NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 S 4.4141 8.1927 115.2910 58.3891 64.8339 175.4281 2 N 4.2508 8.0787 120.3355 55.7562 39.9156 175.0282 3 I 3.9095 8.6228 119.1028 63.8607 39.6584 175.7168 4 I 4.0754 6.9850 118.2385 61.8203 38.4159 176.7142 5 K 3.6821 8.7438 121.1548 58.8290 32.5831 178.5960 6 Q 3.9798 8.9447 120.1333 58.8376 29.0341 177.6513 7 L 3.8180 6.9830 117.1514 56.4951 41.8455 178.9973 8 E 4.1508 7.9852 119.2358 59.0666 29.6545 178.5706 9 Q 4.1462 8.0672 117.3627 59.2716 28.0478 178.1595 10 E 3.8458 9.1792 122.0655 58.2874 29.3314 177.8992 11 Q 4.4529 7.1918 115.3150 56.3310 31.1860 176.1303 12 M 3.6325 8.0284 117.5509 55.6867 32.3401 176.5223 13 K 4.3684 8.0754 122.0037 56.4237 34.1975 176.2866 14 Q 4.5449 8.2525 114.9333 55.6420 30.0705 176.0907 15 D 4.4066 8.0570 118.5697 55.7690 41.6727 176.7419 16 V 3.6622 7.5774 112.7667 60.5704 31.9452 174.1950 17 P 4.5252 0.0000 0.0000 62.2232 32.7878 175.8953 18 S 4.2972 8.3218 112.3165 58.9000 63.0869 174.1773 19 F 5.2791 8.0895 121.6511 57.7913 42.9132 173.7964 20 R 4.5160 7.5530 121.6159 56.1836 31.8663 173.2327 21 P 4.4811 0.0000 0.0000 63.4617 31.0991 176.8754 22 G 3.9871 7.6076 106.6442 45.7060 0.0000 173.5493 23 D 4.4826 7.8372 119.3186 55.1264 41.3984 177.0884 24 T 4.0187 9.5082 117.7931 65.6535 69.1219 176.6756 25 V 3.2827 7.6378 115.7279 61.2372 31.2487 171.8082 26 E 4.8988 8.0384 120.5966 55.4003 31.2986 174.0144 27 V 4.0040 8.5989 127.1366 62.5786 33.2877 174.9575 28 K 4.8477 8.6260 125.4945 55.0931 34.3574 176.0588 29 V 4.8513 8.7730 119.2309 58.3531 34.5582 176.3529 30 W 5.2068 8.4965 124.2212 57.9065 30.2855 176.2431 31 V 4.1999 9.0245 125.4342 62.0913 34.5730 173.6362 32 V 3.6607 8.3482 123.5562 62.2744 32.0238 172.5176 33 E 3.4507 7.8385 120.1078 57.4312 29.9545 173.2999 34 G 3.4868 8.7870 105.0946 46.4189 0.0000 173.3347 35 S 4.6408 8.7453 113.1939 57.8530 64.2644 174.4836 36 K 4.8312 7.0988 121.7241 57.0986 34.1877 175.4972 37 K 4.3932 8.0695 112.7661 56.5114 33.1020 174.5192 38 R 4.1030 8.2725 118.6172 57.9716 31.1521 176.4922 39 L 4.9045 8.3674 119.1097 53.3307 43.6308 176.2926 40 Q 4.3966 9.3436 127.0111 55.4987 30.1832 174.8083 41 A 4.9816 8.6606 127.9677 51.2778 20.8247 176.9579 42 F 4.5121 9.6102 122.9330 56.5994 41.0663 173.0027 43 E 4.2726 8.6008 124.4084 55.8821 29.6326 175.5678 44 G 4.2621 8.3096 115.4720 45.2798 0.0000 171.8065 45 V 4.5372 8.3321 122.4879 61.2363 34.5600 175.6884 46 V 3.8005 7.9074 129.5169 64.1511 31.3676 175.0975 47 I 4.1941 8.7356 121.4068 61.8765 39.6816 175.2083 48 A 4.8916 7.0982 121.3422 49.7982 22.1245 175.0301 49 I 4.6468 8.1161 117.2010 59.4681 41.1077 173.6723 50 R 3.9712 8.9552 120.3211 56.5095 29.9596 177.4869 51 N 4.2501 10.0571 107.9624 53.1250 34.7218 174.9087 52 R 4.6303 8.1309 113.6133 54.6279 33.0395 177.6765 53 G 3.6719 8.1681 108.3183 46.0006 0.0000 174.9318 54 L 4.0143 8.8324 122.2128 58.4441 41.9660 177.4786 55 H 4.4845 7.6740 116.8243 56.1589 28.4426 174.8108 56 S 4.6539 8.2268 119.2060 57.3007 66.8973 173.6222 57 A 5.5888 8.3712 124.5510 49.7885 22.5129 175.2602 58 F 4.8238 8.3907 114.5971 58.0680 41.3385 172.7279 59 T 4.0088 8.0373 130.1425 63.5531 65.2745 171.1417 60 V 5.2815 7.6067 118.4871 58.3594 35.9157 175.7835 61 R 4.3710 8.6926 123.9044 56.6157 