NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 V 3.9654 8.0549 120.2883 61.8087 32.7475 176.5672 2 H 4.4101 8.4248 124.2835 54.4530 26.8322 173.1990 3 L 4.5168 8.1940 122.1057 53.9628 44.2880 177.7417 4 T 4.1586 8.9069 118.9939 62.6713 70.4477 174.2426 5 P 4.2427 0.0000 0.0000 66.0920 31.4052 178.8870 6 E 4.0784 8.1044 116.4663 58.8097 29.4869 178.9933 7 E 3.9157 8.0569 118.6269 59.2599 29.6317 179.0699 8 K 3.8282 8.0133 118.4449 59.5518 32.0349 179.3593 9 S 4.0944 8.0662 114.9890 61.7113 62.8365 176.6044 10 A 4.0050 8.5025 123.5461 55.1638 18.0382 179.9040 11 V 3.4646 7.7338 116.5405 66.4005 31.6070 178.4172 12 T 3.9595 7.9711 115.1544 66.5773 68.1099 176.1849 13 A 4.0427 8.0732 121.6160 55.4838 18.7154 179.1467 14 L 3.8591 8.1321 118.4523 58.0372 42.0844 179.0066 15 W 4.4885 8.7928 128.5763 60.1500 30.4590 177.9490 16 G 3.8558 8.3268 105.0717 46.7822 0.0000 173.9512 17 K 4.4534 7.8970 118.1541 56.0392 32.8332 176.1284 18 V 3.7377 7.5079 120.4821 61.3972 32.1944 174.6076 19 N 4.6630 8.2137 125.4532 52.5349 40.2970 175.3481 20 V 3.6121 8.9772 124.4553 65.2561 32.0875 178.1441 21 D 4.4035 8.0843 118.4357 57.2519 40.6597 178.1644 22 E 3.8658 8.0246 117.6138 59.5498 29.6003 179.3241 23 V 3.4512 8.5852 121.2056 64.9022 31.6782 178.0420 24 G 3.8498 9.5278 105.6751 48.0079 0.0000 175.6542 25 G 3.6436 8.0729 108.6620 47.1927 0.0000 175.9063 26 K 3.9349 8.3180 120.8855 59.0638 32.0625 179.3799 27 A 3.9177 8.3891 121.4252 55.0819 18.4810 179.4597 28 L 3.9992 8.1600 119.1777 58.1579 42.3012 179.2971 29 G 3.6070 7.9853 105.6565 48.0729 0.0000 175.9218 30 R 3.9074 8.0842 120.7377 58.4033 29.9601 178.6924 31 L 4.0064 8.0220 120.4401 58.5265 42.0552 179.2943 32 L 4.0792 7.7074 119.3000 56.7911 41.2383 179.7133 33 V 3.5104 7.2294 117.4077 65.8196 31.6464 177.9563 34 V 3.5257 7.6829 116.9436 64.1178 32.8975 175.6038 35 Y 3.6604 7.2519 115.8643 54.3707 37.8986 174.2153 36 P 5.1091 0.0000 0.0000 64.0370 31.9431 178.2133 37 W 4.4056 7.5430 116.7168 59.0059 28.1918 177.4049 38 T 4.4337 7.7522 110.4233 63.6440 68.2372 175.8793 39 Q 4.7916 8.4217 121.7138 58.0953 28.6746 177.6857 40 R 3.3558 7.6594 117.0688 59.0909 29.0213 177.0958 41 F 4.0625 6.7523 114.9301 57.4200 39.0350 175.7577 42 F 4.5884 8.4063 118.7919 56.7366 40.3329 176.3917 43 E 3.9506 8.3386 123.6373 59.7522 29.3465 179.7654 44 S 4.3279 7.9560 111.7178 60.9088 63.2835 174.9613 45 F 4.6648 8.4711 118.4238 57.5529 40.4727 177.6354 46 G 3.8546 8.0329 111.2920 46.4307 0.0000 176.8002 47 D 4.5976 9.2814 126.8960 53.1019 39.2970 175.9571 48 L 4.9211 8.2326 125.1671 54.3493 43.2631 178.2399 49 S 4.3227 8.3037 115.9832 60.5542 63.6022 174.0629 50 T 4.7406 7.4427 110.1816 58.1801 73.0634 172.7886 51 P 4.1782 0.0000 0.0000 65.9589 31.3731 178.5765 52 D 4.3014 8.1295 116.7926 57.2967 40.5132 178.4048 53 A 3.9850 8.1841 120.4957 55.3744 18.7358 179.6684 54 V 3.6807 7.8899 116.5561 66.5411 31.4621 178.2791 55 M 4.1998 8.1964 117.3654 57.6056 31.8532 178.0251 56 G 3.9521 7.8316 103.4140 43.6092 0.0000 173.3814 57 N 4.3587 7.4777 121.3905 52.9703 39.3630 174.0150 58 P 4.2924 0.0000 0.0000 64.9368 31.4151 178.9956 59 K 3.6322 8.7117 118.3783 59.2591 31.8714 179.2619 60 V 3.6418 7.5716 117.9021 65.9978 31.3544 178.0123 61 K 3.8926 8.0547 117.7436 59.5432 31.9726 179.2733 62 A 3.9934 8.1656 121.1948 55.3724 18.2251 179.1972 63 H 4.3722 8.5557 117.0890 59.0336 29.9629 177.5016 64 G 3.7320 8.5880 108.2048 47.7706 0.0000 175.2666 65 K 3.8828 8.1535 122.3913 59.0702 32.1414 178.5529 66 K 3.9183 7.9633 119.6607 59.5444 32.0758 178.8518 67 V 3.6221 8.1641 