NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3771 8.1627 120.3229 55.5756 33.2952 173.3764 2 H 3.9287 7.6113 125.1061 55.4031 30.7160 171.9441 3 L 4.5369 10.3949 122.1728 53.2318 44.6347 176.9040 4 T 4.1723 8.8277 120.2747 62.2636 69.6873 173.8782 5 P 4.2329 0.0000 0.0000 65.8969 31.4770 178.2572 6 E 4.1833 8.0756 113.8939 57.9570 30.4261 178.4896 7 E 3.9198 7.9876 119.9787 59.2811 29.9061 178.1977 8 K 3.7429 8.5490 119.1016 60.0013 32.2941 179.2023 9 S 4.0961 8.1562 112.6610 61.1180 61.9997 176.0033 10 A 4.0521 7.7701 123.4888 54.7481 18.0391 179.9186 11 V 3.5324 7.8129 116.8849 66.3865 31.6776 178.1827 12 T 3.8963 7.9495 115.2260 66.8159 68.1473 176.2300 13 A 4.0485 7.6820 120.6923 55.2809 18.7158 179.1420 14 L 3.9398 7.7679 117.4329 57.9104 42.1910 178.9561 15 W 4.3591 8.6904 128.6487 60.4035 30.5693 177.9014 16 G 4.1059 8.1207 104.1507 46.6548 0.0000 173.7312 17 K 4.4917 7.6155 118.3230 55.9307 33.0370 176.1544 18 V 3.7949 7.7071 120.4085 61.8984 32.1993 175.8602 19 N 4.5012 8.2880 125.3566 52.2857 38.8298 175.4820 20 V 3.4566 8.0511 128.1672 66.0077 31.8013 176.9841 21 D 4.3816 8.1763 117.9710 57.7014 40.6324 178.6723 22 E 3.8720 8.2124 118.3046 59.4798 29.4758 179.4081 23 V 3.4895 7.8735 118.2962 66.0040 31.4517 178.3985 24 G 3.6685 8.4369 105.7371 47.8770 0.0000 176.0446 25 G 3.6125 7.9174 108.1402 47.1080 0.0000 175.5559 26 E 3.8537 8.3997 121.5432 58.9121 29.7254 178.4634 27 A 3.9211 8.1403 121.1812 55.3202 18.2440 179.4500 28 L 3.9726 7.6983 117.3199 58.0479 42.5197 179.0097 29 G 3.7289 7.9784 105.6741 48.0349 0.0000 175.9177 30 R 3.9516 8.3565 121.2491 58.7043 29.9832 178.9803 31 L 4.1257 7.8511 120.3083 58.0665 42.0909 178.9411 32 L 4.1142 7.8680 118.7802 57.0204 41.3026 179.2619 33 V 3.7233 7.4099 117.0009 65.2997 31.9659 177.6402 34 V 3.6290 7.8861 117.2641 64.1237 32.8458 175.6277 35 Y 4.3405 7.4555 116.1994 54.4356 37.8434 174.1077 36 P 4.8118 0.0000 0.0000 64.6525 31.6874 177.1402 37 Y 4.3798 7.5348 115.8752 59.3106 37.6050 177.3746 38 T 4.2506 8.0549 112.1425 63.8504 68.8406 175.7991 39 Q 4.3855 8.1858 121.5298 57.7250 28.4507 177.9844 40 R 3.7021 7.4044 117.3930 59.0673 29.2374 178.0538 41 F 4.2648 7.1136 115.0765 57.7792 39.4621 176.0659 42 F 4.6563 7.7515 118.3609 56.6960 39.2988 177.3920 43 E 3.9905 8.4728 123.3519 59.6769 29.3371 178.8916 44 S 4.7651 8.0427 109.9499 58.7527 63.3205 174.6942 45 F 4.5737 8.2096 120.3716 58.2998 39.7360 175.2071 46 G 3.9993 7.3817 105.0721 43.7910 0.0000 173.0747 47 D 4.4962 8.7220 122.5086 54.6977 41.5886 176.8298 48 L 4.9083 8.2498 126.5533 54.6081 43.3256 177.7444 49 S 4.3478 8.1702 116.3728 60.5704 63.5452 174.5949 50 T 4.7257 7.4120 110.3708 58.3322 72.9802 172.5533 51 P 4.2006 0.0000 0.0000 66.0464 31.3794 178.6788 52 D 4.3181 8.0769 116.7344 57.4205 40.9312 178.5668 53 A 4.0104 8.0712 121.1921 54.9768 18.0776 179.9978 54 V 3.5321 7.6775 116.1179 66.5750 31.8361 178.1720 55 M 4.2795 8.4230 117.1210 57.6833 31.7845 178.3417 56 G 3.8962 7.9791 105.1605 45.3101 0.0000 173.5950 57 N 4.2617 7.6444 119.7772 53.5875 39.2346 173.7800 58 P 4.3189 0.0000 0.0000 65.2273 31.5006 178.7073 59 K 3.7203 7.9489 117.0443 58.6210 31.8437 179.4825 60 V 3.7489 7.8314 118.9558 65.8906 31.5541 178.0870 61 K 3.8725 7.8936 117.8398 59.6124 31.8573 179.2344 62 A 4.0048 8.1880 121.1225 55.4126 18.2767 179.1925 63 H 4.5144 8.4964 116.9084 59.0157 29.8557 177.8269 64 G 3.5495 8.2549 108.1462 47.5595 0.0000 175.5347 65 K 3.9608 8.0060 122.3106 59.0224 32.2478 178.8054 66 K 3.9959 7.9538 119.5590 59.4807 32.2463 178.8964 67 V 3.6458 7.8927 118.5222 66.1222 