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 30 E 8.07 4.02 0.00 2.10 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 2.37 2.47 0.00 31 R 8.12 3.88 0.00 1.99 1.95 0.00 3.11 0.00 0.00 3.02 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.82 0.00 32 M 8.12 4.33 0.00 1.92 2.05 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.68 0.00 33 F 7.98 4.66 0.00 3.16 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 L 8.08 4.28 0.00 1.67 1.70 0.99 0.82 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 35 G 8.32 3.39 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 0.00 36 F 8.34 4.93 0.00 3.06 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 37 P 0.00 4.67 0.00 2.22 2.16 0.00 3.96 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.03 0.00 38 T 8.19 4.01 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 1.29 0.00 0.00 39 T 8.55 4.31 4.52 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 1.41 0.00 0.00 40 K 8.25 4.04 0.00 1.90 1.83 0.00 1.62 0.00 0.00 1.61 0.00 0.00 3.03 0.00 0.00 3.41 0.00 0.00 0.00 0.00 1.52 1.72 7.81 41 T 7.58 3.94 4.11 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 1.25 0.00 0.00 42 Y 7.69 4.09 0.00 2.90 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 0.00 0.00 0.00 0.00 43 F 8.42 4.72 0.00 2.85 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 44 P 0.00 4.32 0.00 2.16 2.15 0.00 3.79 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 1.97 1.89 0.00 45 H 8.07 4.67 0.00 3.28 3.36 0.00 5.48 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 F 7.64 5.23 0.00 2.95 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 47 D 8.79 4.41 0.00 2.63 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 48 L 8.33 4.49 0.00 1.51 1.44 -0.24 0.66 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 49 S 8.19 4.23 0.00 4.03 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 50 H 8.78 4.22 0.00 3.34 3.31 0.00 5.79 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 G 8.81 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 0.00 0.00 0.00 52 S 7.72 4.20 0.00 4.13 4.11 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 53 A 8.47 4.01 1.29 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 0.00 0.00 54 Q 7.76 3.54 0.00 1.88 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.85 0.00 0.00 0.00 0.00 0.00 1.97 2.21 0.00 55 V 7.49 3.56 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 0.95 0.00 0.00 1.02 0.00 0.00 56 K 8.04 3.90 0.00 1.95 1.80 0.00 1.69 0.00 0.00 1.62 0.00 0.00 2.91 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.42 1.41 7.81 57 A 7.84 3.95 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 58 H 8.64 4.29 0.00 3.27 3.32 0.00 5.80 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 59 G 8.55 3.72 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 0.00 0.00 0.00 60 K 8.07 3.93 0.00 1.84 1.97 0.00 1.65 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.59 1.47 7.81 61 K 7.76 3.84 0.00 1.94 1.87 0.00 1.77 0.00 0.00 1.60 0.00 0.00 2.93 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.70 1.68 7.81 62 V 7.87 3.71 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 1.09 0.00 0.00 0.97 0.00 0.00 63 G 8.28 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 64 D 8.68 4.41 0.00 2.88 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 65 A 8.07 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 66 L 8.14 4.15 0.00 2.23 2.24 1.15 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 67 T 8.09 3.88 4.49 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 1.26 0.00 0.00 68 K 8.24 4.07 0.00 1.92 1.99 0.00 1.64 0.00 0.00 1.63 0.00 0.00 2.89 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.40 1.50 7.81 69 A 8.50 4.03 1.49 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 70 A 7.82 3.56 0.42 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 0.00 0.00 0.00 0.00 0.00 0.00 71 D 7.49 4.58 0.00 2.74 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 72 H 8.05 5.00 0.00 3.22 3.21 0.00 5.62 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 L 8.08 4.08 0.00 1.64 1.76 0.89 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 74 D 8.01 4.81 0.00 2.64 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 75 D 8.27 4.70 0.00 2.75 2.71 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 76 L 8.39 3.93 0.00 1.69 1.68 0.88 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 77 P 0.00 4.16 0.00 1.98 2.09 0.00 3.59 0.00 0.00 3.55 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 78 S 7.94 4.19 0.00 3.84 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 79 A 8.29 4.01 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 80 L 8.34 4.55 0.00 1.56 1.55 0.83 0.89 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 81 S 7.53 4.19 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 82 A 7.93 4.11 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 83 L 7.78 4.10 0.00 1.68 1.70 0.94 1.04 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 84 S 7.59 3.95 0.00 3.81 3.77 0.00 0.00 0.00 0.00 0.00 0.00 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 D 7.54 4.08 0.00 2.71 2.80 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 86 L 7.76 3.93 0.00 1.98 1.90 0.92 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 