118.7258 66.2091 31.5138 178.0983 68 L 4.4155 8.7352 118.8972 57.2928 41.4392 179.7599 69 G 3.6895 8.6075 106.4026 47.7218 0.0000 175.6784 70 A 4.0506 7.9913 123.2586 54.9153 18.2565 179.4501 71 F 4.1664 8.3671 118.0675 61.4565 39.8073 176.9947 72 S 4.0384 8.9334 113.2508 61.4445 62.2894 175.7135 73 D 4.4487 8.3844 120.8535 57.1308 40.8892 178.3629 74 G 3.6844 7.8964 105.9614 47.4723 0.0000 175.5898 75 L 3.7520 7.1641 119.7337 57.1966 41.6009 178.6005 76 A 4.1722 7.5620 118.8751 53.3019 18.0519 176.9664 77 H 4.8932 8.0482 115.4270 55.2518 30.0013 175.6163 78 L 4.5943 8.1122 120.3834 57.0817 41.6531 177.9473 79 D 4.5916 7.8790 116.5244 54.6769 42.1324 175.5755 80 N 5.0743 9.2975 117.8101 52.2101 39.4807 175.3038 81 L 4.1029 7.8437 122.6987 57.9934 42.2225 179.1491 82 K 4.0320 8.0865 116.5914 59.7937 32.3811 178.7093 83 G 3.8607 8.2357 104.9832 48.7381 0.0000 175.1256 84 T 3.8332 8.1049 115.5829 63.0205 67.5916 175.2326 85 F 4.6600 7.8495 117.4203 57.1781 39.5481 176.9856 86 A 4.2922 7.8927 122.2561 55.6761 18.3374 180.2939 87 T 4.0352 7.8535 107.5457 64.7613 68.9573 176.6115 88 L 4.1067 7.9304 121.6760 57.5674 41.7085 179.0832 89 S 4.3447 9.0315 114.4185 61.5255 62.3666 176.0052 90 E 3.9117 8.5009 121.5231 59.2185 29.1681 179.0951 91 L 3.9005 7.9111 120.2088 58.6866 42.2234 178.8840 92 H 4.2180 8.2990 115.9910 58.7325 28.6655 177.4176 93 C 3.4390 7.7111 120.6315 62.3748 31.1870 175.4137 94 D 4.3607 8.2343 119.7478 56.4052 40.5127 177.9200 95 K 4.2878 7.7312 116.9955 57.6414 33.6187 177.6038 96 L 4.2150 7.7550 116.5313 55.0150 42.4122 176.0882 97 H 4.0877 7.2052 113.7831 56.6629 26.6076 175.0562 98 V 4.2501 7.8405 118.5730 61.0498 32.4058 174.7648 99 D 4.3419 8.8735 127.1956 53.8570 41.5435 175.0629 100 P 2.9700 0.0000 0.0000 64.7102 31.8265 177.9470 101 E 3.8643 8.3846 119.0654 59.2396 29.2437 178.3212 102 N 4.2899 8.1362 116.7669 56.3118 38.5197 177.3180 103 F 4.4708 7.3953 119.1636 60.5938 38.9781 177.9015 104 R 3.9628 7.9573 117.2126 59.2649 29.9167 178.9355 105 L 3.8076 7.9192 118.7006 57.6699 41.4977 179.2906 106 L 4.0747 8.3408 120.7156 58.0904 41.9834 179.2511 107 G 3.5624 8.2250 105.6555 47.9830 0.0000 175.4931 108 N 4.4508 8.2602 119.0669 55.8825 38.4989 177.7680 109 V 3.5910 8.0909 119.8985 65.7999 31.5800 177.6273 110 L 3.8523 8.6473 120.7931 58.2247 41.7812 179.1395 111 V 3.4947 7.8970 117.8853 66.3313 31.4275 177.6691 112 C 4.0385 8.2081 116.4631 62.9392 27.8598 176.4348 113 V 3.5062 8.1055 120.1671 65.8040 31.0169 178.1806 114 L 3.6622 7.7291 118.7464 57.3339 41.2607 179.2644 115 A 3.8244 7.3047 120.7717 55.4396 18.1574 179.1337 116 H 4.1090 8.0603 115.6040 59.6606 29.9396 176.5662 117 H 4.0436 8.0989 119.2516 58.3453 29.9664 176.3843 118 F 4.8248 8.4418 118.0937 56.9354 39.9195 177.1696 119 G 3.8125 9.0626 109.0334 45.8240 0.0000 176.5921 120 K 4.0772 9.0401 120.6415 59.8302 32.2866 177.9932 121 E 4.0029 7.9848 119.2412 58.6808 30.0242 177.1705 122 F 4.5025 8.3691 123.4029 57.0570 37.8898 175.0659 123 T 4.1875 7.2269 115.5937 60.3065 71.4486 173.5506 124 P 4.1713 0.0000 0.0000 65.5382 31.3886 177.2479 125 P 4.2314 0.0000 0.0000 65.3211 31.2819 178.8974 126 V 3.5550 7.4091 117.3613 65.8401 31.3715 177.8156 127 Q 3.6466 7.9218 119.4686 59.0531 28.9017 178.0324 128 A 4.0035 8.0668 121.4934 55.1328 18.4825 179.3877 129 A 3.8753 7.8994 118.8207 55.7586 18.4371 179.5382 130 Y 3.9716 8.2055 115.0670 61.2783 37.8964 179.0167 131 Q 4.1314 8.7542 119.6167 58.8997 28.7636 178.8586 132 K 4.0214 8.1206 119.5874 59.2343 31.9568 179.6232 133 V 3.4973 7.6120 118.2822 66.2424 31.5021 