31.4605 177.6685 68 L 4.4320 8.5563 119.7233 57.1965 41.9117 179.0163 69 G 3.6893 8.2422 106.0376 48.0903 0.0000 175.6456 70 A 4.2641 8.1506 122.8910 54.4748 18.2446 179.5435 71 F 4.2322 8.2423 118.8086 61.3989 39.7688 176.8717 72 S 4.3536 8.6892 113.1865 61.8926 62.3182 175.9503 73 D 4.5230 8.3201 121.4697 57.3815 40.4891 179.0525 74 G 3.4930 7.9499 105.8813 47.6535 0.0000 175.4036 75 L 3.8278 7.5210 119.3460 56.3622 41.6301 178.1708 76 A 4.4029 7.6765 119.1980 52.3990 19.2646 176.8479 77 H 4.8215 7.9119 115.2287 55.0252 29.9420 175.9731 78 L 3.3530 8.1052 121.7626 57.8706 41.5216 178.4561 79 D 4.4661 7.8898 116.4240 56.1084 41.7983 175.9741 80 N 4.9912 8.8547 119.1618 51.2544 39.6145 174.7606 81 L 3.9374 7.8417 122.9541 57.8005 42.1845 179.4191 82 K 4.0486 8.0580 117.9841 59.6373 31.8821 179.4967 83 G 3.5923 7.7757 104.3275 48.0360 0.0000 175.4810 84 T 3.7803 7.4324 116.7796 65.7574 68.6929 175.7854 85 F 4.9217 7.7507 116.4735 57.1147 39.3345 177.2429 86 A 4.0721 7.7506 122.4364 55.9480 18.2120 179.9804 87 T 3.8510 7.9435 106.8591 65.0867 68.8186 176.0798 88 L 4.1127 7.9999 122.5047 57.4632 42.0937 178.8533 89 S 4.2882 8.2405 113.4687 61.5394 62.4934 175.6879 90 E 3.8661 8.2299 121.3003 59.5929 29.1444 179.3372 91 L 4.0538 7.9340 119.9366 58.3711 42.1692 178.7392 92 H 4.1621 8.1309 115.8936 58.6290 28.3821 177.4009 93 C 3.5196 7.8763 120.6130 62.1009 31.0821 175.3502 94 D 4.2604 8.1070 119.2671 56.9549 40.7313 178.2779 95 K 4.1612 7.6773 116.2914 58.3101 32.9275 178.4158 96 L 4.1168 7.8923 117.8028 54.6866 42.5168 176.3856 97 H 4.0228 7.1804 114.7755 56.6929 26.5782 175.4088 98 V 3.9401 7.7384 118.4540 60.7933 32.3679 174.7497 99 D 4.3791 8.7273 127.3905 53.9795 41.5522 175.2701 100 P 3.2564 0.0000 0.0000 64.5404 31.6805 178.0506 101 E 4.0609 8.0582 118.7190 59.0883 29.3716 178.3571 102 N 4.2675 7.9527 116.6207 55.9683 38.5550 177.2552 103 F 4.4880 7.8443 119.9499 60.3673 38.9270 177.9378 104 R 3.9526 7.8923 117.3995 59.1528 29.9791 178.7330 105 L 3.7616 7.5204 118.6835 57.7959 41.5270 179.3925 106 L 4.0682 8.0750 120.2353 57.8822 41.9416 179.1435 107 G 3.6914 7.9678 105.3513 48.1224 0.0000 175.4474 108 N 4.4320 8.1871 119.6641 55.6394 38.4187 177.8658 109 V 3.5721 7.9007 119.7818 65.7827 31.6444 177.4451 110 L 3.8399 8.4182 120.8787 58.5756 41.6854 179.2690 111 V 3.5681 7.9355 117.6624 66.2133 31.4283 177.7447 112 C 4.1410 8.0275 116.5235 62.6186 28.0006 176.1730 113 V 3.4844 8.0397 120.1948 66.1292 31.1281 178.1744 114 L 3.8224 7.8537 118.3320 57.4932 41.2649 179.4418 115 A 3.6613 7.1328 120.7726 55.0691 18.0640 179.1628 116 H 4.0299 7.8797 116.1058 59.5380 29.9720 177.0816 117 H 4.1099 7.8536 117.0045 58.4847 28.9877 177.1046 118 F 4.7689 8.3066 117.6566 54.9020 39.5212 179.2728 119 G 3.9302 8.9797 107.8710 46.1676 0.0000 175.1770 120 K 3.8841 9.5651 119.6213 59.4953 32.1273 177.5720 121 E 4.0690 8.2412 117.4094 58.0716 30.1753 176.5924 122 F 4.6865 7.9218 123.1025 57.2126 38.7547 175.6881 123 T 4.0185 7.4725 113.0700 61.4782 70.6412 172.4742 124 P 4.1457 0.0000 0.0000 65.4994 31.1096 177.0182 125 P 4.1859 0.0000 0.0000 65.7021 31.3638 178.8497 126 V 3.5604 7.2302 115.7246 65.8358 31.3531 177.7482 127 Q 3.6339 8.0324 119.4736 59.0703 28.6917 178.1047 128 A 3.9750 8.2492 121.7509 55.3164 18.3541 179.5331 129 A 3.9427 7.7906 118.9286 55.4453 18.3847 179.5289 130 Y 3.8944 8.0853 114.8844 61.1800 37.9005 178.6459 131 Q 4.1707 8.5681 119.3686 58.7718 28.6981 178.9039 132 K 4.0126 7.8435 119.7164 59.3050 31.9969 179.6384 133 V 3.4930 7.7157 118.6205 65.8910 31.4590 178.2417 134 V 3.7483 8.3478 