NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 V 3.9575 8.0544 114.0515 61.6036 32.9481 174.1523 2 H 4.5672 8.5674 120.8645 54.1448 30.2601 172.0323 3 L 4.8516 7.7758 126.8910 52.4578 45.7147 176.9974 4 T 4.1097 8.2323 112.8417 60.5257 70.8409 173.9364 5 P 4.1624 0.0000 0.0000 66.0723 31.4254 178.2460 6 E 3.9259 8.2590 116.4053 59.9726 29.3940 179.4481 7 E 3.9575 8.3949 118.2317 59.2429 29.4828 179.7183 8 K 3.8898 8.4178 119.0019 59.6107 32.1877 179.6166 9 S 4.1180 8.3067 115.3413 61.3514 62.7413 176.7678 10 A 3.9617 7.7541 123.0685 55.0749 18.1342 179.7938 11 V 3.4757 7.6828 116.9687 66.4327 31.7184 178.3080 12 T 3.9518 8.0775 109.3381 64.8852 68.2730 176.1793 13 A 4.0486 7.8374 122.6943 54.7215 18.6252 179.0914 14 L 3.9247 8.0189 118.5022 57.8929 42.1681 178.7085 15 W 4.4336 8.8028 128.6913 60.6790 30.3365 177.9596 16 G 3.7711 8.0624 104.6022 47.5135 0.0000 174.9029 17 K 4.3461 7.9344 118.3662 56.0641 32.7540 177.1057 18 V 3.6055 6.9934 120.4115 62.1401 32.0251 175.7217 19 N 4.4995 8.3309 125.6008 52.4724 38.9305 175.3418 20 V 3.5482 8.2025 122.6549 64.6068 31.7440 178.1439 21 D 4.2700 7.9360 117.7619 57.3877 40.7312 178.2023 22 E 3.8400 7.7231 119.1542 59.3243 29.5521 179.0623 23 V 3.6062 7.7742 118.3632 65.6823 31.5369 178.1786 24 G 3.7232 8.5353 106.0752 47.8686 0.0000 175.9357 25 G 3.5536 8.0313 108.0300 47.2934 0.0000 175.5741 26 E 3.8588 7.9185 121.1914 58.8659 29.6727 178.6630 27 A 3.9111 8.1267 121.0071 55.0850 18.4428 179.2935 28 L 3.9204 8.1382 118.9628 58.2828 42.2256 179.1362 29 G 3.7257 8.1480 105.7271 48.2675 0.0000 175.7833 30 R 3.9259 8.0817 120.3063 58.3698 30.0521 178.7212 31 L 3.9799 7.8407 120.4467 58.3706 41.6882 179.0012 32 L 4.2036 7.6529 118.8185 55.9352 41.3637 179.5504 33 V 3.5550 7.2277 118.1360 65.8764 31.7225 177.8726 34 V 3.5062 8.0638 117.0002 64.5185 32.8433 175.6967 35 Y 3.7879 7.1417 116.6861 53.9442 37.6890 174.0142 36 P 4.4585 0.0000 0.0000 64.6341 31.5265 178.3850 37 W 4.3857 8.1832 116.0471 59.2942 27.9374 177.6817 38 T 4.2487 7.6019 110.2133 63.7996 68.3074 176.3167 39 Q 4.3372 8.1115 121.8024 58.5239 28.4298 178.1464 40 R 3.7342 7.4780 116.5587 58.9558 29.0959 177.7979 41 F 4.4089 6.9746 115.2915 57.2607 39.5274 175.7351 42 F 4.5239 7.7788 118.3838 56.6889 39.8713 177.2111 43 E 4.0124 8.5143 122.7695 59.5529 29.3558 178.4416 44 S 4.5901 8.0438 110.0857 58.9168 63.5312 174.7995 45 F 4.4601 8.2820 120.5095 58.7064 39.7206 175.0185 46 G 3.8998 8.0809 105.9801 44.2941 0.0000 172.9505 47 D 4.5983 8.7063 124.0596 53.9418 41.6289 176.4254 48 L 4.8679 8.3871 124.8505 54.3025 43.2550 177.4747 49 S 4.2941 8.1923 116.6661 61.0469 63.1449 175.0433 50 T 4.7284 7.4162 109.2115 57.9203 73.1025 172.5714 51 P 4.1804 0.0000 0.0000 66.2964 31.2255 178.6420 52 D 4.3674 8.1265 116.4975 57.2773 40.4813 178.6588 53 A 4.0010 7.3581 120.3775 54.9102 18.7747 179.7028 54 V 3.6553 7.7373 116.6591 66.5086 31.5098 178.0407 55 M 3.9595 7.8930 117.1891 58.2128 31.9106 177.7825 56 G 3.9286 7.6266 104.6724 45.2955 0.0000 173.2259 57 N 4.5257 7.9026 119.7794 51.9673 39.7156 173.6405 58 P 4.2111 0.0000 0.0000 66.3400 31.1246 178.5247 59 K 3.7247 8.3393 117.8942 58.5369 31.6907 179.6628 60 V 3.6532 7.7547 118.2936 65.9845 31.7100 177.8087 61 K 3.8292 8.0318 117.9852 59.5283 32.0006 179.0294 62 A 3.9528 7.9660 120.6829 55.5809 18.3451 179.2479 63 H 4.3682 8.3578 116.9112 59.1158 29.9511 177.5965 64 G 3.6718 8.4758 108.2862 47.7030 0.0000 175.6666 65 K 4.0151 7.9571 121.6872 59.5194 32.4830 179.2379 66 K 3.9629 7.9166 119.2430 59.1702 31.9573 179.4797 67 V 3.6587 7.7718 118.3464 66.1651 31.4198 178.1239 68 L 