NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3709 8.3044 120.3216 55.8520 33.8702 175.1085 2 H 4.6715 8.4245 119.6164 54.6139 29.0331 172.4960 3 L 4.7582 7.9725 121.1074 53.5207 45.0501 177.3257 4 T 4.1852 8.1643 118.9728 62.3108 70.5615 174.3272 5 P 4.0552 0.0000 0.0000 66.2125 31.3852 178.8190 6 E 3.9909 8.0699 116.5091 59.4323 29.4728 179.1384 7 E 3.9684 7.8832 118.1753 59.0393 29.7379 179.2323 8 K 3.8348 8.7990 119.7577 59.5812 32.1864 179.2599 9 S 4.0793 8.4460 113.5056 61.3368 61.7935 176.1121 10 A 4.0222 7.8520 123.0788 55.1204 18.1044 179.4821 11 V 3.3745 7.5679 116.2799 66.2989 31.4126 177.9819 12 T 3.9526 7.8903 114.7706 67.0908 68.2812 176.4236 13 A 4.1218 8.0186 120.4582 54.5505 18.6506 178.9217 14 L 4.0344 7.8101 117.9890 57.4677 42.3068 178.4447 15 W 4.3728 8.7436 128.6868 60.6336 30.3768 177.8397 16 G 4.0128 7.8677 104.5650 47.7694 0.0000 174.6746 17 K 4.3805 7.8134 117.3200 55.4415 32.7825 176.8169 18 V 3.8312 7.4018 120.4932 61.9311 32.2912 176.1581 19 N 4.5416 8.1419 125.1427 52.1172 38.3960 175.4016 20 V 3.4765 7.9893 127.4899 65.5894 31.1300 177.2103 21 D 4.3038 8.0418 118.2800 57.3744 40.7954 178.4022 22 E 3.9312 8.7956 119.3732 59.5036 29.5046 179.6503 23 V 3.5907 8.0451 118.7492 65.6819 31.6113 178.3490 24 G 3.6474 8.3920 106.0144 47.6968 0.0000 176.0540 25 G 3.5736 7.7395 107.5652 47.3811 0.0000 175.5418 26 E 3.9196 8.1892 121.6794 58.7478 29.6528 178.7439 27 A 3.8967 8.0979 120.9388 55.1508 18.6418 179.4107 28 L 3.9484 7.8552 118.5172 58.1621 41.7221 179.2567 29 G 3.5476 8.1425 105.7083 47.7990 0.0000 175.8892 30 R 3.8997 8.2510 121.0431 58.7096 30.0614 178.6135 31 L 3.8194 7.7829 120.1067 58.4596 41.9576 179.2654 32 L 4.0053 7.7852 117.7272 56.9663 41.1837 179.2571 33 V 3.8288 6.8991 116.4285 64.7714 32.1403 177.8336 34 V 3.7294 7.9718 116.9859 64.7743 33.0068 176.5315 35 A 3.6613 7.2883 123.4295 48.3343 18.1412 174.5261 36 P 4.5211 0.0000 0.0000 64.3676 30.9728 178.2719 37 W 4.4309 7.8061 115.1837 58.5388 28.1527 177.4665 38 T 4.2880 7.5632 110.6219 63.4964 68.4444 175.9200 39 Q 4.3580 8.0949 121.5659 57.8680 28.5246 177.9756 40 R 3.8147 7.3432 116.6662 58.5100 29.3158 177.8346 41 F 4.2945 7.1495 116.2741 57.0970 40.6346 175.5435 42 F 4.5452 7.4806 117.5477 56.5059 38.9334 176.6145 43 E 4.1829 7.9350 122.2480 59.1036 30.1112 179.5060 44 S 4.5345 8.0573 110.9922 59.7340 63.4451 174.9521 45 F 4.5075 7.9785 119.1995 58.9547 39.7767 175.0768 46 G 3.9261 6.9600 105.6371 44.4435 0.0000 173.1597 47 D 4.7728 8.6916 124.4718 53.2163 40.5616 176.6010 48 L 4.8987 8.2234 127.2978 54.6765 42.8392 178.8214 49 S 4.3721 8.1047 117.0762 61.0180 63.1587 175.1905 50 T 4.7303 7.3771 108.9700 58.2155 72.8867 172.6171 51 P 4.1942 0.0000 0.0000 66.1963 31.3142 178.1957 52 D 4.4556 8.2281 116.4339 57.7850 40.4997 179.1226 53 A 3.9861 8.5170 120.9392 54.6684 18.0357 179.8898 54 V 3.6444 7.6961 116.5382 66.3876 31.9200 177.9927 55 M 4.2591 8.7190 117.7543 58.0577 31.7679 178.4697 56 G 3.9254 8.1023 105.1744 45.5675 0.0000 173.4607 57 N 4.3344 7.6074 120.3622 52.9894 39.2689 173.5945 58 P 4.2751 0.0000 0.0000 65.9342 31.3596 178.5470 59 K 3.6906 8.0128 117.8225 58.9428 31.8013 179.3071 60 V 3.7076 8.1135 118.4948 66.1059 31.6536 178.2394 61 K 3.8972 8.0174 118.0250 59.5053 31.4820 179.2014 62 A 4.0758 8.1786 120.9359 54.9994 18.2524 179.1984 63 H 4.3923 8.2308 117.2420 59.1964 29.9437 177.5792 64 G 4.0221 8.2900 109.2294 47.2408 0.0000 175.5891 65 K 4.0157 7.9890 121.5049 58.8908 32.2948 178.9631 66 K 4.0167 7.7452 119.8017 59.2159 32.1335 179.0981 67 V 3.6090 7.9537 