178.6638 134 V 3.8390 8.3524 112.2207 64.1001 31.3506 178.5420 135 A 4.0923 8.2115 121.0071 55.0439 18.1677 179.8916 136 G 3.4835 8.2166 104.3507 47.8212 0.0000 176.0376 137 V 3.1687 8.0422 121.0258 65.4488 31.5672 177.7945 138 A 3.9003 7.9881 120.4340 55.4503 18.0287 179.3222 139 N 4.2869 8.4537 113.5666 56.3834 38.7426 177.2506 140 A 4.1404 8.1891 122.4220 55.2043 18.2991 179.7551 141 L 3.9447 7.8515 116.3193 57.2075 41.8389 178.8143 142 A 4.2260 8.0105 119.8953 53.7563 18.5470 178.7898 143 H 4.3080 7.8975 116.5014 58.6969 29.9556 175.8443 144 K 4.4329 8.1749 118.0732 56.3138 32.0623 176.4889 145 Y 4.1670 8.0516 117.6992 58.6073 38.3861 175.7995 146 H 4.4084 8.3401 116.9561 56.3359 28.0654 173.5184 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 3.97 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 0.88 0.00 0.00 0.94 0.00 0.00 2 H 8.42 4.41 0.00 3.25 3.29 0.00 5.69 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 8.19 4.52 0.00 1.55 1.53 0.87 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 4 T 8.91 4.16 4.43 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 1.24 0.00 0.00 5 P 0.00 4.24 0.00 2.14 2.09 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 2.17 0.00 6 E 8.10 4.08 0.00 1.96 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 2.38 2.33 0.00 7 E 8.06 3.92 0.00 2.21 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 2.37 2.37 0.00 8 K 8.01 3.83 0.00 1.96 1.80 0.00 1.64 0.00 0.00 1.59 0.00 0.00 2.88 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.38 1.58 7.81 9 S 8.07 4.09 0.00 3.95 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 8.50 4.00 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 11 V 7.73 3.46 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 0.54 0.00 0.00 0.52 0.00 0.00 12 T 7.97 3.96 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 1.27 0.00 0.00 13 A 8.07 4.04 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 14 L 8.13 3.86 0.00 1.88 2.00 -0.17 0.86 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 15 W 8.79 4.49 0.00 3.90 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 16 G 8.33 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 K 7.90 4.45 0.00 2.25 2.07 0.00 1.78 0.00 0.00 1.76 0.00 0.00 2.97 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.47 1.55 7.81 18 V 7.51 3.74 1.17 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 -0.07 0.00 0.00 0.69 0.00 0.00 19 N 8.21 4.66 0.00 2.67 2.63 0.00 0.00 6.78 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 8.98 3.61 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 1.08 0.00 0.00 0.90 0.00 0.00 21 D 8.08 4.40 0.00 2.77 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 22 E 8.02 3.87 0.00 2.03 2.12 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 2.41 2.21 0.00 23 V 8.59 3.45 1.84 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 0.75 0.00 0.00 0.57 0.00 0.00 24 G 9.53 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 G 8.07 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 0.00 0.00 0.00 26 K 8.32 3.93 0.00 1.86 1.80 0.00 1.57 0.00 0.00 1.56 0.00 0.00 2.89 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.40 1.52 7.81 27 A 8.39 3.92 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 8.16 4.00 0.00 1.78 1.67 0.98 1.20 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 29 G 7.99 3.61 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 0.00 0.00 0.00 30 R 8.08 3.91 0.00 1.83 1.92 0.00 3.09 0.00 0.00 3.02 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.57 0.00 31 L 8.02 4.01 0.00 1.80 1.89 1.04 