NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 M 4.5309 8.3044 120.2866 55.2876 33.9782 173.9510 3 V 4.2275 8.0468 121.4570 59.8085 33.7946 172.9138 4 W 4.6587 9.1690 135.0000 57.5845 31.5789 174.8714 5 T 4.1927 8.2926 123.9824 61.4825 67.0541 172.6013 6 P 4.5367 0.0000 0.0000 63.2442 32.2616 175.6254 7 V 4.0910 7.4737 119.8101 62.5503 32.8845 175.2714 8 N 4.2048 8.6673 125.1634 54.9478 36.1354 173.6629 9 N 4.8726 7.5929 108.7052 52.9431 40.0481 174.1979 10 K 4.1349 8.3424 116.5476 56.5420 32.8605 176.8231 11 M 4.8611 8.3372 121.1748 53.8942 35.1363 175.2667 12 F 4.5274 8.2954 119.9060 57.8498 40.6060 175.0812 13 E 3.4792 8.3260 122.4413 57.0917 28.0339 175.4010 14 T 3.8627 8.3640 121.7166 66.5288 68.9706 174.2324 15 F 4.5205 9.0252 124.0486 57.6308 36.6210 176.4314 16 S 4.4819 8.2981 114.9815 60.3891 62.9840 174.5039 17 Y 4.3909 8.2747 117.2895 58.1981 38.2737 175.1660 18 L 4.6742 7.5854 119.9091 52.1741 43.5511 174.5252 19 P 4.4100 0.0000 0.0000 61.9392 31.7623 174.9992 20 P 4.2853 0.0000 0.0000 62.8718 31.7626 176.3722 21 L 3.9804 8.3369 122.7831 54.7400 42.1436 177.9573 22 T 4.2370 8.1940 114.1056 61.1106 71.1046 175.2667 23 D 4.3396 8.5405 120.8083 57.5741 40.7472 178.7572 24 E 3.9112 8.0826 119.2530 59.3976 29.7545 178.7935 25 Q 3.9278 8.0199 118.1611 58.7728 28.6980 178.6566 26 I 3.6777 8.0749 121.0074 64.3629 37.1063 178.1859 27 A 4.0235 8.2769 121.5213 55.2384 18.2370 179.5298 28 A 3.9573 8.0677 119.1706 55.4230 18.4333 179.9346 29 Q 4.0879 8.0894 116.5203 59.0992 28.8299 179.0632 30 V 3.7446 8.1976 119.3877 66.2281 31.5352 177.6792 31 D 4.4383 8.5243 118.9071 57.5767 40.7328 178.3065 32 Y 4.1303 8.0430 119.7028 60.7082 38.9396 177.8802 33 I 3.9192 7.9963 120.8080 64.6630 37.2983 178.5921 34 V 3.5325 7.9033 118.5130 65.9867 31.1810 177.8926 35 A 3.9218 8.0877 119.6611 54.6056 18.2473 178.3642 36 N 4.0667 7.1599 111.8512 52.1666 38.7173 175.7963 37 G 3.7727 7.3068 108.3097 46.0313 0.0000 174.0453 38 W 4.9591 7.4759 118.7924 56.1523 30.6320 176.1509 39 I 4.5242 8.9451 123.2822 59.3109 38.0346 173.9677 40 P 4.9487 0.0000 0.0000 63.1120 33.0259 174.7941 41 C 4.9993 8.9466 120.3272 58.4757 35.6649 172.3433 42 L 5.3458 8.7434 123.8478 53.1804 44.4634 175.1930 43 E 5.5930 9.2452 121.3619 54.7781 33.9422 174.6687 44 F 5.6816 9.2058 116.9862 55.6415 42.2009 173.2015 45 A 4.4761 8.2827 120.0986 50.1262 22.5739 176.2623 46 E 4.2672 8.6308 118.8983 55.7339 30.4740 177.6573 47 A 4.2906 8.8816 122.9583 55.8975 18.3724 179.8339 48 D 4.5212 8.1307 113.0821 56.3482 41.0920 177.2214 49 K 4.5749 7.9549 117.2648 56.0362 32.4812 176.7378 50 A 3.9653 7.5646 123.9300 53.5248 19.2045 178.1889 51 Y 4.6504 7.4299 111.3120 55.5475 40.3243 175.7359 52 V 3.8654 8.3113 122.2491 63.8817 32.0024 175.2362 53 S 4.7522 8.7928 119.3878 57.6239 66.2844 173.7534 54 N 5.2041 8.5623 114.3205 52.5915 39.5785 176.3315 55 E 3.9399 8.3162 118.9185 59.8238 29.3328 179.1712 56 S 4.0113 8.8332 115.4429 60.5572 62.8695 176.0526 57 A 2.5800 7.6876 123.4488 53.6578 17.7179 179.0414 58 I 3.5599 6.9140 116.7125 63.7959 38.0151 177.1096 59 R 4.2945 7.6031 116.3302 55.6276 30.5031 176.2015 60 F 5.0972 7.1704 118.0652 55.8451 41.4079 177.2788 61 G 4.0005 8.2220 115.9321 46.2517 0.0000 175.1385 62 S 4.6009 8.4309 113.5763 58.7349 62.1862 174.5136 63 V 4.4387 7.2853 107.3820 61.1436 33.1726 177.7351 64 S 4.4813 8.1954 115.5340 59.7721 63.5401 173.5774 65 C 4.0180 8.1174 118.9398 61.6506 27.9857 173.1505 66 L 3.6235 8.4549 