118.6208 66.2012 31.5554 178.1927 68 L 4.3573 8.2753 118.5915 57.2725 41.3677 179.7945 69 G 3.7164 8.0923 105.7034 47.8722 0.0000 175.4741 70 A 4.1454 7.8074 122.5848 54.5931 18.6847 179.2426 71 F 4.2802 8.5204 118.9630 61.5516 39.4252 176.9451 72 S 4.2655 9.0703 113.2821 62.0821 62.2696 176.1712 73 D 4.5311 8.4874 121.1162 57.0579 40.4661 178.9690 74 G 3.5231 8.1086 106.4372 47.2934 0.0000 175.1296 75 L 3.9681 7.1932 118.7870 55.7782 41.6556 177.8076 76 A 4.5682 7.5872 119.5775 51.9174 20.2748 176.1689 77 H 4.8308 8.1602 115.4311 54.8144 29.8773 175.0512 78 L 3.9079 8.1095 121.3809 57.2372 42.2014 176.5844 79 D 4.7887 7.4943 116.0167 54.1518 41.7942 176.2876 80 N 4.6507 7.7926 113.9955 52.2067 41.3190 175.0051 81 L 4.0734 7.5170 122.5301 57.0969 42.1857 178.7646 82 K 4.0096 8.0920 119.5616 59.7283 32.0001 179.0100 83 G 3.6898 8.2717 104.4688 47.9582 0.0000 175.4638 84 T 3.8203 7.4230 116.9192 65.4581 68.5944 175.9417 85 F 4.8311 8.0539 117.7326 57.0985 39.2983 177.3345 86 A 4.0567 7.5544 121.6132 56.0474 18.2035 180.8074 87 T 3.8783 7.8459 113.3534 66.6283 68.7167 176.7014 88 L 4.1054 7.9720 121.9133 57.8748 42.0596 178.8698 89 S 4.4275 8.5072 115.0889 60.9603 62.4402 175.8353 90 E 3.8754 8.2458 121.2701 59.3718 29.1700 179.0788 91 L 3.9260 7.8588 120.1111 58.7038 42.0918 178.8821 92 H 4.2225 8.1998 115.7005 59.0624 28.7260 176.8383 93 C 3.5997 7.5763 120.8360 62.0621 31.1346 175.3071 94 D 4.4349 8.5705 121.9136 56.1599 40.5969 177.3498 95 K 4.3300 7.7996 116.9045 57.6416 33.8005 177.3970 96 L 4.2194 7.7444 115.7310 54.8062 42.5195 176.0748 97 H 4.1885 7.1957 113.3316 56.6503 26.5245 175.1141 98 V 3.8404 7.9202 118.3098 61.2241 32.7611 174.7547 99 D 4.4121 8.5981 127.1673 53.3997 41.8759 175.0289 100 P 3.3091 0.0000 0.0000 64.6761 31.8047 177.9769 101 E 3.9171 8.2325 119.1534 59.1433 29.2858 178.2349 102 N 4.3316 7.8589 116.5578 56.4468 38.5715 177.2638 103 F 4.4963 7.4866 118.9097 60.5376 39.0485 177.8867 104 R 4.0981 7.8572 117.3591 58.8052 30.1101 178.7040 105 L 3.9992 7.8938 118.8873 57.7029 41.5401 179.2192 106 L 4.0210 8.2548 120.5156 58.1386 41.9791 178.9214 107 G 3.9170 7.9166 105.1264 48.3088 0.0000 175.3085 108 N 4.4046 8.1276 118.6080 55.7651 38.5432 177.7504 109 V 3.5129 7.7863 119.7234 65.7956 31.5523 177.4558 110 L 3.7991 8.6946 121.3315 58.5146 41.8136 179.1542 111 V 3.5350 7.9684 117.8231 66.3422 31.4341 177.7897 112 C 4.1508 8.0475 116.4648 62.5300 27.9305 176.2459 113 V 3.5598 8.1880 120.2890 65.9601 31.0834 177.9545 114 L 3.8430 7.8725 118.7276 57.7557 41.4957 179.4366 115 A 3.7230 7.2167 120.4485 55.1677 18.0626 178.9287 116 H 4.1075 7.9294 115.6570 59.8994 29.9596 176.9575 117 H 3.9444 8.0653 116.1781 58.5137 28.8996 177.1455 118 F 4.5681 8.6077 117.6461 55.3401 39.4866 178.4987 119 G 3.9408 8.8001 108.9311 45.6203 0.0000 175.2482 120 K 3.8688 9.3481 121.9191 59.7761 31.9720 177.2485 121 E 4.0645 8.4232 119.3918 58.4664 29.8284 177.1269 122 F 4.5158 8.1213 122.7746 57.0271 37.8805 175.4482 123 T 4.2280 7.3805 115.5082 59.9068 71.4560 173.5584 124 P 4.1417 0.0000 0.0000 65.7699 31.2417 177.2422 125 P 4.2139 0.0000 0.0000 65.2426 31.3266 178.8883 126 V 3.5938 7.2673 117.4055 65.6770 31.4636 177.8192 127 Q 3.6086 8.2335 119.5912 58.8638 28.7204 178.0209 128 A 3.9685 8.0858 121.6211 55.3707 18.5691 179.5573 129 A 3.9259 7.7483 119.2265 55.4892 18.3352 179.5175 130 Y 3.8855 8.0134 115.1287 61.1286 37.9042 178.5585 131 Q 4.1514 8.7887 119.6972 58.9039 28.8227 178.8495 132 K 4.0629 7.9673 119.3956 59.0903 31.9925 179.7608 133 V 3.5098 7.5704 118.3335 66.0490 