NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3910 8.3049 120.3444 54.7008 34.3848 175.4135 2 N 4.3661 7.9362 119.3921 52.7623 39.8292 174.0903 3 A 3.8492 7.6812 122.7289 51.3591 19.5541 175.6100 4 P 4.3197 0.0000 0.0000 63.0053 31.5616 174.5963 5 D 4.4445 7.7459 116.9457 53.1776 41.6635 176.9408 6 R 3.9671 8.4052 124.3117 59.5468 30.0728 178.4302 7 F 4.3216 8.0379 109.6911 58.4282 37.6141 175.8553 8 E 4.5187 8.5248 119.9875 56.9834 29.6809 177.0555 9 L 4.4527 8.0760 118.8063 56.3081 42.1584 177.4403 10 F 4.9991 8.1528 110.0357 56.0946 39.5611 174.8105 11 L 4.2186 6.9840 121.5485 53.4193 42.1746 176.5130 12 L 4.1164 8.3840 124.0462 54.4967 42.2645 177.2038 13 G 3.9202 8.7875 112.5365 44.0458 0.0000 172.8833 14 E 3.4801 8.5552 117.2440 56.8310 29.1364 177.6660 15 G 3.8409 8.6682 109.2443 46.2001 0.0000 170.9362 16 E 4.5683 7.9313 118.3304 55.6983 33.5762 175.8839 17 S 4.7690 8.4962 119.9930 56.5463 65.1983 174.0893 18 K 4.0436 8.6623 122.8153 59.1525 32.7597 176.6378 19 L 4.9803 7.6242 116.8120 51.6584 45.1382 176.4554 20 K 4.3730 8.0987 122.3537 55.0004 35.5880 174.6587 21 I 4.8177 8.4711 128.4268 59.8722 39.1931 174.4735 22 D 5.0871 8.5642 128.0438 51.4949 43.1488 174.7482 23 P 4.6670 0.0000 0.0000 62.8934 32.4079 174.9295 24 D 4.8739 8.5205 122.1377 53.4277 41.8076 176.3792 25 T 4.2469 8.6223 115.1790 63.4554 70.0106 176.1249 26 K 3.9438 8.1041 120.6144 58.8680 32.0808 175.9842 27 A 4.8178 7.7312 118.2096 49.0826 21.9204 173.7661 28 P 4.3364 0.0000 0.0000 63.5199 32.1597 175.6922 29 N 3.8908 8.6515 115.7870 54.0880 36.6344 172.3962 30 A 4.6816 7.3462 121.2323 51.1775 22.6949 174.7311 31 V 4.7272 8.6309 119.1368 61.3283 36.3462 174.2367 32 V 4.9098 8.7331 122.9883 61.2783 34.3407 173.9975 33 I 4.7593 9.2109 129.5556 59.9456 39.5275 174.9878 34 T 4.6683 8.8679 124.6835 62.3537 69.8728 174.0018 35 F 4.5663 8.8058 127.4062 56.2247 40.0852 175.2614 36 E 4.5287 9.1190 124.6450 55.4498 30.6017 176.8488 37 K 3.9979 8.2029 121.0853 57.5096 30.1476 173.2487 38 E 4.7709 7.4948 115.6580 57.1111 33.9145 173.5970 39 D 4.4237 8.7816 116.7436 54.5013 42.0287 176.5024 40 H 4.0008 8.1480 114.9475 60.2252 28.4857 177.3293 41 T 3.7160 7.5487 113.3578 66.8252 67.2723 175.1566 42 L 4.3250 7.8231 121.2318 57.5865 42.5444 177.9401 43 G 2.8468 8.0511 107.1583 46.0606 0.0000 174.7733 44 N 3.2030 8.1282 118.8595 55.6427 39.0600 177.2593 45 L 3.8247 7.0708 118.9312 58.0617 42.1166 178.4589 46 I 3.9958 7.3439 116.4086 62.3090 37.1477 177.5174 47 R 4.0101 7.2382 120.0184 58.6594 30.4058 177.5166 48 A 3.9450 7.6835 120.3695 55.4225 18.4928 179.5082 49 E 4.1989 7.9812 115.9960 58.7318 29.2994 178.6830 50 L 4.3489 7.2895 118.7306 55.9750 42.4017 176.9975 51 L 4.3951 7.9000 118.8604 55.8960 42.1739 176.6404 52 N 4.8276 7.5197 114.0879 54.2094 39.3849 174.5511 53 D 4.4333 7.7312 120.1669 54.1173 41.1436 176.7554 54 R 4.1076 8.5926 126.3892 58.2241 30.5551 177.9243 55 K 4.1957 8.6153 117.4516 57.6255 32.5609 176.3216 56 V 4.1150 7.6894 119.7713 61.8786 30.8804 175.9002 57 L 4.3393 8.7133 129.2897 57.5114 42.4871 177.4829 58 F 5.0801 8.5474 119.7674 57.0664 43.3600 173.3100 59 A 4.8676 7.6407 122.7631 51.9859 21.8474 175.1693 60 A 4.6142 7.7955 123.2248 51.4076 23.2765 173.7533 61 Y 5.4942 8.3596 116.3606 56.5114 42.2041 173.6026 62 K 3.8112 8.3385 115.0580 56.2494 36.2373 174.8313 63 V 4.2482 8.0342 115.7337 60.3173 31.7227 175.6359 64 E 4.0471 9.0380 126.0054 58.8660 29.7078 177.3866 65 H 4.5145 8.1161 115.4122 54.4328 32.8008 172.4665 66 P 4.2462 0.0000 0.0000 66.1487 31.2415 177.3028 67 F 4.5531 8.5031 116.5946 59.5399 39.0227 175.2537 68 F 5.0702 8.0374 118.7067 55.5957 40.7252 175.3491 69 A 4.5760 8.7023 127.6832 52.2715 18.7308 176.2198 70 R 5.0611 8.4198 116.7781 57.3465 31.5979 173.5154 71 F 5.0640 8.1664 113.1771 56.1841 41.7405 172.8260 72 K 5.0694 8.9471 120.2419 54.8426 34.4778 174.9745 73 L 5.4057 9.2345 127.0382 53.2951 45.0137 174.7184 74 R 5.1881 9.1162 126.7563 54.6629 32.8586 174.3229 75 I 5.1041 9.0861 126.9788 59.5505 40.9118 174.0823 76 Q 5.0639 9.2500 128.3551 54.6553 31.9613 174.3045 77 T 5.4896 8.0468 115.5423 60.2223 72.1323 173.0941 78 T 4.3354 8.3079 117.2873 63.0057 