122.8431 55.5884 39.0373 173.1202 67 Y 4.4218 7.8584 119.5369 56.0118 39.9093 174.6032 68 Y 4.8713 7.2749 123.3091 56.2734 42.3308 174.7593 69 D 4.4951 8.8567 123.2246 55.2563 41.7491 177.0210 70 N 4.4417 8.8947 116.5310 54.1377 36.0612 175.9767 71 R 3.9451 7.9369 118.8166 59.2797 30.3547 177.1412 72 Y 4.3962 7.7106 114.8841 57.8263 38.4161 175.0425 73 W 5.0482 8.7085 124.3908 55.4985 32.6197 174.5109 74 T 4.3719 8.0898 117.0040 62.4524 69.6474 174.5559 75 M 4.6564 8.5346 126.5196 55.2971 33.2425 175.2964 76 W 4.8102 9.5894 135.0000 56.0139 31.1950 176.9315 77 K 3.4524 8.5326 129.2985 57.5896 30.4266 178.1949 78 L 4.9170 8.2486 125.2381 52.6842 45.0999 174.0536 79 P 4.3655 0.0000 0.0000 63.4433 32.1290 177.4256 80 M 4.2912 8.5883 122.7726 53.7636 30.4250 175.4876 81 F 4.4875 7.4185 119.0221 58.6918 40.0291 176.4457 82 G 3.9713 9.1248 112.6935 45.4702 0.0000 172.9623 83 C 4.2542 7.8420 120.4233 59.7440 31.5898 173.1550 84 R 4.5565 8.6566 124.8221 55.5878 30.8702 174.7074 85 D 4.7838 7.7965 117.9871 51.3445 42.9150 174.4580 86 P 4.3282 0.0000 0.0000 65.8743 31.2494 178.5806 87 M 4.1613 8.3944 117.7419 58.2078 31.8396 178.6957 88 Q 4.0138 7.9249 118.6280 58.8617 28.9017 178.9962 89 V 3.6055 7.7599 118.6458 66.1318 31.8163 177.8524 90 L 4.0387 7.8789 118.5589 58.0054 41.4562 179.8394 91 R 3.9990 8.3110 118.0711 59.2172 29.8819 178.9552 92 E 4.1773 8.2131 118.4283 59.1037 29.4604 179.3151 93 I 3.5372 7.8376 120.1094 64.2553 37.1964 178.4772 94 V 3.4826 7.6278 118.4745 65.9028 31.3613 177.8984 95 A 3.9328 7.9362 120.3466 55.2404 18.2615 179.1497 96 C 2.0000 7.5734 117.6598 62.0879 30.9412 175.9667 97 T 3.7176 7.5036 111.2787 64.4282 68.0172 176.4551 98 K 3.8496 7.7271 121.6674 59.2703 32.3079 178.4468 99 A 3.9659 7.6200 120.0212 53.4864 19.9997 177.6534 100 F 4.7492 7.7801 115.4794 55.0608 39.1046 174.0565 101 P 4.3988 0.0000 0.0000 64.4076 31.8279 177.8798 102 D 4.6274 8.0655 116.4505 53.9233 41.2187 175.5882 103 A 4.7657 7.4004 120.9523 50.4771 21.1463 177.1044 104 Y 4.1916 8.5785 117.7888 57.9599 39.4418 175.3416 105 V 5.2450 8.9668 123.0858 61.1502 35.1948 174.3025 106 R 4.9823 9.5150 123.9529 54.2543 33.0040 173.8522 107 L 4.8124 8.1594 123.5728 53.9773 43.6954 175.7210 108 V 4.8129 8.7034 118.4747 59.4559 36.3050 174.2393 109 A 4.9020 8.0315 121.7611 50.4018 22.8045 175.1594 110 F 5.2250 9.0031 119.6457 55.6782 42.7245 174.1278 111 D 5.3869 8.8417 122.6799 52.6643 42.4625 176.5001 112 N 4.7456 9.1809 123.1261 54.1779 38.3257 176.2093 113 Q 4.2273 8.7482 118.8712 58.7139 29.1411 177.5052 114 K 4.0329 8.3096 114.9878 57.0084 32.9538 176.5309 115 Q 3.4564 8.0449 118.2764 55.9630 26.9310 172.4603 116 V 4.5216 7.8239 117.6591 60.0166 35.0393 174.2552 117 Q 4.3306 8.6340 122.9008 56.3484 29.3964 175.4508 118 I 4.2980 8.3310 124.1000 60.9503 40.2461 174.5593 119 M 4.7395 7.0103 117.5915 54.1524 34.8207 173.8882 120 G 4.7196 8.3188 103.9676 46.8874 0.0000 172.5792 121 F 5.0817 7.1781 117.1169 55.2443 41.2398 172.9180 122 L 4.4957 8.7920 123.0323 55.5750 42.0117 176.7863 123 V 4.5127 9.0618 118.3631 61.5154 33.9316 175.6973 124 Q 4.6304 7.8427 121.2614 54.3554 32.4581 173.3413 125 R 4.3758 8.1657 121.4789 52.9364 32.7634 173.6046 126 P 4.2417 0.0000 0.0000 62.7103 31.7966 177.6526 127 K 4.0816 8.4144 119.4464 59.4682 32.1669 178.5056 128 T 4.0463 7.8062 106.9426 62.7568 69.2004 174.6070 129 A 4.2369 7.7248 126.3601 52.8408 18.5797 177.2898 130 R 4.6711 8.8240 120.3285 55.9415 31.7083 175.3864 