31.5009 178.5156 134 V 3.7812 8.3157 112.4082 64.3388 31.3344 178.4694 135 A 4.0789 8.1838 120.6391 55.0785 18.2818 179.7053 136 G 3.6238 8.0654 104.2741 48.0357 0.0000 175.8524 137 V 3.3820 8.3880 121.0044 65.5355 31.4121 177.7982 138 A 3.9447 7.8819 120.3765 55.3331 17.9794 179.3953 139 N 4.2809 8.1459 113.5493 56.3059 38.9345 177.1694 140 A 4.1903 8.0428 122.1018 55.3865 18.2528 179.8063 141 L 3.8980 8.1329 117.2404 57.1269 41.5271 178.8113 142 A 4.4752 7.7496 119.4331 52.8588 18.9863 178.3526 143 H 4.0987 7.7996 116.8609 59.3326 29.8622 176.0578 144 K 4.3467 8.1136 115.0732 56.5510 32.1103 176.7161 145 Y 4.1685 8.0618 118.1954 58.4207 38.4051 175.7401 146 H 4.4571 8.3419 117.8234 56.1699 28.2735 173.2755 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 M 8.30 4.37 0.00 1.97 2.12 0.00 0.00 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.51 0.00 2 H 8.42 4.67 0.00 3.13 3.21 0.00 5.71 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 3 L 7.97 4.76 0.00 1.57 1.46 0.80 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 4 T 8.16 4.19 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 5 P 0.00 4.06 0.00 2.12 2.10 0.00 3.56 0.00 0.00 3.72 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 6 E 8.07 3.99 0.00 2.02 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 2.38 2.44 0.00 7 E 7.88 3.97 0.00 2.19 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 2.35 2.34 0.00 8 K 8.80 3.83 0.00 1.82 1.79 0.00 1.62 0.00 0.00 1.50 0.00 0.00 2.98 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.38 1.43 7.81 9 S 8.45 4.08 0.00 3.84 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 10 A 7.85 4.02 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 7.57 3.37 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.51 0.00 0.00 0.58 0.00 0.00 12 T 7.89 3.95 4.50 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 1.28 0.00 0.00 13 A 8.02 4.12 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 7.81 4.03 0.00 1.87 2.04 0.36 -0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 15 W 8.74 4.37 0.00 3.78 3.37 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 16 G 7.87 4.01 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 0.00 0.00 0.00 17 K 7.81 4.38 0.00 2.10 2.16 0.00 2.00 0.00 0.00 1.77 0.00 0.00 3.23 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.53 1.50 7.81 18 V 7.40 3.83 1.04 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 0.00 0.00 0.66 0.00 0.00 19 N 8.14 4.54 0.00 2.70 2.60 0.00 0.00 6.82 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 7.99 3.48 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 1.19 0.00 0.00 0.89 0.00 0.00 21 D 8.04 4.30 0.00 2.99 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 22 E 8.80 3.93 0.00 2.03 1.95 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 2.29 2.44 0.00 23 V 8.05 3.59 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 0.96 0.00 0.00 0.68 0.00 0.00 24 G 8.39 3.65 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 0.00 0.00 0.00 25 G 7.74 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 26 E 8.19 3.92 0.00 2.26 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.32 0.00 27 A 8.10 3.90 1.32 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 0.00 0.00 28 L 7.86 3.95 0.00 1.71 1.61 0.87 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 29 G 8.14 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 30 R 8.25 3.90 0.00 1.91 1.94 0.00 3.21 0.00 0.00 3.04 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.60 0.00 31 L 7.78 3.82 0.00 1.83 1.84 0.86 0.76 