NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4226 8.3049 120.3601 55.2163 34.0199 175.4590 2 Q 4.4937 7.8438 114.9892 53.8879 31.4649 172.6914 3 D 5.1145 8.1782 118.3754 51.9697 45.7107 176.1962 4 W 4.6346 8.8823 127.3639 61.0878 30.4179 178.1879 5 A 3.8500 8.0585 120.5123 55.1135 17.7331 179.6988 6 T 3.7298 7.7573 113.8972 66.8447 68.7525 176.7392 7 F 3.9520 8.0675 121.9362 60.6992 39.2588 177.0929 8 K 3.4683 7.5940 119.5446 59.3900 31.8257 178.8631 9 K 4.0276 7.3788 116.5308 58.2473 32.0748 179.3811 10 K 4.1268 7.7794 118.8004 58.9877 32.5611 177.5373 11 H 5.2920 7.9256 113.2014 54.2659 30.7181 173.5608 12 L 4.9003 7.2853 119.5237 53.2281 41.9455 175.9980 13 T 4.5922 8.2800 111.6588 60.4276 71.7927 173.7641 14 D 5.1123 8.3650 121.4919 54.0160 41.4225 176.2636 15 T 4.7434 7.5329 112.9563 62.4257 72.3967 173.7284 16 W 4.3504 8.7662 135.0000 60.2940 30.9818 176.1389 17 D 4.4412 7.9292 117.7374 53.0191 41.0518 175.8948 18 V 4.2283 8.0233 123.1115 61.0478 33.9466 175.1030 19 D 4.6497 8.1043 123.6516 53.3182 40.0584 177.7351 20 C 4.0888 8.3377 122.4296 58.8387 41.0445 175.8809 21 D 4.1232 8.0790 117.2522 55.9886 41.0350 175.8011 22 N 4.7138 7.9781 115.4170 54.6821 40.4584 175.8349 23 L 4.7570 7.2708 118.9396 55.9872 41.9907 178.3733 24 M 4.0211 8.0971 119.0030 58.0977 31.9346 175.7800 25 P 4.6725 0.0000 0.0000 63.6358 32.3773 176.1025 26 T 4.3595 7.8964 116.9859 63.0292 69.8631 174.8885 27 S 4.3663 8.4341 115.2854 60.2130 62.7876 174.9400 28 L 4.0955 7.9736 121.2164 57.6232 41.3656 177.2724 29 F 4.2762 8.3639 116.3277 57.8962 39.7486 175.8443 30 D 4.6010 9.2301 117.7472 55.2348 40.3122 172.1074 31 C 3.9038 8.7771 112.8762 57.2703 37.1070 172.7874 32 K 4.4430 7.9849 122.5099 55.4630 33.7770 177.3329 33 D 4.7019 8.7340 118.8646 56.2243 40.4383 176.4229 34 K 5.2038 7.7370 114.6712 55.9595 35.2794 173.8612 35 N 4.8138 8.7554 118.9081 52.3784 43.4803 173.3444 36 T 4.4318 7.5371 117.8591 61.9327 72.2816 173.7567 37 F 5.3621 8.4858 125.7235 56.1540 41.9404 174.7894 38 I 5.1355 8.7702 119.6247 59.7681 41.5161 173.8202 39 Y 4.8274 8.9979 131.0348 56.7684 38.1381 173.9846 40 S 4.2512 7.5622 119.4777 57.6293 66.4857 175.0172 41 L 4.4589 7.8018 122.0820 52.9650 42.7182 176.3906 42 P 4.6367 0.0000 0.0000 64.8616 32.2319 178.9255 43 G 3.5549 8.1388 109.1720 48.1743 0.0000 174.1204 44 P 4.3159 0.0000 0.0000 64.7622 31.8674 178.4728 45 V 3.6643 7.5664 118.2109 65.9220 31.6046 178.0993 46 K 3.6387 8.2298 119.0299 58.9411 31.9143 178.4611 47 A 3.9658 7.9074 121.3399 55.0389 17.9332 179.5139 48 L 3.9441 7.5076 116.4618 58.0613 41.9833 178.4607 49 C 4.5777 7.9603 114.9732 57.1062 40.5277 172.5685 50 R 4.7648 6.8734 120.7404 57.8347 28.4683 174.3103 51 G 3.6385 8.4356 120.0957 45.4742 0.0000 172.3710 52 V 3.3777 7.7990 122.2075 62.6818 32.2587 176.2476 53 I 3.9844 7.5397 125.9735 61.5848 39.7368 175.2565 54 F 5.1861 6.1193 113.9904 54.6435 41.1674 175.1688 55 S 4.8604 8.7479 115.2113 58.7678 63.0667 174.0296 56 A 4.7831 8.9256 125.1190 50.8823 23.1276 174.4419 57 D 5.1619 8.6528 120.0975 53.1185 42.1658 176.3065 58 V 4.5352 8.8698 123.4996 60.9181 35.3579 173.8995 59 L 5.3634 8.3235 125.4065 52.4466 43.8249 176.5027 60 S 4.3454 8.8145 119.3736 59.1642 62.7098 174.5981 61 N 4.5085 9.0314 120.3722 54.6663 37.9722 175.4300 62 S 4.4392 7.7546 114.0938 56.7592 64.3751 173.0455 63 E 4.1953 8.0536 124.1103 55.6697 30.3366 175.6736 64 F 5.1604 8.2560 121.9099 55.3968 43.6847 173.9492 65 Y 4.5430 9.0323 117.1316 58.2183 39.4478 175.1246 66 L 5.8269 9.8865 122.3480 52.1582 45.4984 175.5183 67 A 4.8085 8.9976 126.8251 50.5767 20.0782 175.5215 68 E 4.5423 8.9423 119.8587 56.0301 32.9235 174.9399 69 C 5.3296 8.6082 116.8901 54.3260 38.1996 172.6230 70 N 5.2592 8.6278 123.2304 51.6057 40.8830 173.7785 71 V 4.0941 8.5822 127.0375 62.3970 31.8142 175.9599 72 K 4.2603 8.5186 128.6215 55.9662 31.6373 175.5938 73 P 4.4258 0.0000 0.0000 63.3164 32.3281 176.1064 74 R 4.1086 8.6021 115.5762 57.0439 27.5093 176.3651 75 K 4.5903 7.3586 115.7471 53.9820 