0.59 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 32 L 7.71 4.08 0.00 1.90 1.66 0.92 0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 33 V 7.23 3.51 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 0.70 0.00 0.00 0.89 0.00 0.00 34 V 7.68 3.53 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 0.04 0.00 0.00 0.76 0.00 0.00 35 Y 7.25 3.66 0.00 2.69 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 0.00 0.00 0.00 0.00 36 P 0.00 5.11 0.00 2.31 2.27 0.00 3.52 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 2.20 1.88 0.00 37 W 7.54 4.41 0.00 3.57 3.51 0.00 0.00 0.00 0.00 0.00 0.00 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 7.75 4.43 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 1.15 0.00 0.00 39 Q 8.42 4.79 0.00 2.35 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.70 0.00 0.00 0.00 0.00 0.00 2.46 2.50 0.00 40 R 7.66 3.36 0.00 1.64 2.04 0.00 3.17 0.00 0.00 2.90 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.50 0.00 41 F 6.75 4.06 0.00 1.68 2.53 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 42 F 8.41 4.59 0.00 3.02 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 43 E 8.34 3.95 0.00 1.96 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 0.00 2.33 2.25 0.00 44 S 7.96 4.33 0.00 4.14 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 45 F 8.47 4.66 0.00 3.10 3.08 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 46 G 8.03 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 D 9.28 4.60 0.00 2.82 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 48 L 8.23 4.92 0.00 1.65 1.68 1.07 1.11 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 49 S 8.30 4.32 0.00 3.99 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 50 T 7.44 4.74 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 2.10 0.00 3.59 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 2.08 2.14 0.00 52 D 8.13 4.30 0.00 2.70 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 8.18 3.99 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 54 V 7.89 3.68 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 1.04 0.00 0.00 0.97 0.00 0.00 55 M 8.20 4.20 0.00 1.98 2.08 0.00 0.00 0.00 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.85 0.00 56 G 7.83 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 57 N 7.48 4.36 0.00 2.93 2.73 0.00 0.00 7.11 7.47 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 58 P 0.00 4.29 0.00 2.11 2.02 0.00 3.54 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.11 0.00 59 K 8.71 3.63 0.00 1.55 0.74 0.00 1.15 0.00 0.00 1.28 0.00 0.00 2.82 0.00 0.00 2.89 0.00 0.00 0.00 0.00 0.85 1.10 7.81 60 V 7.57 3.64 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 1.01 0.00 0.00 0.98 0.00 0.00 61 K 8.05 3.89 0.00 1.99 1.80 0.00 1.67 0.00 0.00 1.61 0.00 0.00 3.13 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.42 1.55 7.81 62 A 8.17 3.99 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 63 H 8.56 4.37 0.00 3.43 3.45 0.00 5.81 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 8.59 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 65 K 8.15 3.88 0.00 1.94 2.06 0.00 1.65 0.00 0.00 1.59 0.00 0.00 2.93 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.47 1.48 7.81 66 K 7.96 3.92 0.00 2.11 1.90 0.00 1.80 0.00 0.00 1.65 0.00 0.00 2.99 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.50 1.51 7.81 67 V 8.16 3.62 2.24 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 1.02 0.00 0.00 0.85 0.00 0.00 68 L 8.74 4.42 0.00 1.85 2.08 1.05 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 69 G 8.61 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 70 A 7.99 4.05 1.