118.2432 66.0767 31.3260 177.9009 135 A 4.1201 8.1920 120.6943 55.0189 18.2200 179.7049 136 G 3.5969 8.2878 104.4424 48.1051 0.0000 176.0764 137 V 3.5425 8.5963 121.3271 65.5095 31.6480 178.0324 138 A 3.7976 8.1792 120.6409 55.1079 18.0073 179.3320 139 N 4.2681 8.3087 114.2252 56.4349 38.9039 177.2391 140 A 4.1564 8.1314 122.1629 55.1182 18.3291 179.6645 141 L 3.8089 7.8070 116.0833 56.7864 41.6498 178.4719 142 A 4.3066 7.5833 119.0983 52.3569 19.1813 178.1322 143 H 4.2260 8.0167 117.1561 58.7396 29.9436 175.7667 144 K 4.4948 7.8413 117.5672 56.4015 32.0000 176.4049 145 Y 4.1386 7.8425 117.5644 58.3885 38.4163 175.6942 146 H 4.4742 8.1750 117.3157 56.1467 28.3821 173.2531 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 8.16 4.38 0.00 2.01 2.23 0.00 0.00 0.00 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.45 0.00 2 H 7.61 3.93 0.00 3.16 3.27 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 10.39 4.54 0.00 1.66 1.48 0.81 0.71 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 4 T 8.83 4.17 4.36 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 1.22 0.00 0.00 5 P 0.00 4.23 0.00 2.14 2.11 0.00 3.54 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 2.09 2.08 0.00 6 E 8.08 4.18 0.00 2.09 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.25 0.00 7 E 7.99 3.92 0.00 2.24 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 2.34 2.35 0.00 8 K 8.55 3.74 0.00 1.89 1.83 0.00 1.61 0.00 0.00 1.52 0.00 0.00 2.81 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.39 1.51 7.81 9 S 8.16 4.10 0.00 3.89 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 10 A 7.77 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 11 V 7.81 3.53 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 0.60 0.00 0.00 0.47 0.00 0.00 12 T 7.95 3.90 4.30 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 1.25 0.00 0.00 13 A 7.68 4.05 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 7.77 3.94 0.00 1.89 1.96 0.50 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 15 W 8.69 4.36 0.00 3.83 3.34 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 16 G 8.12 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 0.00 0.00 0.00 17 K 7.62 4.49 0.00 1.91 1.97 0.00 1.71 0.00 0.00 1.68 0.00 0.00 2.96 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.40 1.51 7.81 18 V 7.71 3.79 1.20 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 0.13 0.00 0.00 0.75 0.00 0.00 19 N 8.29 4.50 0.00 2.72 2.61 0.00 0.00 6.84 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 8.05 3.46 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 1.18 0.00 0.00 0.86 0.00 0.00 21 D 8.18 4.38 0.00 2.90 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 22 E 8.21 3.87 0.00 1.97 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 2.29 2.48 0.00 23 V 7.87 3.49 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 1.01 0.00 0.00 0.62 0.00 0.00 24 G 8.44 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 25 G 7.92 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 26 E 8.40 3.85 0.00 2.07 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 0.00 2.23 2.26 0.00 27 A 8.14 3.92 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 28 L 7.70 3.97 0.00 1.60 1.64 0.90 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 29 G 7.98 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 8.36 3.95 0.00 2.06 1.98 0.00 3.08 0.00 0.00 3.06 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.59 0.00 31 L 7.85 4.13 0.00 1.83 1.89 0.95 0.72 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 7.87 4.11 0.00 1.90 1.69 0.71 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 33 V 7.41 3.72 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 0.79 0.00 0.00 0.93 0.00 0.00 34 V 7.89 3.63 1.79 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 0.11 0.00 0.00 0.87 0.00 0.00 35 Y 7.46 4.34 0.00 2.88 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 0.00 0.00 0.00 0.00 36 P 0.00 4.81 0.00 2.19 2.11 0.00 3.79 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 2.16 1.98 0.00 37 Y 7.53 4.38 0.00 3.21 3.