35.8450 175.6138 76 P 4.3641 0.0000 0.0000 63.0640 30.1197 175.6127 77 C 4.0389 8.2463 122.6977 58.0459 37.1791 171.6866 78 K 4.6032 7.3764 118.1833 54.6220 35.2867 175.5281 79 Y 5.3131 8.5845 122.3989 56.6561 40.3481 175.1461 80 K 4.6501 8.5826 120.3495 54.5592 35.5864 175.6690 81 L 4.6203 8.5268 125.1217 54.3914 42.8600 176.4141 82 K 4.5938 8.7562 124.1008 54.6558 35.3959 174.9142 83 K 5.6546 8.9178 126.7455 55.3725 34.9732 175.4403 84 S 4.7073 8.4332 115.2764 58.1236 66.5656 173.1451 85 S 5.1427 8.0263 115.0768 56.0855 65.5044 173.3053 86 N 4.3335 8.3270 121.7106 53.6938 42.6007 172.8626 87 R 4.9689 8.1316 119.7008 54.8138 33.2781 175.4316 88 I 4.8218 8.8823 112.6751 59.6826 41.4189 173.3276 89 C 5.2540 8.8079 125.9487 55.2532 44.4621 172.3756 90 I 5.1065 8.8094 119.4231 59.0774 41.5577 174.3309 91 R 4.7916 8.6679 124.4542 55.6857 31.1297 174.0752 92 C 5.4170 9.3741 127.8913 54.9593 41.7248 172.2442 93 E 5.1723 8.6224 121.4334 56.7142 32.9313 174.7774 94 H 3.8343 9.0444 117.5604 56.8777 27.1755 174.5722 95 E 3.7094 8.1824 116.0550 56.5524 27.1514 174.8653 96 L 3.5410 7.3836 119.7062 53.6790 42.3591 173.1009 97 P 5.1935 0.0000 0.0000 61.9485 30.7430 176.2028 98 V 4.3045 8.3094 117.1829 62.1691 32.7979 175.9578 99 H 5.2876 8.0868 115.6836 53.8425 32.7715 172.7547 100 F 4.8427 8.9516 122.6652 56.9448 39.7263 175.2615 101 A 4.0294 8.8098 129.6902 53.8151 18.7903 177.2882 102 G 3.8888 6.0564 100.8008 45.8187 0.0000 171.5779 103 V 4.5673 8.0876 118.1359 60.7866 33.5888 173.5548 104 G 4.0561 8.2099 114.5383 45.3072 0.0000 173.6315 105 I 4.4442 7.2646 120.2968 58.5219 40.2894 175.9632 106 C 4.8142 8.3913 121.4065 54.0541 45.1495 172.0668 107 P 4.4347 0.0000 0.0000 63.0334 31.1191 176.1201 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 4.42 0.00 2.09 2.24 0.00 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.56 0.00 2 Q 7.84 4.49 0.00 2.01 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.91 6.70 0.00 0.00 0.00 0.00 0.00 2.31 2.52 0.00 3 D 8.18 5.11 0.00 2.78 2.64 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 4 W 8.88 4.63 0.00 3.35 3.12 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 0.00 0.00 0.00 5 A 8.06 3.85 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 6 T 7.76 3.73 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 1.19 0.00 0.00 7 F 8.07 3.95 0.00 3.28 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 8 K 7.59 3.47 0.00 1.47 1.67 0.00 1.34 0.00 0.00 1.51 0.00 0.00 2.88 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.26 1.22 7.81 9 K 7.38 4.03 0.00 1.58 1.77 0.00 1.66 0.00 0.00 1.64 0.00 0.00 2.95 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.41 1.37 7.81 10 K 7.78 4.13 0.00 1.68 1.46 0.00 1.60 0.00 0.00 1.60 0.00 0.00 2.82 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.16 1.30 7.81 11 H 7.93 5.29 0.00 1.40 2.93 0.00 5.80 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 12 L 7.29 4.90 0.00 1.59 1.55 0.50 1.32 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 T 8.28 4.59 4.33 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 0.56 0.00 0.00 14 D 8.37 5.11 0.00 2.66 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 15 T 7.53 4.74 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 1.32 0.00 0.00 16 W 8.77 4.35 0.00 2.70 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 D 7.93 4.44 0.00 2.59 2.48 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 18 V 8.02 4.23 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 0.36 0.00 0.00 0.73 0.00 0.00 19 D 8.10 4.65 0.00 2.68 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 20 C 8.34 4.09 0.00 2.90 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 21 D 8.08 4.12 0.00 2.64 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 N 7.98 4.71 0.00 2.67 2.78 0.00 0.00 6.99 7.78 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 23 L 7.27 4.76 0.00 1.56 1.76 0.97 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 24 M 8.10 4.02 0.00 2.02 2.28 