69.8471 174.5711 79 E 4.0207 8.8791 125.9122 58.3652 29.8806 177.3587 80 G 3.9035 9.1780 113.8638 45.1926 0.0000 172.3406 81 Y 4.7145 7.7506 121.2370 55.3918 38.8882 174.0168 82 D 4.6726 8.7090 128.3035 53.2153 41.9606 175.1544 83 P 3.8822 0.0000 0.0000 65.6839 31.1678 178.3011 84 K 3.8065 8.7545 118.6484 59.6645 32.0015 178.4599 85 D 4.3894 7.8087 118.0294 57.6580 40.7851 178.6377 86 A 4.5226 8.0667 121.8185 54.6403 18.0406 179.0807 87 L 3.9045 8.2001 118.7026 58.2809 42.1521 178.9356 88 K 3.9033 7.9582 117.7603 59.9620 32.0281 178.4776 89 N 4.3177 8.5015 115.8722 56.6762 38.1569 177.4226 90 A 3.7726 8.4066 121.9063 54.9922 18.3022 179.5800 91 C 4.1133 8.1927 115.6212 62.9797 28.4095 175.7035 92 N 4.2980 8.8028 118.5077 56.4245 38.1681 177.0500 93 S 4.0988 8.8039 115.0333 61.8728 62.2606 176.5328 94 I 3.7574 7.3810 121.3165 64.2998 36.5223 178.6462 95 I 3.7514 7.7608 120.7920 64.4440 37.0075 178.1403 96 N 4.2990 8.5239 117.7454 56.3628 38.3519 177.6548 97 K 4.0391 8.1813 119.8347 59.1844 32.0784 179.4365 98 L 4.1319 7.7464 119.5161 57.5477 41.8478 179.3891 99 G 3.8975 9.1647 106.4861 47.6242 0.0000 175.6081 100 A 4.0736 7.9795 122.7290 55.0586 17.1740 179.5118 101 L 3.9974 7.8665 118.5222 57.6605 42.0028 179.2647 102 K 3.9153 8.5611 120.2920 60.0167 32.2703 178.4509 103 T 3.9288 7.4656 115.0668 66.9814 68.2646 175.8555 104 N 4.5211 8.4875 115.8428 54.6378 38.7546 175.6155 105 F 4.6817 7.5100 121.0463 60.1103 40.3673 177.0144 106 E 3.9919 8.3305 118.0814 60.0357 29.0729 179.1876 107 T 3.9273 7.7534 114.0765 66.9689 68.6384 175.6553 108 E 4.0690 8.1176 118.7342 59.7777 30.0643 177.9709 109 W 3.7785 8.4234 124.8139 60.6399 30.8843 172.9135 110 N 4.0035 6.8885 125.1834 52.5212 38.1867 173.5299 111 L 5.3165 7.4230 135.0000 53.1009 41.4322 174.6550 112 Q 4.2468 7.4526 124.1209 57.3305 27.8466 174.2803 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 4.39 0.00 1.96 1.98 0.00 0.00 0.00 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.63 0.00 2 N 7.94 4.37 0.00 2.81 2.82 0.00 0.00 6.82 6.46 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 3 A 7.68 3.85 1.18 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 4 P 0.00 4.32 0.00 2.09 2.07 0.00 3.63 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.93 0.00 5 D 7.75 4.44 0.00 2.16 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 6 R 8.41 3.97 0.00 1.83 2.09 0.00 3.34 0.00 0.00 3.37 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.63 0.00 7 F 8.04 4.32 0.00 2.81 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 8 E 8.52 4.52 0.00 1.98 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.18 0.00 9 L 8.08 4.45 0.00 1.97 1.89 0.99 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 10 F 8.15 5.00 0.00 3.17 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 11 L 6.98 4.22 0.00 1.61 1.46 0.71 -0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 12 L 8.38 4.12 0.00 1.59 1.57 0.92 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 13 G 8.79 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 14 E 8.56 3.48 0.00 1.95 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 2.34 0.00 15 G 8.67 3.84 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 E 7.93 4.57 0.00 2.03 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 0.00 2.10 2.21 0.00 17 S 8.50 4.77 0.00 3.85 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 18 K 8.66 4.04 0.00 1.64 1.86 0.00 1.71 0.00 0.00 2.05 0.00 0.00 2.88 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.55 1.48 7.81 19 L 7.62 4.98 0.00 1.30 1.23 0.77 -0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 20 K 8.10 4.37 0.00 1.68 1.50 0.00 1.76 0.00 0.00 1.78 0.00 0.00 2.82 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.34 1.40 7.81 21 I 8.47 4.82 1.81 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.63 0.87 0.00 0.00 22 D 8.56 5.09 0.00 2.59 2.54 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 23 P 0.00 4.67 0.00 2.07 2.05 0.00 3.74 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.96 0.00 24 D 8.52 4.87 0.00 2.76 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 25 T 8.62 4.25 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 26 K 8.10 3.94 0.00 1.91 1.93 0.00 1.69 0.00 0.00 1.70 0.00 0.00 3.03 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.46 1.43 7.81 27 A 7.73 4.82 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 P 0.00 4.34 0.00 2.20 2.06 0.00 3.91 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.95 0.00 29 N 8.65 3.89 0.00 2.82 2.84 0.00 0.00 6.87 7.