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 F 8.37 4.17 0.00 3.09 3.33 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 72 S 8.93 4.04 0.00 4.49 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 73 D 8.38 4.45 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 74 G 7.90 3.68 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 0.00 0.00 0.00 75 L 7.16 3.75 0.00 1.54 1.51 0.13 -0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 76 A 7.56 4.17 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 H 8.05 4.89 0.00 3.07 3.18 0.00 5.63 0.00 0.00 0.00 0.00 7.00 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 4.59 0.00 1.54 1.64 0.80 0.94 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 79 D 7.88 4.59 0.00 2.63 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 80 N 9.30 5.07 0.00 2.69 2.65 0.00 0.00 7.09 6.54 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 81 L 7.84 4.10 0.00 1.72 1.73 0.84 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 82 K 8.09 4.03 0.00 1.66 1.80 0.00 1.65 0.00 0.00 1.31 0.00 0.00 2.93 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.26 1.44 7.81 83 G 8.24 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 T 8.10 3.83 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 85 F 7.85 4.66 0.00 3.26 2.95 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 86 A 7.89 4.29 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 87 T 7.85 4.04 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 1.20 0.00 0.00 88 L 7.93 4.11 0.00 2.04 1.97 1.21 0.93 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 89 S 9.03 4.34 0.00 4.13 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 E 8.50 3.91 0.00 2.20 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 2.56 0.00 91 L 7.91 3.90 0.00 1.79 1.83 0.90 1.07 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 8.30 4.22 0.00 3.71 3.80 0.00 5.86 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 C 7.71 3.44 0.00 1.29 2.56 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 0.00 0.00 0.00 0.00 94 D 8.23 4.36 0.00 2.67 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 7.73 4.29 0.00 1.67 1.80 0.00 1.70 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.35 1.57 7.81 96 L 7.76 4.22 0.00 1.77 1.72 0.75 1.07 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 97 H 7.21 4.09 0.00 3.57 3.45 0.00 5.64 0.00 0.00 0.00 0.00 8.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 7.84 4.25 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 0.20 0.00 0.00 0.61 0.00 0.00 99 D 8.87 4.34 0.00 2.80 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 0.00 100 P 0.00 2.97 0.00 1.91 1.84 0.00 3.33 0.00 0.00 3.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.51 0.00 101 E 8.38 3.86 0.00 2.01 1.89 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 2.30 2.40 0.00 102 N 8.14 4.29 0.00 2.52 2.75 0.00 0.00 6.95 8.79 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 0.00 103 F 7.40 4.47 0.00 3.12 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 0.00 104 R 7.96 3.96 0.00 1.96 1.97 0.00 3.12 0.00 0.00 3.34 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.87 0.00 105 L 7.92 3.81 0.00 1.72 1.37 0.76 -0.33 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 0.00 106 L 8.34 4.07 0.00 1.88 1.88 0.93 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 107 G 8.23 3.56 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 N 8.26 4.45 0.00 2.92 2.95 0.00 0.00 6.68 7.82 