131 D 4.9832 8.4418 117.0860 52.7597 39.7349 175.4919 132 F 5.4184 7.7318 112.2024 54.9676 41.1216 173.3063 133 Q 4.4562 8.2901 119.6121 52.8738 31.4487 174.2364 134 P 4.3714 0.0000 0.0000 62.4306 32.4887 176.9316 135 A 3.9515 8.9197 123.6782 55.6736 18.1076 179.3237 136 N 4.6360 8.0514 109.0549 53.9377 37.8375 175.5092 137 K 4.3785 7.6897 117.7522 56.3470 32.7189 177.5287 138 R 3.5430 7.6547 120.3868 57.7925 30.1098 176.6998 139 S 5.0889 7.4811 110.5392 56.2872 65.9784 174.2369 140 V 3.9754 8.6336 115.3128 61.6675 31.8222 175.5832 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 2 M 8.30 4.53 0.00 1.98 2.15 0.00 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.58 0.00 3 V 8.05 4.23 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 0.93 0.00 0.00 0.97 0.00 0.00 4 W 9.17 4.66 0.00 3.47 3.03 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 0.00 0.00 0.00 5 T 8.29 4.19 4.09 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 1.13 0.00 0.00 6 P 0.00 4.54 0.00 2.24 2.19 0.00 3.78 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.97 0.00 7 V 7.47 4.09 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 0.78 0.00 0.00 0.91 0.00 0.00 8 N 8.67 4.20 0.00 2.88 2.89 0.00 0.00 6.52 6.92 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 9 N 7.59 4.87 0.00 2.67 2.69 0.00 0.00 7.31 6.68 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 10 K 8.34 4.13 0.00 1.97 1.58 0.00 0.61 0.00 0.00 0.69 0.00 0.00 2.58 0.00 0.00 2.44 0.00 0.00 0.00 0.00 1.29 1.37 7.81 11 M 8.34 4.86 0.00 2.11 2.12 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.62 0.00 12 F 8.30 4.53 0.00 3.10 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 13 E 8.33 3.48 0.00 2.17 1.72 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 2.20 2.13 0.00 14 T 8.36 3.86 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 0.14 0.00 0.00 15 F 9.03 4.52 0.00 3.31 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 16 S 8.30 4.48 0.00 4.14 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 0.00 17 Y 8.27 4.39 0.00 3.03 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 18 L 7.59 4.67 0.00 1.86 1.61 0.87 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 19 P 0.00 4.41 0.00 2.03 2.00 0.00 3.70 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.14 0.00 20 P 0.00 4.29 0.00 2.05 2.04 0.00 3.71 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.20 0.00 21 L 8.34 3.98 0.00 1.58 1.48 0.29 0.51 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 22 T 8.19 4.24 4.22 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 1.18 0.00 0.00 23 D 8.54 4.34 0.00 2.70 2.77 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 24 E 8.08 3.91 0.00 2.01 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 2.35 2.39 0.00 25 Q 8.02 3.93 0.00 2.27 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.58 0.00 0.00 0.00 0.00 0.00 2.26 2.32 0.00 26 I 8.07 3.68 2.05 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.68 1.08 0.00 0.00 27 A 8.28 4.02 1.39 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 0.00 0.00 0.00 28 A 8.07 3.96 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 29 Q 8.09 4.09 0.00 2.47 2.