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 32 L 7.79 4.01 0.00 1.86 1.68 0.82 0.65 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 33 V 6.90 3.83 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 0.78 0.00 0.00 0.94 0.00 0.00 34 V 7.97 3.73 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 0.83 0.00 0.00 0.94 0.00 0.00 35 A 7.29 3.66 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 P 0.00 4.52 0.00 2.35 2.36 0.00 3.77 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 2.23 1.95 0.00 37 W 7.81 4.43 0.00 3.57 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 7.56 4.29 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 1.04 0.00 0.00 39 Q 8.09 4.36 0.00 2.24 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.82 0.00 0.00 0.00 0.00 0.00 2.42 2.46 0.00 40 R 7.34 3.81 0.00 1.60 1.81 0.00 2.96 0.00 0.00 2.47 7.64 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 7.15 4.29 0.00 1.51 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 42 F 7.48 4.55 0.00 2.88 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 0.00 0.00 0.00 43 E 7.94 4.18 0.00 2.01 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.20 0.00 44 S 8.06 4.53 0.00 4.12 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 45 F 7.98 4.51 0.00 3.26 3.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 G 6.96 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 47 D 8.69 4.77 0.00 2.67 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 8.22 4.90 0.00 1.73 1.61 1.05 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 49 S 8.10 4.37 0.00 3.90 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 T 7.38 4.73 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 1.22 0.00 0.00 51 P 0.00 4.19 0.00 2.16 2.15 0.00 3.62 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 2.11 2.20 0.00 52 D 8.23 4.46 0.00 2.68 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 53 A 8.52 3.99 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.70 3.64 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 0.95 0.00 0.00 55 M 8.72 4.26 0.00 1.97 2.14 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.83 0.00 56 G 8.10 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 7.61 4.33 0.00 2.93 2.93 0.00 0.00 6.86 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 58 P 0.00 4.28 0.00 2.25 2.26 0.00 3.74 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.03 0.00 59 K 8.01 3.69 0.00 1.85 0.79 0.00 1.30 0.00 0.00 1.17 0.00 0.00 2.79 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.20 1.30 7.81 60 V 8.11 3.71 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 1.09 0.00 0.00 1.10 0.00 0.00 61 K 8.02 3.90 0.00 2.02 1.82 0.00 1.74 0.00 0.00 1.64 0.00 0.00 3.12 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.44 1.49 7.81 62 A 8.18 4.08 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 8.23 4.39 0.00 3.58 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 8.29 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 0.00 0.00 0.00 65 K 7.99 4.02 0.00 2.00 1.82 0.00 1.64 0.00 0.00 1.59 0.00 0.00 2.93 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.46 1.44 7.81 66 K 7.75 4.02 0.00 2.06 1.96 0.00 1.75 0.00 0.00 1.63 0.00 0.00 3.03 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.51 1.50 7.81 67 V 7.95 3.61 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 0.99 0.00 0.00 0.89 0.00 0.00 68 L 8.28 4.36 0.00 1.92 1.88 1.17 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 69 G 8.09 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 7.81 4.15 