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 A 7.35 4.68 1.25 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 0.00 0.00 0.00 31 V 8.63 4.73 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 1.01 0.00 0.00 0.92 0.00 0.00 32 V 8.73 4.91 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 0.98 0.00 0.00 0.99 0.00 0.00 33 I 9.21 4.76 1.91 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.68 0.37 0.00 0.00 34 T 8.87 4.67 4.15 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 1.16 0.00 0.00 35 F 8.81 4.57 0.00 1.51 2.59 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 36 E 9.12 4.53 0.00 1.89 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 2.26 2.40 0.00 37 K 8.20 4.00 0.00 2.00 1.95 0.00 1.93 0.00 0.00 1.77 0.00 0.00 3.01 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.42 1.59 7.81 38 E 7.49 4.77 0.00 2.19 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.55 0.00 39 D 8.78 4.42 0.00 2.80 2.86 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 40 H 8.15 4.00 0.00 3.20 3.39 0.00 5.93 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 41 T 7.55 3.72 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 1.21 0.00 0.00 42 L 7.82 4.33 0.00 1.76 1.75 1.01 1.48 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 43 G 8.05 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 0.00 0.00 0.00 44 N 8.13 3.20 0.00 2.64 2.73 0.00 0.00 7.04 6.26 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 45 L 7.07 3.82 0.00 1.75 1.71 0.86 0.81 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 46 I 7.34 4.00 1.78 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.87 0.97 0.00 0.00 47 R 7.24 4.01 0.00 1.42 1.66 0.00 3.18 0.00 0.00 3.29 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.27 0.00 48 A 7.68 3.94 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 49 E 7.98 4.20 0.00 2.06 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 2.29 2.44 0.00 50 L 7.29 4.35 0.00 1.88 1.63 0.96 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 51 L 7.90 4.40 0.00 1.78 1.67 0.88 0.96 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 52 N 7.52 4.83 0.00 2.96 2.85 0.00 0.00 6.85 7.94 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 53 D 7.73 4.43 0.00 2.74 2.65 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 54 R 8.59 4.11 0.00 1.87 2.00 0.00 3.43 0.00 0.00 3.24 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.61 0.00 55 K 8.62 4.20 0.00 2.49 2.40 0.00 1.61 0.00 0.00 1.63 0.00 0.00 2.77 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.47 1.40 7.81 56 V 7.69 4.11 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 0.79 0.00 0.00 0.94 0.00 0.00 57 L 8.71 4.34 0.00 1.80 1.79 1.03 0.86 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 58 F 8.55 5.08 0.00 3.08 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 59 A 7.64 4.87 1.01 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 60 A 7.80 4.61 1.14 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 0.00 0.00 61 Y 8.36 5.49 0.00 3.21 2.99 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 62 K 8.34 3.81 0.00 1.69 1.80 0.00 1.29 0.00 0.00 1.67 0.00 0.00 2.87 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.24 1.30 7.81 63 V 8.03 4.25 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 0.42 0.00 0.00 0.82 0.00 0.00 64 E 9.04 4.05 0.00 2.01 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 2.37 2.34 0.00 65 H 8.12 4.51 0.00 2.93 2.71 0.00 5.73 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 P 0.00 4.25 0.00 2.32 2.21 0.00 3.42 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.85 0.00 67 F 8.50 4.55 0.00 2.24 3.10 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 68 F 8.04 5.07 0.00 3.03 2.90 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 69 A 8.70 4.58 