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.75 0.00 0.00 0.00 0.00 0.00 2.37 1.90 0.00 30 V 8.20 3.74 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 1.10 0.00 0.00 1.10 0.00 0.00 31 D 8.52 4.44 0.00 2.98 2.77 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 32 Y 8.04 4.13 0.00 3.24 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 33 I 8.00 3.92 2.17 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.36 1.08 0.00 0.00 34 V 7.90 3.53 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 0.96 0.00 0.00 0.99 0.00 0.00 35 A 8.09 3.92 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 36 N 7.16 4.07 0.00 1.44 1.42 0.00 0.00 7.03 7.38 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 37 G 7.31 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 0.00 0.00 0.00 38 W 7.48 4.96 0.00 3.41 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 39 I 8.95 4.52 2.13 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.03 0.82 0.00 0.00 40 P 0.00 4.95 0.00 2.21 2.20 0.00 3.65 0.00 0.00 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.13 0.00 41 C 8.95 5.00 0.00 3.13 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 42 L 8.74 5.35 0.00 1.87 1.63 0.88 0.83 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 43 E 9.25 5.59 0.00 2.02 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 2.36 2.33 0.00 44 F 9.21 5.68 0.00 3.06 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 45 A 8.28 4.48 -0.32 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 46 E 8.63 4.27 0.00 2.17 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 0.00 2.29 2.27 0.00 47 A 8.88 4.29 1.49 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 48 D 8.13 4.52 0.00 2.70 2.77 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 49 K 7.95 4.57 0.00 1.59 1.65 0.00 1.69 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.33 1.42 7.81 50 A 7.56 3.97 0.56 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 51 Y 7.43 4.65 0.00 2.90 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 52 V 8.31 3.87 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 0.69 0.00 0.00 0.79 0.00 0.00 53 S 8.79 4.75 0.00 4.08 3.98 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 54 N 8.56 5.20 0.00 2.76 2.84 0.00 0.00 6.57 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 55 E 8.32 3.94 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 2.38 0.00 56 S 8.83 4.01 0.00 3.95 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 57 A 7.69 2.58 1.11 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 58 I 6.91 3.56 1.78 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.81 0.89 0.00 0.00 59 R 7.60 4.29 0.00 1.89 2.01 0.00 3.19 0.00 0.00 3.22 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.58 0.00 60 F 7.17 5.10 0.00 3.01 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 61 G 8.22 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 62 S 8.43 4.60 0.00 3.86 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 63 V 7.29 4.44 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 0.66 0.00 0.00 0.46 0.00 0.00 64 S 8.20 4.48 0.00 4.10 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 0.00 65 C 8.12 4.02 0.00 2.96 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 66 L 8.45 3.62 0.00 1.78 1.77 0.94 0.98 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 67 Y 7.86 4.42 0.00 2.89 3.03 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 0.00 0.00 0.00 68 Y 7.27 4.87 0.00 2.80 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 69 D 8.86 4.50 0.00 2.89 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 70 N 8.89 4.44 0.00 3.06 3.24 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 71 R 7.94 3.95 0.00 1.51 1.68 0.00 3.07 0.00 0.00 3.25 