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 71 F 8.52 4.28 0.00 3.22 3.30 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 72 S 9.07 4.27 0.00 4.60 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 73 D 8.49 4.53 0.00 2.72 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 8.11 3.52 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 0.00 0.00 0.00 75 L 7.19 3.97 0.00 1.53 1.43 -0.37 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 76 A 7.59 4.57 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 77 H 8.16 4.83 0.00 3.03 3.15 0.00 5.82 0.00 0.00 0.00 0.00 7.99 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 3.91 0.00 1.47 1.60 0.73 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 79 D 7.49 4.79 0.00 2.64 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 80 N 7.79 4.65 0.00 2.69 2.60 0.00 0.00 7.22 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 81 L 7.52 4.07 0.00 1.78 1.88 0.89 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 82 K 8.09 4.01 0.00 1.82 1.75 0.00 1.51 0.00 0.00 1.74 0.00 0.00 2.94 0.00 0.00 2.63 0.00 0.00 0.00 0.00 1.16 1.38 7.81 83 G 8.27 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 T 7.42 3.82 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.46 0.00 0.00 85 F 8.05 4.83 0.00 3.10 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 86 A 7.55 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 7.85 3.88 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 1.22 0.00 0.00 88 L 7.97 4.11 0.00 1.89 2.02 1.04 0.98 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 89 S 8.51 4.43 0.00 4.07 4.07 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 90 E 8.25 3.88 0.00 2.19 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 2.33 2.54 0.00 91 L 7.86 3.93 0.00 1.85 1.93 0.90 1.10 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 92 H 8.20 4.22 0.00 3.63 3.79 0.00 5.86 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 C 7.58 3.60 0.00 1.70 2.57 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 94 D 8.57 4.43 0.00 2.72 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 95 K 7.80 4.33 0.00 1.82 1.78 0.00 1.56 0.00 0.00 1.69 0.00 0.00 3.03 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.36 1.39 7.81 96 L 7.74 4.22 0.00 1.73 1.67 0.73 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 97 H 7.20 4.19 0.00 3.49 3.44 0.00 5.64 0.00 0.00 0.00 0.00 8.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 7.92 3.84 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 0.16 0.00 0.00 0.67 0.00 0.00 99 D 8.60 4.41 0.00 2.81 2.74 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 0.00 100 P 0.00 3.31 0.00 1.92 1.78 0.00 3.35 0.00 0.00 3.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.44 0.00 101 E 8.23 3.92 0.00 2.06 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.46 0.00 102 N 7.86 4.33 0.00 2.57 2.68 0.00 0.00 6.94 8.06 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 0.00 103 F 7.49 4.50 0.00 3.11 2.93 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 0.00 104 R 7.86 4.10 0.00 2.09 2.01 0.00 3.27 0.00 0.00 3.35 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.77 0.00 105 L 7.89 4.00 0.00 1.86 1.70 1.01 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 106 L 8.25 4.02 0.00 1.78 1.72 0.89 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 107 G 7.92 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 0.00 108 N 8.13 4.40 0.00 2.95 2.91 0.00 0.00 6.70 7.11 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 0.00 109 V 7.79 3.51 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 