NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9087 8.3544 109.7367 45.1970 0.0000 171.8560 2 S 4.3024 7.6388 114.8512 55.7274 65.2990 173.8597 3 S 4.6970 8.4300 121.0905 56.9711 67.3877 175.2247 4 G 3.7421 8.6371 109.1713 45.7932 0.0000 173.5783 5 S 4.4635 8.5590 116.1253 56.7021 64.4642 173.0788 6 S 4.7266 9.3995 119.1125 56.1156 65.1825 172.1709 7 G 4.3239 8.1455 108.9513 43.4750 0.0000 173.3136 8 A 4.4065 8.3073 124.1197 53.6346 20.2745 178.6094 9 K 4.4253 7.7752 115.0826 57.3056 33.4494 178.1190 10 D 4.4890 8.1916 119.5950 57.8032 41.8613 176.1807 11 A 3.9869 8.0852 119.4035 55.3834 18.5194 179.0452 12 L 3.9878 7.8672 117.7832 58.2833 42.4419 178.2586 13 L 4.1151 7.8449 119.8186 58.6208 41.8388 178.8853 14 L 4.3316 8.6038 121.5681 57.1866 42.0407 178.4986 15 W 4.2349 8.3319 128.4068 61.0411 30.6777 177.8122 16 C 4.1652 8.5318 115.9517 62.8111 27.4935 176.0662 17 Q 3.9991 7.9426 121.0747 58.5479 28.0684 178.6490 18 M 4.0100 8.0492 118.8478 58.3287 32.3112 178.7549 19 K 3.8790 7.5916 118.5528 59.6732 31.7794 179.4677 20 T 3.9582 8.2701 110.1417 64.8006 68.1210 175.6859 21 A 3.9794 7.8662 123.0371 55.0823 18.3296 178.6509 22 G 3.5477 7.3138 105.1004 48.3487 0.0000 173.2895 23 Y 4.5858 7.7258 118.2320 55.2474 39.5956 175.0675 24 P 4.1644 0.0000 0.0000 65.9992 31.9291 177.2355 25 N 4.3415 8.3435 116.5047 55.8530 38.9816 175.2456 26 V 3.6515 7.0485 116.3261 62.6811 31.7993 175.0405 27 N 4.6280 8.2351 124.2516 52.0042 41.8820 174.7747 28 V 4.1171 7.8229 123.5530 60.8604 30.6774 174.1123 29 H 4.5878 8.0746 122.2118 56.3605 29.7611 174.5079 30 N 4.9872 7.5194 113.6749 51.4437 40.4332 173.7777 31 F 5.4992 8.7165 114.9003 57.8569 38.9377 176.6777 32 T 4.6514 7.6013 109.1738 62.9733 70.5995 174.8754 33 T 5.0001 7.7277 112.7403 61.3330 69.9865 175.5266 34 S 4.3233 8.1992 117.3229 58.8452 64.5148 174.5917 35 W 4.5290 7.5467 116.7737 56.0980 29.8185 176.5717 36 R 4.1180 8.1446 119.7456 59.5303 29.7242 177.1633 37 D 4.3877 7.9651 117.2318 57.5974 41.9998 176.0489 38 G 3.5148 8.8076 111.6735 46.4064 0.0000 175.4485 39 L 3.8056 8.7578 122.5646 57.8495 41.5339 179.5188 40 A 3.6110 7.7324 119.9247 55.3732 18.2140 179.5563 41 F 4.6512 8.2882 115.9247 60.7789 38.8537 177.0625 42 N 4.8672 8.4217 112.9764 54.3616 38.1874 176.0440 43 A 3.7892 7.9388 123.1765 53.5792 19.6212 179.5481 44 I 3.6857 7.7595 117.1505 64.8778 37.6660 178.1840 45 V 3.8342 7.8852 117.8594 66.0439 31.4769 177.4317 46 H 4.1360 8.2271 117.2513 59.3400 29.6831 176.7572 47 K 4.0282 7.5196 119.3917 59.8420 32.1104 178.2551 48 H 4.6814 8.2334 115.3163 57.3414 29.6949 176.0516 49 R 4.5579 7.5493 121.1326 53.4493 30.8208 173.6488 50 P 4.4671 0.0000 0.0000 63.1167 31.7405 177.7029 51 D 4.5524 7.8491 119.8863 57.0683 41.1489 177.5836 52 L 3.9930 7.8060 117.0686 57.3448 41.8177 177.1364 53 L 4.9411 7.6508 116.2049 54.0768 43.6562 176.2802 54 D 4.9494 8.1807 119.2723 51.5600 40.7290 176.3774 55 F 3.7843 8.8173 126.0508 61.2102 39.7263 177.3853 56 E 4.0765 8.4676 118.2758 59.6544 29.4754 178.5462 57 S 4.2642 8.5576 114.2982 61.1191 63.1282 175.1528 58 L 4.0919 7.1367 118.7421 54.7167 41.8841 176.2261 59 K 4.5998 8.1000 120.8231 54.5211 34.9652 175.3415 60 K 4.4143 8.2784 121.0395 57.8139 33.3326 176.5678 61 C 4.5533 7.9094 116.9608 62.0156 33.6148 173.0338 62 N 4.4957 8.0820 116.7244 53.3926 39.5245 173.5936 63 A 4.7841 8.5191 126.9313 53.7018 20.8215 178.0650 64 H 4.0231 8.1754 116.0457 59.7901 29.9836 176.1031 65 Y 4.0334 7.8864 120.8953 60.8295 38.4837 176.9544 66 N 4.2893 8.5365 116.8976 56.5270 38.4467 177.0101 67 L 3.8426 8.4726 120.9415 57.3933 41.9709 178.9247 68 Q 4.1602 7.9614 117.0742 59.6073 28.3505 178.4240 69 N 4.0115 8.2428 118.8804 56.1732 38.9020 176.6050 70 A 3.9255 7.3251 121.4414 