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 T 8.05 4.25 4.44 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 1.21 0.00 0.00 39 Q 8.19 4.39 0.00 2.25 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.79 0.00 0.00 0.00 0.00 0.00 2.44 2.49 0.00 40 R 7.40 3.70 0.00 1.53 1.86 0.00 2.97 0.00 0.00 2.74 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.50 0.00 41 F 7.11 4.26 0.00 2.04 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 42 F 7.75 4.66 0.00 2.87 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 E 8.47 3.99 0.00 2.00 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 0.00 2.50 2.23 0.00 44 S 8.04 4.77 0.00 4.10 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 45 F 8.21 4.57 0.00 3.13 3.14 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 0.00 0.00 0.00 0.00 46 G 7.38 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 0.00 0.00 0.00 47 D 8.72 4.50 0.00 2.65 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 48 L 8.25 4.91 0.00 1.64 1.60 1.02 1.00 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 49 S 8.17 4.35 0.00 3.93 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 7.41 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 1.21 0.00 0.00 51 P 0.00 4.20 0.00 2.16 2.13 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 2.09 2.16 0.00 52 D 8.08 4.32 0.00 2.67 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 53 A 8.07 4.01 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 54 V 7.68 3.53 2.19 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 0.91 0.00 0.00 0.96 0.00 0.00 55 M 8.42 4.28 0.00 1.95 2.09 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.86 0.00 56 G 7.98 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 57 N 7.64 4.26 0.00 2.98 2.92 0.00 0.00 7.10 7.42 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 58 P 0.00 4.32 0.00 2.13 2.04 0.00 3.60 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.14 0.00 59 K 7.95 3.72 0.00 1.51 0.74 0.00 1.34 0.00 0.00 1.31 0.00 0.00 2.76 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.12 1.23 7.81 60 V 7.83 3.75 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 1.07 0.00 0.00 1.07 0.00 0.00 61 K 7.89 3.87 0.00 1.99 1.82 0.00 1.69 0.00 0.00 1.62 0.00 0.00 2.91 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.44 1.44 7.81 62 A 8.19 4.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 H 8.50 4.51 0.00 3.55 3.51 0.00 5.79 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 8.25 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 65 K 8.01 3.96 0.00 1.88 2.06 0.00 1.65 0.00 0.00 1.59 0.00 0.00 2.92 0.00 0.00 3.39 0.00 0.00 0.00 0.00 1.48 1.48 7.81 66 K 7.95 4.00 0.00 2.10 2.07 0.00 1.76 0.00 0.00 1.64 0.00 0.00 3.05 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.56 1.53 7.81 67 V 7.89 3.65 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 0.96 0.00 0.00 0.93 0.00 0.00 68 L 8.56 4.43 0.00 1.97 1.80 0.88 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 69 G 8.24 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 8.15 4.26 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 