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.43 0.00 25 P 0.00 4.67 0.00 2.27 2.13 0.00 3.84 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 1.99 2.12 0.00 26 T 7.90 4.36 4.37 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 1.26 0.00 0.00 27 S 8.43 4.37 0.00 3.84 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 28 L 7.97 4.10 0.00 1.58 1.62 0.81 0.37 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 29 F 8.36 4.28 0.00 3.53 3.22 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 30 D 9.23 4.60 0.00 2.75 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 31 C 8.78 3.90 0.00 3.13 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 32 K 7.98 4.44 0.00 2.31 1.97 0.00 1.89 0.00 0.00 1.90 0.00 0.00 2.95 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.56 1.62 7.81 33 D 8.73 4.70 0.00 2.75 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 34 K 7.74 5.20 0.00 1.72 1.83 0.00 1.53 0.00 0.00 1.59 0.00 0.00 2.89 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.32 1.42 7.81 35 N 8.76 4.81 0.00 2.64 1.99 0.00 0.00 7.25 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 36 T 7.54 4.43 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 37 F 8.49 5.36 0.00 3.19 2.87 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 38 I 8.77 5.14 2.05 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.86 1.01 0.00 0.00 39 Y 9.00 4.83 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 40 S 7.56 4.25 0.00 3.67 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 41 L 7.80 4.46 0.00 1.74 1.54 0.81 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 42 P 0.00 4.64 0.00 2.52 2.54 0.00 3.71 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 2.15 2.02 0.00 43 G 8.14 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 P 0.00 4.32 0.00 2.26 2.21 0.00 3.76 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.01 0.00 45 V 7.57 3.66 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 1.06 0.00 0.00 0.72 0.00 0.00 46 K 8.23 3.64 0.00 1.60 1.72 0.00 1.48 0.00 0.00 1.32 0.00 0.00 2.13 0.00 0.00 2.59 0.00 0.00 0.00 0.00 1.01 0.43 7.81 47 A 7.91 3.97 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 48 L 7.51 3.94 0.00 1.82 1.73 1.09 0.94 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 49 C 7.96 4.58 0.00 2.81 2.76 0.00 0.00 0.00 0.00 0.00 0.00 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 R 6.87 4.76 0.00 1.75 1.81 0.00 3.08 0.00 0.00 3.03 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.47 0.00 51 G 8.44 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 52 V 7.80 3.38 1.85 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 0.63 0.00 0.00 0.81 0.00 0.00 53 I 7.54 3.98 1.72 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.78 0.86 0.00 0.00 54 F 6.12 5.19 0.00 3.10 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 55 S 8.75 4.86 0.00 3.87 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 56 A 8.93 4.78 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 57 D 8.65 5.16 0.00 2.57 2.60 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 58 V 8.87 4.54 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 1.08 0.00 0.00 0.89 0.00 0.00 59 L 8.32 5.36 0.00 1.53 1.55 0.94 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 60 S 8.81 4.35 0.00 4.26 4.17 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 61 N 9.03 4.51 0.00 2.85 2.99 0.00 0.00 6.11 7.68 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 62 S 7.75 4.44 0.00 3.85 3.29 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 0.00 0.00 0.00 0.00 63 E 8.05 4.20 0.00 1.64 1.70 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 2.18 2.18 0.00 64 F 8.26 5.16 0.00 3.04 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 65 Y 9.03 4.54 0.00 3.10 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 L 9.89 5.83 0.00 1.63 1.71 1.11 1.26 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 67 A 9.00 4.81 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 68 E 8.94 4.54 0.00 1.97 