55.3247 18.4349 179.5665 71 F 4.3913 7.8879 116.6032 61.0018 38.9184 177.5532 72 N 4.4180 8.9471 116.5135 55.9571 38.4693 177.1987 73 L 3.9331 8.5781 120.3316 58.2005 41.8968 179.8987 74 A 3.9674 8.1137 120.2780 55.0430 18.2696 179.0505 75 E 4.9918 8.3360 117.3414 57.6532 29.6630 177.0211 76 K 4.3693 7.6783 116.4809 59.3124 33.9098 177.1425 77 E 3.9831 8.7894 119.1454 59.1391 29.4254 178.4108 78 L 3.7808 7.4520 120.3828 57.4256 42.0747 179.3837 79 G 3.8663 8.4413 105.2418 45.7672 0.0000 173.1624 80 L 4.3841 7.5472 117.9016 52.9794 43.4580 176.3699 81 T 4.2397 8.0500 118.8102 62.5726 68.7607 174.7395 82 K 4.1849 8.5738 126.3441 57.0197 31.4305 176.5345 83 L 4.1921 8.5417 124.8065 55.7056 42.2289 176.7088 84 L 4.6716 7.5240 116.1712 52.6220 45.2168 174.5995 85 D 4.6851 7.6641 117.6062 51.7305 44.2070 175.2798 86 P 4.8362 0.0000 0.0000 64.2083 31.6550 176.5989 87 E 4.4263 7.8632 116.2861 57.7685 31.5130 177.1793 88 D 4.4358 8.1394 118.2318 57.3003 41.2363 177.8242 89 V 3.6309 7.6324 117.0301 65.8512 31.5152 175.1192 90 N 4.5610 8.0468 121.0294 54.2566 37.6318 173.4488 91 V 4.4418 7.7086 122.0669 60.3677 34.1627 173.8678 92 D 4.5811 8.9432 120.6595 57.3369 40.6841 178.0715 93 Q 4.4802 7.5666 117.7884 53.0258 29.2961 172.9229 94 P 4.4565 0.0000 0.0000 61.9576 32.6853 177.5967 95 D 4.6179 8.4496 118.7945 53.3814 40.8813 176.9592 96 E 4.8196 8.7496 126.3600 59.0117 28.5676 179.1908 97 K 4.0644 8.0306 118.5693 58.8469 31.9884 178.6461 98 S 4.4092 8.0621 113.9265 59.6160 63.2025 175.5290 99 I 4.1255 7.2402 121.9180 63.4863 38.0165 177.5014 100 I 3.1691 7.6901 120.8479 64.8717 36.5448 178.5060 101 T 3.8059 6.9821 112.4551 66.7007 68.5709 175.8767 102 Y 3.8874 8.2743 122.1922 60.5415 38.8057 178.0934 103 V 3.8052 7.9423 119.4574 64.9393 31.1225 177.8586 104 A 4.1094 7.9005 121.0511 55.0993 18.1093 179.6837 105 T 3.8883 8.3966 109.0817 65.2611 68.7268 176.3230 106 Y 4.6519 8.2528 119.8803 61.2008 37.8938 178.2360 107 Y 3.0163 8.0469 119.7443 60.6155 38.9531 176.9990 108 H 3.5410 8.1164 116.9507 59.7580 28.6954 176.3028 109 Y 4.0082 8.4929 119.1364 61.0704 38.4996 177.5681 110 F 3.8108 8.5180 117.6920 60.8129 39.2459 177.8660 111 S 3.9915 8.0830 111.7309 61.3525 62.1600 175.8546 112 K 3.9329 7.7614 120.1437 59.4232 32.0955 176.8395 113 M 3.9229 7.0052 116.2175 54.7497 32.1794 175.4310 114 K 3.8051 8.3733 118.3035 57.8524 31.4147 176.1571 115 A 4.4440 8.0971 124.3078 50.5268 21.7502 175.5990 116 L 3.9242 8.3972 119.3141 56.6774 40.5698 176.8075 117 A 4.4008 7.9257 120.5863 51.6175 21.6666 176.0606 118 V 4.2016 7.8914 120.1886 62.1491 34.2504 175.1939 119 E 3.8301 8.8793 128.4780 57.6895 27.4056 174.3973 120 G 4.1609 7.6859 110.0911 45.4074 0.0000 173.2526 121 K 4.4465 8.3656 123.1954 55.3501 33.6642 176.3010 122 S 4.3836 8.6612 115.2217 57.3018 63.0872 174.4169 123 G 3.7989 8.0013 106.9525 45.8614 0.0000 171.4987 124 P 4.5272 0.0000 0.0000 62.6452 32.3797 176.0253 125 S 4.6844 7.7749 113.6832 57.2097 66.9220 173.9646 126 S 4.4200 7.7764 111.1513 56.6914 64.8355 176.6252 127 G 3.4798 9.0829 113.3354 45.5468 0.0000 172.1039 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 G 8.35 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 0.00 0.00 0.00 2 S 7.64 4.30 0.00 3.86 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 3 S 8.43 4.70 0.00 3.96 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 4 G 8.64 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 S 8.56 4.46 0.00 3.94 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 6 S 9.40 4.73 0.00 3.82 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 0.00 7 G 8.15 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 A 8.31 4.41 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 9 K 7.78 4.43 0.00 