0.94 0.00 0.00 0.93 0.00 0.00 110 L 8.69 3.80 0.00 1.65 1.84 0.85 0.15 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 0.00 111 V 7.97 3.54 2.30 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 1.25 0.00 0.00 1.16 0.00 0.00 112 C 8.05 4.15 0.00 3.13 2.93 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 0.00 113 V 8.19 3.56 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 0.95 0.00 0.00 0.96 0.00 0.00 114 L 7.87 3.84 0.00 0.81 1.04 0.69 1.20 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 7.22 3.72 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 0.00 116 H 7.93 4.11 0.00 3.21 3.59 0.00 5.95 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 0.00 117 H 8.07 3.94 0.00 3.05 2.72 0.00 5.69 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 8.61 4.57 0.00 3.18 3.16 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 0.00 119 G 8.80 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 K 9.35 3.87 0.00 1.92 2.05 0.00 1.63 0.00 0.00 1.67 0.00 0.00 3.00 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.49 1.54 7.81 121 E 8.42 4.06 0.00 2.37 2.26 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 2.37 2.34 0.00 122 F 8.12 4.52 0.00 3.08 3.16 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 0.00 123 T 7.38 4.23 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 1.31 0.00 0.00 124 P 0.00 4.14 0.00 2.15 2.15 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 2.11 2.20 0.00 125 P 0.00 4.21 0.00 2.11 2.06 0.00 3.45 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 2.08 2.11 0.00 126 V 7.27 3.59 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 0.97 0.00 0.00 0.89 0.00 0.00 127 Q 8.23 3.61 0.00 1.60 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.55 0.00 0.00 0.00 0.00 0.00 2.39 2.52 0.00 128 A 8.09 3.97 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 0.00 129 A 7.75 3.93 1.21 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 0.00 130 Y 8.01 3.89 0.00 3.46 3.27 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 0.00 131 Q 8.79 4.15 0.00 2.23 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.81 0.00 0.00 0.00 0.00 0.00 2.77 2.61 0.00 132 K 7.97 4.06 0.00 1.90 1.83 0.00 1.63 0.00 0.00 1.57 0.00 0.00 2.89 0.00 0.00 3.30 0.00 0.00 0.00 0.00 1.46 1.62 7.81 133 V 7.57 3.51 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 0.76 0.00 0.00 134 V 8.32 3.78 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 0.99 0.00 0.00 1.12 0.00 0.00 135 A 8.18 4.08 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 8.07 3.62 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 0.00 0.00 0.00 137 V 8.39 3.38 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 0.73 0.00 0.00 0.70 0.00 0.00 138 A 7.88 3.94 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 8.15 4.28 0.00 2.82 2.91 0.00 0.00 7.04 6.86 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 0.00 140 A 8.04 4.19 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.13 3.90 0.00 1.41 0.89 -0.14 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 142 A 7.75 4.48 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 0.00 143 H 7.80 4.10 0.00 3.29 3.71 0.00 5.75 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 0.00 144 K 8.11 4.35 0.00 1.84 1.83 0.00 1.66 0.00 0.00 1.72 0.00 0.00 3.14 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.49 1.78 7.81 145 Y 8.06 4.17 0.00 3.12 2.93 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 0.00 146 H 8.34 4.46 0.00 3.22 3.23 0.00 5.75 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