8.24 4.23 0.00 3.07 3.34 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 72 S 8.69 4.35 0.00 4.58 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 0.00 73 D 8.32 4.52 0.00 2.77 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 74 G 7.95 3.49 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 0.00 75 L 7.52 3.83 0.00 1.46 1.44 -0.46 0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 76 A 7.68 4.40 1.24 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 0.00 0.00 77 H 7.91 4.82 0.00 3.00 3.10 0.00 5.83 0.00 0.00 0.00 0.00 7.02 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 3.35 0.00 1.53 1.64 0.80 0.93 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 79 D 7.89 4.47 0.00 2.62 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 80 N 8.85 4.99 0.00 2.60 2.59 0.00 0.00 7.05 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 3.94 0.00 1.72 1.78 0.91 0.62 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 82 K 8.06 4.05 0.00 1.78 1.82 0.00 1.49 0.00 0.00 1.74 0.00 0.00 2.82 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.20 1.43 7.81 83 G 7.78 3.59 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 0.00 84 T 7.43 3.78 3.75 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 0.48 0.00 0.00 85 F 7.75 4.92 0.00 3.20 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 86 A 7.75 4.07 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 87 T 7.94 3.85 4.27 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 1.22 0.00 0.00 88 L 8.00 4.11 0.00 2.05 1.87 1.05 0.95 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 89 S 8.24 4.29 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 90 E 8.23 3.87 0.00 2.26 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 2.35 2.36 0.00 91 L 7.93 4.05 0.00 1.80 1.83 0.90 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 92 H 8.13 4.16 0.00 3.71 3.68 0.00 5.86 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 C 7.88 3.52 0.00 1.23 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 0.00 0.00 0.00 0.00 94 D 8.11 4.26 0.00 2.68 2.66 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 95 K 7.68 4.16 0.00 1.78 1.79 0.00 1.59 0.00 0.00 1.66 0.00 0.00 3.11 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.36 1.54 7.81 96 L 7.89 4.12 0.00 1.66 1.61 0.69 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 97 H 7.18 4.02 0.00 3.39 3.40 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 7.74 3.94 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 0.16 0.00 0.00 0.49 0.00 0.00 99 D 8.73 4.38 0.00 2.77 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 0.00 100 P 0.00 3.26 0.00 1.97 1.85 0.00 3.46 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.77 0.00 101 E 8.06 4.06 0.00 2.03 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 0.00 2.27 2.34 0.00 102 N 7.95 4.27 0.00 2.46 2.65 0.00 0.00 6.90 8.07 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 0.00 103 F 7.84 4.49 0.00 3.04 2.91 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 0.00 104 R 7.89 3.95 0.00 1.97 1.95 0.00 3.22 0.00 0.00 3.33 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.75 0.00 105 L 7.52 3.76 0.00 1.59 1.29 0.61 0.20 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 0.00 106 L 8.07 4.07 0.00 1.79 1.69 0.91 0.97 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 0.00 107 G 7.97 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 0.00 108 N 8.19 4.43 0.00 2.78 2.94 0.00 0.00 6.75 7.59 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 0.00 109 V 7.90 3.57 