2.01 2.02 0.00 1.76 0.00 0.00 1.81 0.00 0.00 2.87 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.63 1.85 7.81 10 D 8.19 4.49 0.00 2.86 2.72 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 11 A 8.09 3.99 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 12 L 7.87 3.99 0.00 1.75 1.83 0.85 0.46 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 13 L 7.84 4.12 0.00 2.29 2.00 0.40 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 14 L 8.60 4.33 0.00 1.80 1.97 0.94 0.87 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 15 W 8.33 4.23 0.00 3.51 3.47 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 16 C 8.53 4.17 0.00 3.19 3.21 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 17 Q 7.94 4.00 0.00 2.34 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.51 6.78 0.00 0.00 0.00 0.00 0.00 2.39 2.35 0.00 18 M 8.05 4.01 0.00 1.87 2.14 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.85 2.56 0.00 19 K 7.59 3.88 0.00 1.46 1.55 0.00 1.38 0.00 0.00 1.37 0.00 0.00 2.55 0.00 0.00 2.60 0.00 0.00 0.00 0.00 0.87 0.53 7.81 20 T 8.27 3.96 4.14 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 1.07 0.00 0.00 21 A 7.87 3.98 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 22 G 7.31 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 23 Y 7.73 4.59 0.00 2.86 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 24 P 0.00 4.16 0.00 2.19 2.17 0.00 3.88 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.97 0.00 25 N 8.34 4.34 0.00 2.77 3.00 0.00 0.00 6.91 7.70 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 26 V 7.05 3.65 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 0.71 0.00 0.00 0.71 0.00 0.00 27 N 8.24 4.63 0.00 2.43 2.22 0.00 0.00 6.98 7.66 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 28 V 7.82 4.12 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 0.98 0.00 0.00 0.46 0.00 0.00 29 H 8.07 4.59 0.00 3.08 3.23 0.00 5.71 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 30 N 7.52 4.99 0.00 2.81 2.78 0.00 0.00 5.84 7.49 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 31 F 8.72 5.50 0.00 3.22 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 T 7.60 4.65 4.34 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 1.40 0.00 0.00 33 T 7.73 5.00 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 1.28 0.00 0.00 34 S 8.20 4.32 0.00 3.56 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 35 W 7.55 4.53 0.00 3.15 3.05 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 36 R 8.14 4.12 0.00 1.85 2.00 0.00 3.44 0.00 0.00 3.18 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.85 0.00 37 D 7.97 4.39 0.00 2.78 2.58 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.81 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 0.00 0.00 0.00 39 L 8.76 3.81 0.00 1.69 1.80 0.88 -0.03 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 40 A 7.73 3.61 0.43 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 41 F 8.29 4.65 0.00 3.21 3.05 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 42 N 8.42 4.87 0.00 2.90 2.97 0.00 0.00 7.00 7.48 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 43 A 7.94 3.79 0.95 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 44 I 7.76 3.69 2.42 0.00 0.00 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 1.69 0.99 1.33 0.00 0.00 45 V 7.89 3.83 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 1.21 0.00 0.00 1.17 0.00 0.00 46 H 8.23 4.14 0.00 3.41 3.31 0.00 5.73 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 47 K 7.52 4.03 0.00 1.97 1.73 0.00 1.57 0.00 0.00 1.55 0.00 0.00 2.93 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.23 1.38 7.81 48 H 8.23 4.68 0.00 3.29 3.40 0.00 5.65 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 49 R 7.55 4.56 0.00 1.88 1.89 0.00 3.39 0.00 0.00 3.53 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.69 0.00 50 P 0.00 4.47 0.00 2.11 2.00 0.00 3.37 0.00 0.00 4.