4.3382 8.3082 118.8400 57.4960 41.3084 179.6811 69 G 3.7241 8.6184 106.0810 47.7685 0.0000 175.6529 70 A 4.1115 8.0063 122.3220 54.8783 18.6284 178.9928 71 F 4.3070 8.6997 119.3941 61.7779 39.4378 177.5493 72 S 4.0991 8.6737 114.8735 61.7981 62.5809 176.4662 73 D 4.5349 8.1739 121.4964 57.0275 40.4587 179.0399 74 G 3.4549 7.8093 106.3992 47.4773 0.0000 175.7981 75 L 3.8076 7.1612 119.5058 56.8894 41.6076 178.5224 76 A 4.2587 7.4371 118.7662 52.9513 19.2723 176.7802 77 H 4.8301 7.8957 115.4095 54.7642 29.9140 175.7418 78 L 3.9300 8.1097 120.7920 57.8642 41.7703 178.9503 79 D 4.4603 7.9302 117.1503 56.6297 41.8427 176.2591 80 N 5.0073 8.2602 117.3070 51.0151 39.3742 174.4809 81 L 4.0348 7.9218 122.8942 57.7476 42.0640 179.0539 82 K 3.9585 8.1588 117.0662 59.9269 32.0059 179.1217 83 G 3.6965 8.5392 105.3701 47.7397 0.0000 175.9582 84 T 3.7267 7.5475 117.2387 65.9394 68.5930 175.8202 85 F 4.7378 8.0069 117.2869 57.1621 39.1855 177.4446 86 A 4.0606 7.5764 122.2303 55.7429 18.1781 180.6166 87 T 3.8437 7.8200 113.5032 66.8873 68.6990 176.9215 88 L 4.1247 7.9940 120.4127 57.6145 41.6100 179.2805 89 S 4.2944 8.4991 113.6049 61.5360 62.2960 175.8696 90 E 3.8532 8.0280 121.4328 59.0910 29.3582 178.4123 91 L 3.9074 8.0384 120.2991 58.6962 42.1915 178.8136 92 H 4.1630 8.4464 115.8138 58.5036 28.3823 177.8171 93 A 3.2645 7.6347 121.8875 54.8877 18.3249 179.1208 94 D 4.4045 7.9655 116.1514 56.8065 41.1888 177.8932 95 K 4.0891 7.6794 118.1555 58.4384 32.7693 177.3915 96 L 4.1060 7.6743 116.4043 55.0229 42.5054 176.2882 97 H 4.1672 7.7816 114.4612 56.7142 25.9068 175.1426 98 V 3.7539 7.8259 117.6868 60.5826 32.8331 174.7892 99 D 4.3226 8.6869 127.0943 53.9697 41.5859 175.2556 100 P 3.1360 0.0000 0.0000 64.2705 31.9393 177.8279 101 E 3.8334 8.4352 119.5523 59.4879 29.2504 178.4857 102 N 4.3082 7.8537 116.2715 56.2099 38.4608 177.3536 103 F 4.5068 7.5148 119.3750 60.5288 38.9075 177.9718 104 R 3.9668 7.7936 117.3257 59.0903 30.0090 178.6837 105 L 3.8036 7.6279 118.2656 57.7057 41.5766 179.1422 106 L 4.0635 8.1589 120.2731 58.3264 42.0415 178.9535 107 G 3.8825 8.2086 105.4619 48.2703 0.0000 175.2588 108 N 4.4427 8.2349 118.8870 55.9645 38.5098 177.7398 109 V 3.6145 8.0202 119.7149 65.8797 31.6242 177.7942 110 L 3.8621 8.3137 120.5183 58.0659 41.8369 178.9917 111 V 3.6917 7.9782 118.3346 65.9110 31.3662 177.9791 112 G 3.6615 7.9771 105.3094 48.0945 0.0000 175.7191 113 V 3.5258 7.9275 121.5444 65.4310 31.3989 178.1135 114 L 3.8864 7.8539 118.5435 57.3979 41.3168 179.3252 115 A 3.6386 7.3754 120.8868 55.2596 18.1304 179.1552 116 H 4.0525 8.0130 115.5964 59.5517 29.9961 176.7403 117 H 3.9078 8.0092 118.9019 59.1800 29.6583 176.8315 118 F 4.5162 8.4598 118.8485 57.5691 39.4119 177.1512 119 G 3.9452 8.8216 108.2616 46.1687 0.0000 177.1487 120 K 4.0452 8.8130 121.9641 59.1454 32.6290 178.0244 121 E 4.0533 7.8519 118.8512 58.4037 30.1486 176.9977 122 F 4.5281 8.1846 123.8023 57.0744 37.8459 174.8043 123 T 4.1870 7.2528 115.7666 60.2417 71.3678 173.4000 124 P 4.1643 0.0000 0.0000 65.6764 31.3863 177.1909 125 P 4.2083 0.0000 0.0000 65.3034 31.1659 178.9396 126 V 3.5210 7.2387 116.8389 65.7974 31.4371 177.4768 127 Q 3.4792 7.7039 119.3059 59.3093 28.7863 178.3544 128 A 4.0001 8.0738 121.1897 55.4181 18.4604 179.5506 129 A 3.8904 7.8813 118.4728 55.5623 18.4141 179.5302 130 Y 3.7881 8.3913 115.5688 61.1044 37.9243 178.8279 131 Q 4.1290 8.8019 119.5785 58.9630 28.8351 178.9410 132 K 3.9877 7.9391 119.0932 59.2762 31.9679 179.5262 133 V 3.5004 7.6530 118.1719 66.2985 31.4666 178.6463 134 V 3.8422 8.3854 112.2480 64.3302 31.3446 178.5368 135 A 4.1650 8.2024 