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 1.09 0.00 0.00 1.13 0.00 0.00 110 L 8.42 3.84 0.00 1.70 1.82 0.91 0.43 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 0.00 111 V 7.94 3.57 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 1.22 0.00 0.00 1.16 0.00 0.00 112 C 8.03 4.14 0.00 3.18 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 0.00 113 V 8.04 3.48 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.87 0.00 0.00 114 L 7.85 3.82 0.00 0.91 1.34 0.74 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 115 A 7.13 3.66 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 7.88 4.03 0.00 3.21 3.44 0.00 5.77 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 0.00 117 H 7.85 4.11 0.00 2.65 2.53 0.00 5.70 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 8.31 4.77 0.00 3.25 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 G 8.98 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 0.00 120 K 9.57 3.88 0.00 1.81 1.96 0.00 1.80 0.00 0.00 1.67 0.00 0.00 3.00 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.49 1.43 7.81 121 E 8.24 4.07 0.00 2.22 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.28 0.00 122 F 7.92 4.69 0.00 3.07 3.15 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 0.00 0.00 0.00 0.00 123 T 7.47 4.02 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 1.21 0.00 0.00 124 P 0.00 4.15 0.00 2.15 2.14 0.00 3.59 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 2.19 0.00 125 P 0.00 4.19 0.00 2.11 2.08 0.00 3.46 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 2.09 2.13 0.00 126 V 7.23 3.56 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 0.93 0.00 0.00 0.91 0.00 0.00 127 Q 8.03 3.63 0.00 1.65 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.54 0.00 0.00 0.00 0.00 0.00 2.39 2.53 0.00 128 A 8.25 3.98 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 0.00 129 A 7.79 3.94 1.24 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 0.00 0.00 130 Y 8.09 3.89 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 0.00 131 Q 8.57 4.17 0.00 2.27 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.82 0.00 0.00 0.00 0.00 0.00 2.72 2.62 0.00 132 K 7.84 4.01 0.00 1.92 1.83 0.00 1.64 0.00 0.00 1.57 0.00 0.00 2.90 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.46 1.63 7.81 133 V 7.72 3.49 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 0.82 0.00 0.00 0.74 0.00 0.00 134 V 8.35 3.75 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 1.02 0.00 0.00 1.16 0.00 0.00 135 A 8.19 4.12 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 0.00 136 G 8.29 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 0.00 0.00 0.00 0.00 137 V 8.60 3.54 2.41 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 0.95 0.00 0.00 0.75 0.00 0.00 138 A 8.18 3.80 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 0.00 139 N 8.31 4.27 0.00 2.88 2.89 0.00 0.00 7.04 6.98 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 0.00 140 A 8.13 4.16 1.48 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 0.00 141 L 7.81 3.81 0.00 0.99 0.52 -0.03 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 142 A 7.58 4.31 1.24 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 0.00 0.00 143 H 8.02 4.23 0.00 3.19 3.48 0.00 5.76 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 7.84 4.49 0.00 1.87 1.84 0.00 1.77 0.00 0.00 1.80 0.00 0.00 3.02 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.53 1.72 7.81 145 Y 7.84 4.14 0.00 2.97 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 8.18 4.47 0.00 3.18 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