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.91 0.00 51 D 7.85 4.55 0.00 2.67 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 L 7.81 3.99 0.00 1.70 1.80 1.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 53 L 7.65 4.94 0.00 1.78 1.68 1.09 0.79 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 54 D 8.18 4.95 0.00 2.75 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 55 F 8.82 3.78 0.00 2.72 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 56 E 8.47 4.08 0.00 2.07 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 2.43 2.36 0.00 57 S 8.56 4.26 0.00 3.99 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 58 L 7.14 4.09 0.00 1.30 1.37 0.71 0.91 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 59 K 8.10 4.60 0.00 1.58 1.58 0.00 1.61 0.00 0.00 1.70 0.00 0.00 3.08 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.25 1.39 7.81 60 K 8.28 4.41 0.00 1.85 1.93 0.00 1.51 0.00 0.00 1.59 0.00 0.00 3.05 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.32 1.33 7.81 61 C 7.91 4.55 0.00 2.88 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 62 N 8.08 4.50 0.00 2.71 2.76 0.00 0.00 6.77 8.00 0.00 0.00 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 A 8.52 4.78 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 64 H 8.18 4.02 0.00 3.25 3.39 0.00 5.67 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 Y 7.89 4.03 0.00 3.01 3.13 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 66 N 8.54 4.29 0.00 3.00 2.87 0.00 0.00 6.96 6.94 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 67 L 8.47 3.84 0.00 1.96 1.90 1.13 1.10 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 68 Q 7.96 4.16 0.00 2.31 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 6.92 0.00 0.00 0.00 0.00 0.00 2.43 2.28 0.00 69 N 8.24 4.01 0.00 1.86 2.40 0.00 0.00 7.01 7.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 A 7.33 3.93 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 71 F 7.89 4.39 0.00 3.14 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 N 8.95 4.42 0.00 2.87 2.86 0.00 0.00 6.93 6.67 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 73 L 8.58 3.93 0.00 1.76 1.81 0.95 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 74 A 8.11 3.97 1.51 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 0.00 0.00 75 E 8.34 4.99 0.00 2.15 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 2.48 2.34 0.00 76 K 7.68 4.37 0.00 1.85 1.76 0.00 1.75 0.00 0.00 1.70 0.00 0.00 3.12 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.36 1.48 7.81 77 E 8.79 3.98 0.00 1.97 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 2.46 2.52 0.00 78 L 7.45 3.78 0.00 1.36 0.69 0.53 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 79 G 8.44 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 L 7.55 4.38 0.00 1.65 1.39 0.93 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 81 T 8.05 4.24 4.14 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 1.16 0.00 0.00 82 K 8.57 4.18 0.00 1.73 1.75 0.00 1.69 0.00 0.00 1.80 0.00 0.00 2.99 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.57 1.54 7.81 83 L 8.54 4.19 0.00 1.72 1.69 0.75 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 84 L 7.52 4.67 0.00 0.86 1.23 0.83 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 85 D 7.66 4.69 0.00 2.71 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 86 P 0.00 4.84 0.00 2.50 2.42 0.00 3.71 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 2.11 2.08 0.00 87 E 7.86 4.43 0.00 2.03 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 2.18 2.27 0.00 88 D 8.14 4.44 0.00 2.60 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 89 V 7.63 3.63 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 0.95 0.00 0.00 0.98 0.00 0.00 90 N 8.05 4.56 0.00 2.85 2.84 0.00 0.00 6.78 7.73 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 91 V 7.71 4.44 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 0.86 0.00 0.00 0.95 0.00 0.00 92 D 8.94 4.58 0.00 2.71 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 Q 7.57 4.48 0.00 2.