120.8759 54.7770 18.1424 180.0147 136 G 3.4347 8.1557 104.3994 47.9039 0.0000 175.8999 137 V 3.3099 7.9933 121.5398 65.6034 31.6017 177.6156 138 A 3.9335 8.2359 120.6566 55.5737 17.9267 179.1705 139 N 4.3200 8.0128 113.9836 56.5553 38.8260 176.7817 140 A 4.1637 8.0563 122.4740 54.9286 18.2744 179.5061 141 L 3.9263 7.6824 116.3846 56.9520 42.0285 178.4002 142 A 4.3874 7.8542 119.0123 52.7605 18.5638 178.5145 143 H 4.2564 7.9217 117.2119 58.8272 30.0494 175.9247 144 K 4.3600 8.0543 117.3292 56.4033 32.1035 176.2989 145 Y 3.8658 8.0391 118.6108 57.9924 38.2985 175.6178 146 H 4.5009 8.1301 119.0420 55.8123 28.8117 173.0456 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 3.96 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 0.89 0.00 0.00 0.87 0.00 0.00 2 H 8.57 4.57 0.00 3.15 3.21 0.00 5.67 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 L 7.78 4.85 0.00 1.51 1.40 0.78 0.86 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 4 T 8.23 4.11 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 1.22 0.00 0.00 5 P 0.00 4.16 0.00 2.15 2.14 0.00 3.60 0.00 0.00 3.73 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 6 E 8.26 3.93 0.00 2.02 2.00 0.00 0.00 0.00 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 2.48 0.00 7 E 8.39 3.96 0.00 2.17 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 2.28 2.30 0.00 8 K 8.42 3.89 0.00 1.71 1.79 0.00 1.72 0.00 0.00 1.59 0.00 0.00 2.86 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.37 1.68 7.81 9 S 8.31 4.12 0.00 3.84 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 10 A 7.75 3.96 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 11 V 7.68 3.48 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 0.00 0.00 0.45 0.00 0.00 12 T 8.08 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 1.23 0.00 0.00 13 A 7.84 4.05 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 14 L 8.02 3.92 0.00 1.84 1.91 -0.11 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 15 W 8.80 4.43 0.00 3.79 3.24 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 16 G 8.06 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 0.00 0.00 0.00 17 K 7.93 4.35 0.00 1.97 2.10 0.00 1.70 0.00 0.00 1.57 0.00 0.00 3.19 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.49 1.58 7.81 18 V 6.99 3.61 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 -0.02 0.00 0.00 0.68 0.00 0.00 19 N 8.33 4.50 0.00 2.74 2.59 0.00 0.00 7.20 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 20 V 8.20 3.55 2.13 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 0.79 0.00 0.00 0.99 0.00 0.00 21 D 7.94 4.27 0.00 2.65 2.69 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 22 E 7.72 3.84 0.00 2.19 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 2.14 2.21 0.00 23 V 7.77 3.61 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 0.94 0.00 0.00 0.67 0.00 0.00 24 G 8.54 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 25 G 8.03 3.55 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 0.00 26 E 7.92 3.86 0.00 2.11 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 2.25 2.27 0.00 27 A 8.13 3.91 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 28 L 8.14 3.92 0.00 1.74 1.63 0.93 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 29 G 8.15 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 30 R 8.08 3.93 0.00 1.89 1.90 0.00 3.07 0.00 0.00 3.00 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.70 0.00 31 L 7.84 3.98 0.00 1.81 1.87 1.03 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 32 L 7.65 4.20 0.00 1.81 1.65 0.90 0.88 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 