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 0.00 109 V 8.09 3.59 2.25 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 1.11 0.00 0.00 1.17 0.00 0.00 110 L 8.65 3.85 0.00 1.70 1.75 0.91 0.15 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 0.00 111 V 7.90 3.49 2.32 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 1.40 0.00 0.00 1.13 0.00 0.00 112 C 8.21 4.04 0.00 3.15 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 8.11 3.51 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 0.96 0.00 0.00 0.91 0.00 0.00 114 L 7.73 3.66 0.00 0.99 0.89 0.51 0.65 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 0.00 115 A 7.30 3.82 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 0.00 116 H 8.06 4.11 0.00 3.16 3.42 0.00 5.77 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 H 8.10 4.04 0.00 2.93 2.83 0.00 5.99 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 0.00 118 F 8.44 4.82 0.00 3.39 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 0.00 119 G 9.06 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 K 9.04 4.08 0.00 1.91 2.03 0.00 1.61 0.00 0.00 1.66 0.00 0.00 2.99 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.46 1.50 7.81 121 E 7.98 4.00 0.00 2.00 2.32 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 2.21 2.23 0.00 122 F 8.37 4.50 0.00 3.08 3.17 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 0.00 0.00 0.00 0.00 123 T 7.23 4.19 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 1.28 0.00 0.00 124 P 0.00 4.17 0.00 2.15 2.14 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 2.18 0.00 125 P 0.00 4.23 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 7.41 3.56 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 1.00 0.00 0.00 0.89 0.00 0.00 127 Q 7.92 3.65 0.00 1.61 2.10 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 2.44 2.64 0.00 128 A 8.07 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 0.00 129 A 7.90 3.88 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 0.00 130 Y 8.21 3.97 0.00 3.44 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 8.75 4.13 0.00 2.26 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.80 0.00 0.00 0.00 0.00 0.00 2.79 2.62 0.00 132 K 8.12 4.02 0.00 1.98 1.84 0.00 1.65 0.00 0.00 1.56 0.00 0.00 2.90 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.62 7.81 133 V 7.61 3.50 2.28 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 1.12 0.00 0.00 0.71 0.00 0.00 134 V 8.35 3.84 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 0.84 0.00 0.00 1.11 0.00 0.00 135 A 8.21 4.09 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 0.00 136 G 8.22 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.04 3.17 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.59 0.00 0.00 0.71 0.00 0.00 138 A 7.99 3.90 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 0.00 139 N 8.45 4.29 0.00 2.80 2.89 0.00 0.00 7.08 7.26 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 0.00 140 A 8.19 4.14 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 0.00 141 L 7.85 3.94 0.00 1.06 0.98 0.01 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 142 A 8.01 4.23 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 0.00 143 H 7.90 4.31 0.00 3.29 3.60 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 8.17 4.43 0.00 1.84 1.84 0.00 1.80 0.00 0.00 1.70 0.00 0.00 2.92 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.50 1.82 7.81 145 Y 8.05 4.17 0.00 3.10 2.95 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 0.00 146 H 8.34 4.41 0.00 3.22 3.24 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