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.56 0.00 72 Y 7.71 4.40 0.00 3.06 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 73 W 8.71 5.05 0.00 3.08 3.18 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 74 T 8.09 4.37 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 0.93 0.00 0.00 75 M 8.53 4.66 0.00 2.08 2.03 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.76 0.00 76 W 9.59 4.81 0.00 3.69 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 77 K 8.53 3.45 0.00 1.70 0.82 0.00 1.73 0.00 0.00 1.53 0.00 0.00 2.69 0.00 0.00 2.43 0.00 0.00 0.00 0.00 0.75 0.21 7.81 78 L 8.25 4.92 0.00 1.59 1.56 1.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 79 P 0.00 4.37 0.00 0.65 1.82 0.00 3.61 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 2.11 0.00 80 M 8.59 4.29 0.00 2.04 2.01 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.53 0.00 81 F 7.42 4.49 0.00 3.10 2.96 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 0.00 0.00 0.00 82 G 9.12 3.97 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 0.00 0.00 0.00 83 C 7.84 4.25 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 84 R 8.66 4.56 0.00 1.81 1.87 0.00 3.21 0.00 0.00 3.16 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.77 0.00 85 D 7.80 4.78 0.00 2.72 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 86 P 0.00 4.33 0.00 2.22 2.12 0.00 3.67 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.20 0.00 87 M 8.39 4.16 0.00 2.06 2.23 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.74 0.00 88 Q 7.92 4.01 0.00 2.30 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.81 0.00 0.00 0.00 0.00 0.00 2.42 2.55 0.00 89 V 7.76 3.61 2.26 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 1.11 0.00 0.00 0.98 0.00 0.00 90 L 7.88 4.04 0.00 1.93 1.72 0.95 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 91 R 8.31 4.00 0.00 2.04 2.01 0.00 3.15 0.00 0.00 3.18 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.87 0.00 92 E 8.21 4.18 0.00 2.25 2.17 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 2.62 2.65 0.00 93 I 7.84 3.54 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 1.36 0.98 0.86 0.00 0.00 94 V 7.63 3.48 2.21 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 0.97 0.00 0.00 0.99 0.00 0.00 95 A 7.94 3.93 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 96 C 7.57 2.00 0.00 1.23 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 0.00 0.00 0.00 0.00 97 T 7.50 3.72 4.31 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 1.13 0.00 0.00 98 K 7.73 3.85 0.00 1.81 1.93 0.00 1.76 0.00 0.00 1.68 0.00 0.00 2.99 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.37 1.39 7.81 99 A 7.62 3.97 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 0.00 100 F 7.78 4.75 0.00 2.91 2.77 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 0.00 101 P 0.00 4.40 0.00 2.12 2.12 0.00 3.26 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.88 0.00 102 D 8.07 4.63 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 0.00 103 A 7.40 4.77 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 0.00 104 Y 8.58 4.19 0.00 2.60 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 0.00 105 V 8.97 5.25 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 0.78 0.00 0.00 0.90 0.00 0.00 106 R 9.51 4.98 0.00 1.78 1.85 0.00 2.32 0.00 0.00 2.25 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.34 0.00 107 L 8.16 4.81 0.00 1.49 0.71 0.85 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 108 V 8.70 