33 V 7.23 3.55 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 0.71 0.00 0.00 0.92 0.00 0.00 34 V 8.06 3.51 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 0.02 0.00 0.00 0.71 0.00 0.00 35 Y 7.14 3.79 0.00 2.58 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 36 P 0.00 4.46 0.00 2.32 2.32 0.00 3.73 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 1.91 0.00 37 W 8.18 4.39 0.00 3.54 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 38 T 7.60 4.25 4.42 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 1.08 0.00 0.00 39 Q 8.11 4.34 0.00 2.24 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.74 0.00 0.00 0.00 0.00 0.00 2.42 2.46 0.00 40 R 7.48 3.73 0.00 1.65 1.94 0.00 3.02 0.00 0.00 2.75 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.50 0.00 41 F 6.97 4.41 0.00 1.88 2.49 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 42 F 7.78 4.52 0.00 2.82 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 0.00 0.00 0.00 43 E 8.51 4.01 0.00 1.95 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 2.26 2.23 0.00 44 S 8.04 4.59 0.00 4.10 4.08 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 0.00 0.00 0.00 0.00 45 F 8.28 4.46 0.00 3.25 3.26 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 46 G 8.08 3.90 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 0.00 0.00 0.00 47 D 8.71 4.60 0.00 2.65 2.61 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 48 L 8.39 4.87 0.00 1.66 1.62 1.05 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 49 S 8.19 4.29 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 50 T 7.42 4.73 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 1.21 0.00 0.00 51 P 0.00 4.18 0.00 2.14 2.12 0.00 3.58 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 2.09 2.17 0.00 52 D 8.13 4.37 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 53 A 7.36 4.00 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 54 V 7.74 3.66 2.17 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 1.01 0.00 0.00 0.92 0.00 0.00 55 M 7.89 3.96 0.00 2.03 2.10 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 2.60 2.86 0.00 56 G 7.63 3.93 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 N 7.90 4.53 0.00 3.08 2.92 0.00 0.00 6.95 7.15 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 58 P 0.00 4.21 0.00 2.23 2.27 0.00 3.72 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.04 0.00 59 K 8.34 3.72 0.00 1.37 0.74 0.00 1.62 0.00 0.00 1.22 0.00 0.00 2.88 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.19 1.25 7.81 60 V 7.75 3.65 2.23 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 1.13 0.00 0.00 1.04 0.00 0.00 61 K 8.03 3.83 0.00 1.81 1.83 0.00 1.69 0.00 0.00 1.62 0.00 0.00 3.05 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.43 1.64 7.81 62 A 7.97 3.95 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 63 H 8.36 4.37 0.00 3.63 3.55 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 64 G 8.48 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 65 K 7.96 4.02 0.00 2.05 2.09 0.00 1.40 0.00 0.00 1.65 0.00 0.00 2.97 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.49 1.56 7.81 66 K 7.92 3.96 0.00 2.07 1.95 0.00 1.80 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.51 1.66 7.81 67 V 7.77 3.66 2.29 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 1.17 0.00 0.00 0.94 0.00 0.00 68 L 8.31 4.34 0.00 2.04 1.88 0.91 0.89 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 69 G 8.62 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 70 A 8.01 4.11 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 0.00 0.00 71 F 8.70 4.31 0.00 3.19 3.36 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 72 S 8.67 4.10 0.00 4.29 4.40 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 73 D 8.17 4.53 0.00 2.56 2.67 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 74 G 7.81 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 75 L 7.16 3.81 0.00 1.53 1.46 -0.49 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 76 A 7.44 4.26 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 77 H 7.90 4.83 0.00 3.09 3.15 0.00 5.83 0.00 0.00 0.00 0.00 6.