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.33 0.00 69 C 8.61 5.33 0.00 1.87 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 70 N 8.63 5.26 0.00 2.77 2.70 0.00 0.00 6.81 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 71 V 8.58 4.09 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 0.61 0.00 0.00 0.28 0.00 0.00 72 K 8.52 4.26 0.00 1.67 1.72 0.00 1.74 0.00 0.00 1.74 0.00 0.00 2.95 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.48 1.40 7.81 73 P 0.00 4.43 0.00 2.20 2.16 0.00 3.83 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 2.06 1.98 0.00 74 R 8.60 4.11 0.00 1.97 2.04 0.00 3.30 0.00 0.00 3.21 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.57 0.00 75 K 7.36 4.59 0.00 1.99 1.59 0.00 1.67 0.00 0.00 1.72 0.00 0.00 3.02 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.33 1.46 7.81 76 P 0.00 4.36 0.00 2.14 2.06 0.00 3.88 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.95 0.00 77 C 8.25 4.04 0.00 3.01 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 78 K 7.38 4.60 0.00 1.56 1.63 0.00 1.62 0.00 0.00 1.82 0.00 0.00 2.99 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.34 1.32 7.81 79 Y 8.58 5.31 0.00 2.81 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 80 K 8.58 4.65 0.00 1.80 1.66 0.00 1.66 0.00 0.00 1.63 0.00 0.00 2.81 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.34 1.52 7.81 81 L 8.53 4.62 0.00 1.40 1.43 0.85 0.78 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 82 K 8.76 4.59 0.00 1.88 1.62 0.00 1.48 0.00 0.00 1.68 0.00 0.00 2.95 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.32 1.42 7.81 83 K 8.92 5.65 0.00 2.62 1.81 0.00 1.06 0.00 0.00 2.38 0.00 0.00 2.92 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.51 1.69 7.81 84 S 8.43 4.71 0.00 3.92 4.05 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 85 S 8.03 5.14 0.00 3.49 3.58 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 86 N 8.33 4.33 0.00 2.81 2.70 0.00 0.00 7.21 7.68 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 87 R 8.13 4.97 0.00 1.82 2.05 0.00 3.09 0.00 0.00 3.59 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.57 0.00 88 I 8.88 4.82 2.19 0.00 0.00 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 1.45 1.06 1.32 0.00 0.00 89 C 8.81 5.25 0.00 2.90 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 90 I 8.81 5.11 1.98 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 1.01 1.20 0.00 0.00 91 R 8.67 4.79 0.00 1.99 1.95 0.00 3.16 0.00 0.00 3.16 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.61 0.00 92 C 9.37 5.42 0.00 2.86 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 93 E 8.62 5.17 0.00 1.95 2.07 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 2.21 2.13 0.00 94 H 9.04 3.83 0.00 3.32 3.35 0.00 5.79 0.00 0.00 0.00 0.00 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 E 8.18 3.71 0.00 2.05 1.85 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 2.18 2.13 0.00 96 L 7.38 3.54 0.00 1.77 1.30 0.97 0.85 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 97 P 0.00 5.19 0.00 1.80 1.94 0.00 2.20 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.58 0.00 98 V 8.31 4.30 2.22 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 0.88 0.00 0.00 0.95 0.00 0.00 99 H 8.09 5.29 0.00 3.17 3.25 0.00 5.59 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 F 8.95 4.84 0.00 3.03 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 0.00 101 A 8.81 4.03 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 0.00 102 G 6.06 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 0.00 0.00 0.00 103 V 8.09 4.57 2.38 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 0.88 0.00 0.00 1.15 0.00 0.00 104 G 8.21 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 0.00 0.00 0.00 105 I 7.26 4.44 1.88 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.71 0.91 0.00 0.00 106 C 8.39 4.81 0.00 2.84 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 0.00 107 P 0.00 4.43 0.00 2.22 2.02 0.00 3.83 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.96 0.00