4.81 1.59 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 0.42 0.00 0.00 0.55 0.00 0.00 109 A 8.03 4.90 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 0.00 110 F 9.00 5.22 0.00 3.00 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 0.00 111 D 8.84 5.39 0.00 2.32 2.42 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 0.00 112 N 9.18 4.75 0.00 2.93 3.05 0.00 0.00 6.31 7.39 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 0.00 113 Q 8.75 4.23 0.00 2.27 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 7.05 0.00 0.00 0.00 0.00 0.00 2.46 2.54 0.00 114 K 8.31 4.03 0.00 1.75 1.87 0.00 2.11 0.00 0.00 1.61 0.00 0.00 2.97 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.46 1.46 7.81 115 Q 8.04 3.46 0.00 2.13 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.72 0.00 0.00 0.00 0.00 0.00 2.25 2.32 0.00 116 V 7.82 4.52 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 0.49 0.00 0.00 0.91 0.00 0.00 117 Q 8.63 4.33 0.00 2.09 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.87 0.00 0.00 0.00 0.00 0.00 2.14 1.91 0.00 118 I 8.33 4.30 1.22 0.00 0.00 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.02 0.61 -0.53 0.00 0.00 119 M 7.01 4.74 0.00 2.10 2.24 0.00 0.00 0.00 0.00 0.00 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.61 0.00 120 G 8.32 4.72 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 0.00 0.00 0.00 121 F 7.18 5.08 0.00 3.21 3.30 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 0.00 122 L 8.79 4.50 0.00 1.57 1.61 0.63 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 123 V 9.06 4.51 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 0.78 0.00 0.00 0.93 0.00 0.00 124 Q 7.84 4.63 0.00 2.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.81 0.00 0.00 0.00 0.00 0.00 2.27 2.24 0.00 125 R 8.17 4.38 0.00 1.18 1.53 0.00 2.38 0.00 0.00 2.83 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 1.32 0.00 126 P 0.00 4.24 0.00 2.12 2.20 0.00 2.20 0.00 0.00 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.64 0.00 127 K 8.41 4.08 0.00 1.75 1.91 0.00 1.74 0.00 0.00 1.74 0.00 0.00 3.01 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.42 1.39 7.81 128 T 7.81 4.05 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 0.00 129 A 7.72 4.24 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 0.00 130 R 8.82 4.67 0.00 1.81 1.91 0.00 3.21 0.00 0.00 3.28 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.81 0.00 131 D 8.44 4.98 0.00 2.91 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 0.00 132 F 7.73 5.42 0.00 3.20 3.11 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 0.00 133 Q 8.29 4.46 0.00 1.85 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 7.03 0.00 0.00 0.00 0.00 0.00 2.29 2.02 0.00 134 P 0.00 4.37 0.00 2.35 2.12 0.00 3.54 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.86 0.00 135 A 8.92 3.95 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 0.00 136 N 8.05 4.64 0.00 2.83 2.94 0.00 0.00 5.91 7.13 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 0.00 137 K 7.69 4.38 0.00 1.62 1.71 0.00 1.61 0.00 0.00 1.63 0.00 0.00 2.89 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.31 1.30 7.81 138 R 7.65 3.54 0.00 1.50 0.66 0.00 3.05 0.00 0.00 3.11 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 1.52 0.00 139 S 7.48 5.09 0.00 4.01 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 0.00 140 V 8.63 3.98 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 0.61 0.00 0.00 0.94 0.00 0.00