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 L 8.11 3.93 0.00 1.53 1.66 0.80 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 79 D 7.93 4.46 0.00 2.63 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 80 N 8.26 5.01 0.00 2.71 2.60 0.00 0.00 7.04 6.20 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 81 L 7.92 4.03 0.00 1.75 1.84 0.93 1.13 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 82 K 8.16 3.96 0.00 1.67 1.83 0.00 1.65 0.00 0.00 1.42 0.00 0.00 2.99 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.19 1.44 7.81 83 G 8.54 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 84 T 7.55 3.73 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 0.56 0.00 0.00 85 F 8.01 4.74 0.00 3.22 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 86 A 7.58 4.06 1.41 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 87 T 7.82 3.84 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 88 L 7.99 4.12 0.00 2.01 1.86 1.13 0.90 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 89 S 8.50 4.29 0.00 4.04 4.05 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 90 E 8.03 3.85 0.00 2.09 2.10 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 2.30 2.47 0.00 91 L 8.04 3.91 0.00 1.82 1.90 0.91 0.88 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 92 H 8.45 4.16 0.00 3.53 3.79 0.00 5.86 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 93 A 7.63 3.26 0.34 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 94 D 7.97 4.40 0.00 2.75 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 K 7.68 4.09 0.00 1.66 1.92 0.00 1.75 0.00 0.00 1.69 0.00 0.00 2.98 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.33 1.42 7.81 96 L 7.67 4.11 0.00 1.59 1.60 0.74 1.07 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 97 H 7.78 4.17 0.00 3.37 3.40 0.00 5.70 0.00 0.00 0.00 0.00 8.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 7.83 3.75 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 -0.03 0.00 0.00 0.39 0.00 0.00 99 D 8.69 4.32 0.00 2.78 2.55 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 0.00 100 P 0.00 3.14 0.00 1.89 1.69 0.00 3.35 0.00 0.00 3.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.44 0.00 101 E 8.44 3.83 0.00 1.99 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 2.39 0.00 102 N 7.85 4.31 0.00 2.45 2.73 0.00 0.00 6.99 8.29 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 0.00 103 F 7.51 4.51 0.00 3.12 2.89 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 0.00 104 R 7.79 3.97 0.00 2.05 1.97 0.00 3.29 0.00 0.00 3.26 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.80 0.00 105 L 7.63 3.80 0.00 1.72 1.42 0.66 -0.15 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 0.00 106 L 8.16 4.06 0.00 1.82 1.89 0.94 1.08 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 0.00 107 G 8.21 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 0.00 0.00 0.00 108 N 8.23 4.44 0.00 2.84 2.97 0.00 0.00 6.70 7.83 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 0.00 109 V 8.02 3.61 2.29 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 1.13 0.00 