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 70 R 8.42 5.06 0.00 1.94 1.98 0.00 3.22 0.00 0.00 3.36 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.58 0.00 71 F 8.17 5.06 0.00 3.03 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.95 5.07 0.00 1.81 1.84 0.00 1.65 0.00 0.00 1.62 0.00 0.00 2.83 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.41 1.41 7.81 73 L 9.23 5.41 0.00 2.11 2.01 1.08 0.95 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 74 R 9.12 5.19 0.00 2.03 1.88 0.00 3.25 0.00 0.00 3.49 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.88 0.00 75 I 9.09 5.10 1.88 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.59 0.86 0.00 0.00 76 Q 9.25 5.06 0.00 2.25 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.47 0.00 0.00 0.00 0.00 0.00 2.27 2.50 0.00 77 T 8.05 5.49 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 0.89 0.00 0.00 78 T 8.31 4.34 4.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 79 E 8.88 4.02 0.00 1.95 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 2.33 2.37 0.00 80 G 9.18 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 81 Y 7.75 4.71 0.00 2.91 3.10 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 82 D 8.71 4.67 0.00 2.75 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 83 P 0.00 3.88 0.00 2.22 2.17 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 2.02 2.01 0.00 84 K 8.75 3.81 0.00 1.81 1.92 0.00 1.66 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.45 1.66 7.81 85 D 7.81 4.39 0.00 3.06 2.90 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 86 A 8.07 4.52 1.15 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 0.00 0.00 87 L 8.20 3.90 0.00 1.79 1.92 1.07 1.14 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 88 K 7.96 3.90 0.00 2.18 1.92 0.00 1.77 0.00 0.00 1.67 0.00 0.00 2.96 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.50 1.56 7.81 89 N 8.50 4.32 0.00 2.95 2.93 0.00 0.00 7.02 7.05 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 90 A 8.41 3.77 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 C 8.19 4.11 0.00 3.19 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 92 N 8.80 4.30 0.00 2.84 2.89 0.00 0.00 6.71 7.94 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 93 S 8.80 4.10 0.00 3.96 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 94 I 7.38 3.76 2.02 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.44 0.90 0.00 0.00 95 I 7.76 3.75 2.00 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.02 0.92 0.00 0.00 96 N 8.52 4.30 0.00 2.84 2.87 0.00 0.00 7.08 6.56 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 97 K 8.18 4.04 0.00 1.95 1.85 0.00 1.65 0.00 0.00 1.64 0.00 0.00 3.03 0.00 0.00 3.31 0.00 0.00 0.00 0.00 1.46 1.83 7.81 98 L 7.75 4.13 0.00 1.81 1.68 0.93 1.03 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 99 G 9.16 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 0.00 100 A 7.98 4.07 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 0.00 101 L 7.87 4.00 0.00 1.88 1.79 0.91 0.50 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 0.00 102 K 8.56 3.92 0.00 1.88 1.79 0.00 1.71 0.00 0.00 1.65 0.00 0.00 2.93 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.67 1.47 7.81 103 T 7.47 3.93 4.45 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 1.24 0.00 0.00 104 N 8.49 4.52 0.00 2.79 2.93 0.00 0.00 6.98 7.00 0.00 0.00 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 F 7.51 4.68 0.00 3.22 3.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 E 8.33 3.99 0.00 2.25 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 2.43 2.68 0.00 107 T 7.75 3.93 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 0.00 108 E 8.12 4.07 0.00 1.98 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.33 0.00 109 W 8.42 3.78 0.00 2.95 2.99 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 0.00 110 N 6.89 4.00 0.00 2.76 2.81 0.00 0.00 7.11 7.52 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 0.00 111 L 7.42 5.32 0.00 1.78 1.71 0.84 0.52 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 0.00 112 Q 7.45 4.25 0.00 2.13 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.68 0.00 0.00 0.00 0.00 0.00 1.68 1.74 0.00