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 7.07 0.00 0.00 0.00 0.00 0.00 2.27 2.28 0.00 94 P 0.00 4.46 0.00 2.26 2.37 0.00 3.83 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 2.09 2.14 0.00 95 D 8.45 4.62 0.00 2.72 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 96 E 8.75 4.82 0.00 2.45 2.36 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 2.41 2.33 0.00 97 K 8.03 4.06 0.00 1.77 1.87 0.00 1.65 0.00 0.00 1.77 0.00 0.00 2.95 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.53 1.47 7.81 98 S 8.06 4.41 0.00 3.98 3.89 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 99 I 7.24 4.13 1.81 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.90 0.50 0.00 0.00 100 I 7.69 3.17 1.54 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.50 0.45 0.00 0.00 101 T 6.98 3.81 4.19 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 1.14 0.00 0.00 102 Y 8.27 3.89 0.00 2.89 2.85 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 0.00 103 V 7.94 3.81 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 0.80 0.00 0.00 1.14 0.00 0.00 104 A 7.90 4.11 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 0.00 105 T 8.40 3.89 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 1.06 0.00 0.00 106 Y 8.25 4.65 0.00 3.64 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 0.00 107 Y 8.05 3.02 0.00 1.78 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 H 8.12 3.54 0.00 3.20 3.29 0.00 5.70 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 Y 8.49 4.01 0.00 2.79 3.01 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 0.00 110 F 8.52 3.81 0.00 3.43 3.13 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 0.00 111 S 8.08 3.99 0.00 3.14 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 0.00 112 K 7.76 3.93 0.00 1.64 1.77 0.00 1.75 0.00 0.00 1.64 0.00 0.00 3.00 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.39 1.70 7.81 113 M 7.01 3.92 0.00 1.91 2.18 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.33 0.00 114 K 8.37 3.81 0.00 1.72 1.83 0.00 1.65 0.00 0.00 1.69 0.00 0.00 3.09 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.44 1.50 7.81 115 A 8.10 4.44 1.23 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 0.00 0.00 116 L 8.40 3.92 0.00 1.78 1.76 0.98 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 117 A 7.93 4.40 1.22 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 0.00 0.00 0.00 118 V 7.89 4.20 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 0.87 0.00 0.00 0.94 0.00 0.00 119 E 8.88 3.83 0.00 2.14 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 2.22 2.28 0.00 120 G 7.69 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 K 8.37 4.45 0.00 1.72 1.72 0.00 1.75 0.00 0.00 1.75 0.00 0.00 3.06 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.37 1.34 7.81 122 S 8.66 4.38 0.00 3.96 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 0.00 123 G 8.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 P 0.00 4.53 0.00 2.18 2.07 0.00 3.71 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 1.97 1.97 0.00 125 S 7.77 4.68 0.00 3.80 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 S 7.78 4.42 0.00 3.90 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 G 9.08 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