0.00 1.14 0.00 0.00 110 L 8.31 3.86 0.00 1.75 1.78 0.89 0.28 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 0.00 111 V 7.98 3.69 2.33 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 1.35 0.00 0.00 1.17 0.00 0.00 112 G 7.98 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 0.00 113 V 7.93 3.53 2.14 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 1.01 0.00 0.00 0.94 0.00 0.00 114 L 7.85 3.89 0.00 1.16 1.09 0.59 0.83 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 0.00 115 A 7.38 3.64 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 0.00 116 H 8.01 4.05 0.00 3.16 3.42 0.00 5.78 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 0.00 117 H 8.01 3.91 0.00 2.89 2.81 0.00 5.99 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 0.00 118 F 8.46 4.52 0.00 3.27 3.12 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 0.00 0.00 0.00 119 G 8.82 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 0.00 120 K 8.81 4.05 0.00 1.92 2.01 0.00 1.60 0.00 0.00 1.65 0.00 0.00 2.99 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.44 1.47 7.81 121 E 7.85 4.05 0.00 2.08 2.35 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 2.35 2.28 0.00 122 F 8.18 4.53 0.00 3.08 3.19 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 0.00 123 T 7.25 4.19 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 1.28 0.00 0.00 124 P 0.00 4.16 0.00 2.16 2.16 0.00 3.57 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 2.12 2.21 0.00 125 P 0.00 4.21 0.00 2.11 2.06 0.00 3.48 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 2.08 2.11 0.00 126 V 7.24 3.52 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 1.00 0.00 0.00 0.89 0.00 0.00 127 Q 7.70 3.48 0.00 1.77 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.50 0.00 0.00 0.00 0.00 0.00 2.45 2.64 0.00 128 A 8.07 4.00 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 0.00 129 A 7.88 3.89 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 0.00 130 Y 8.39 3.79 0.00 3.27 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 0.00 131 Q 8.80 4.13 0.00 2.25 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.80 0.00 0.00 0.00 0.00 0.00 2.75 2.62 0.00 132 K 7.94 3.99 0.00 1.89 1.84 0.00 1.64 0.00 0.00 1.56 0.00 0.00 2.97 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.63 7.81 133 V 7.65 3.50 2.13 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 0.98 0.00 0.00 0.73 0.00 0.00 134 V 8.39 3.84 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 0.93 0.00 0.00 1.13 0.00 0.00 135 A 8.20 4.17 1.41 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 0.00 136 G 8.16 3.43 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 0.00 137 V 7.99 3.31 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 0.49 0.00 0.00 0.64 0.00 0.00 138 A 8.24 3.93 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 0.00 139 N 8.01 4.32 0.00 2.92 2.85 0.00 0.00 7.24 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 0.00 140 A 8.06 4.16 1.46 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 0.00 141 L 7.68 3.93 0.00 1.22 0.71 -0.03 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 142 A 7.85 4.39 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 0.00 143 H 7.92 4.26 0.00 3.32 3.51 0.00 5.94 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 K 8.05 4.36 0.00 1.77 1.79 0.00 1.81 0.00 0.00 1.74 0.00 0.00 3.06 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.52 1.59 7.81 145 Y 8.04 3.87 0.00 3.04 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 0.00 146 H 8.13 4.50 0.00 3.22 3.21 0.00 5.58 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00