87 H 8.69 4.54 0.00 3.37 3.65 0.00 5.85 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 88 A 7.49 4.06 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.19 4.28 0.00 3.34 3.34 0.00 5.67 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 K 8.06 4.29 0.00 1.93 1.85 0.00 1.74 0.00 0.00 1.72 0.00 0.00 3.24 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.40 1.52 7.81 91 L 8.37 4.18 0.00 1.60 1.76 0.70 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 92 R 7.48 4.01 0.00 2.01 2.08 0.00 3.44 0.00 0.00 3.20 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.76 0.00 93 V 8.40 3.81 2.34 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 -0.08 0.00 0.00 0.66 0.00 0.00 94 D 9.48 4.39 0.00 2.81 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 95 P 0.00 4.62 0.00 2.23 2.21 0.00 3.60 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 2.00 2.17 0.00 96 V 8.07 3.63 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 0.99 0.00 0.00 0.99 0.00 0.00 97 N 8.30 4.21 0.00 2.47 2.53 0.00 0.00 7.01 7.72 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 98 F 7.80 4.18 0.00 3.07 3.06 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 99 K 7.97 4.04 0.00 1.87 1.82 0.00 1.66 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.48 1.52 7.81 100 L 7.49 3.53 0.00 1.42 0.57 0.64 -0.29 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 0.00 101 L 7.87 3.97 0.00 1.69 1.63 0.87 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 102 S 8.17 4.16 0.00 4.13 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 0.00 103 H 8.39 4.19 0.00 3.20 3.53 0.00 5.59 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 C 8.11 4.13 0.00 3.17 3.06 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 0.00 105 L 8.34 3.99 0.00 1.91 1.79 1.04 0.54 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 0.00 106 L 7.96 3.95 0.00 1.91 1.76 1.17 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 107 V 7.70 3.35 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 0.91 0.00 0.00 0.77 0.00 0.00 108 T 7.77 3.64 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 1.14 0.00 0.00 109 V 7.52 3.17 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 1.13 0.00 0.00 0.84 0.00 0.00 110 A 6.92 3.26 0.59 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 0.00 0.00 111 A 7.66 3.88 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 0.00 112 H 7.41 4.51 0.00 2.59 3.01 0.00 5.60 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 0.00 113 H 8.03 5.00 0.00 3.22 3.21 0.00 5.62 0.00 0.00 0.00 0.00 6.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 P 0.00 4.33 0.00 2.18 2.16 0.00 3.75 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 1.99 1.93 0.00 115 G 8.13 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 0.00 0.00 0.00 116 D 8.03 4.62 0.00 2.74 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 0.00 117 F 7.80 4.52 0.00 3.14 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.23 4.11 4.20 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 1.20 0.00 0.00 119 P 0.00 4.13 0.00 2.13 2.12 0.00 3.57 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.18 0.00 120 S 7.87 4.07 0.00 3.81 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 0.00 121 V 7.59 3.50 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 1.02 0.00 0.00 0.89 0.00 0.00 122 H 7.76 3.35 0.00 2.37 3.23 0.00 5.65 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 0.00 123 A 7.90 3.95 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 0.00 124 S 8.04 4.24 0.00 3.91 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 0.00 125 L 8.46 4.26 0.00 2.03 1.95 1.13 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 126 D 8.54 4.44 0.00 3.00 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 0.00 127 K 8.23 4.00 0.00 2.09 1.89 0.00 1.79 0.00 0.00 1.72 0.00 0.00 2.92 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.48 1.61 7.81 128 F 8.71 4.24 0.00 3.12 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 0.00 129 L 8.36 3.74 0.00 1.85 1.72 1.18 0.87 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 0.00 130 A 8.26 3.95 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 0.00 131 N 8.14 4.20 0.00 2.85 2.80 0.00 0.00 6.67 7.39 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 0.00 132 V 7.38 3.34 1.87 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 0.97 0.00 0.00 0.26 0.00 0.00 133 S 8.03 3.81 0.00 4.01 3.84 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 0.00 134 T 7.58 3.73 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 1.15 0.00 0.00 135 V 7.55 3.62 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 0.93 0.00 0.00 0.91 0.00 0.00 136 L 7.73 3.85 0.00 0.91 1.19 0.87 1.01 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 0.00 137 T 7.35 4.22 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 0.96 0.00 0.00 138 S 7.63 4.14 0.00 4.00 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 0.00 139 K 7.61 4.19 0.00 1.41 1.63 0.00 1.50 0.00 0.00 1.56 0.00 0.00 2.99 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.22 1.43 7.81 140 Y 7.75 4.57 0.00 3.19 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 0.00 141 R 7.87 4.27 0.00 1.94 1.80 0.00 3.20 0.00 0.00 3.28 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.59 0.00