31.0864 176.5390 62 K 4.0462 8.2647 120.4921 57.1432 35.6736 175.9307 63 I 3.5347 7.6920 116.9601 61.7928 34.4192 174.6128 64 S 4.6151 7.2783 124.2212 57.9511 63.1039 178.3735 65 N 4.6125 8.7211 123.3503 54.2117 35.5827 173.2754 66 G 4.2533 8.1063 109.4529 44.9030 0.0000 171.7490 67 E 4.5575 7.6509 119.5741 53.8199 31.2983 175.2084 68 G 3.9224 8.4570 114.5786 45.6784 0.0000 172.9945 69 V 4.6943 8.1754 114.2317 59.3172 36.3793 174.0570 70 E 4.9535 8.7087 122.4068 54.5970 32.8907 174.3956 71 R 4.0688 8.3327 126.0350 54.6575 32.7866 174.7197 72 V 4.5767 7.9970 120.8753 59.5944 31.1500 175.6569 73 F 4.3178 7.8099 124.8121 56.9405 40.9174 174.8911 74 Q 5.1152 8.0929 114.8857 57.0519 29.3383 182.0294 75 T 2.6270 6.5046 108.7759 64.3894 70.2259 173.4480 76 H 4.6829 8.0785 122.0433 55.9744 28.6856 175.1983 77 S 4.6537 8.1726 115.1364 55.6779 63.8515 172.8990 78 P 3.9791 0.0000 0.0000 65.8148 31.4463 178.8671 79 V 2.8194 7.3109 110.7130 63.4408 31.7450 178.6682 80 V 3.3908 7.8602 119.6736 62.6463 32.7100 178.3679 81 D 3.9208 6.9371 117.3904 55.1169 42.0285 176.5269 82 S 4.6204 8.4975 108.8011 57.5151 65.2872 172.3559 83 I 4.5330 7.8502 121.8020 60.1567 39.7280 174.3423 84 S 4.6628 8.4459 126.4435 57.9605 63.4772 173.4714 85 V 4.4937 8.3365 115.4126 60.7179 34.3533 178.8771 86 K 3.5915 8.1717 117.1557 56.9263 32.4086 176.5529 87 R 4.7530 8.8973 128.5047 55.3608 32.6063 174.1411 88 R 4.6330 8.0146 121.3531 53.7986 32.0751 175.0623 89 G 4.4013 8.7149 105.9593 44.3907 0.0000 171.9648 90 A 4.4240 9.0673 125.5722 51.5833 19.4192 177.1591 91 V 4.0599 8.1323 120.4274 64.0892 34.1244 175.3017 92 R 3.6788 8.6808 114.7682 55.4108 27.0018 175.3451 93 K 4.2032 7.1337 114.3427 55.9623 35.4334 174.2598 94 A 4.1507 8.8607 128.6863 54.0510 18.8770 178.0495 95 K 4.4019 7.7634 113.9869 54.7195 35.1466 177.2415 96 L 4.8130 8.3335 127.6914 54.2188 41.0778 177.7481 97 Y 4.3862 7.4513 118.6851 60.9540 38.6843 178.1947 98 Y 4.2195 8.3639 116.6136 59.1280 37.9926 176.3782 99 L 4.0096 6.7358 121.5417 55.0086 41.9537 177.2244 100 R 3.9350 7.7686 117.9410 58.3488 29.9767 178.1934 101 E 4.3896 8.3827 120.6069 56.8030 28.2445 175.9105 102 R 4.2689 7.6048 120.7521 58.7063 33.1579 177.4416 103 T 3.4786 7.6325 113.7609 62.0004 67.6794 171.3758 104 G 4.1469 8.3805 110.9654 46.8552 0.0000 173.2601 105 K 4.1002 8.9396 123.7943 57.6102 30.6026 178.4423 106 A 4.0455 7.8677 118.5861 54.3949 18.5921 178.2098 107 A 4.1951 8.0367 118.0139 53.8445 19.2853 177.7686 108 R 3.7336 7.0044 113.6740 55.8184 29.9933 175.4442 109 I 4.5003 8.0813 116.8897 58.5960 39.1291 175.7811 110 K 4.1429 8.7319 126.4193 56.4076 33.3219 176.8562 111 E 4.0077 8.7198 122.2614 56.7052 30.6425 177.0392 112 R 3.9951 8.7404 118.9636 57.7099 30.5540 175.0980 113 L 3.5293 7.7076 125.2995 54.9444 39.5247 174.0525 114 N 4.6126 8.1942 118.8329 52.7833 39.0536 174.5773 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 S 8.19 4.41 0.00 3.88 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2 N 8.08 4.25 0.00 2.78 2.83 0.00 0.00 6.91 7.06 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 3 I 8.62 3.91 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.46 0.91 0.00 0.00 4 I 6.98 4.08 1.94 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 1.19 0.72 0.92 0.00 0.00 5 K 8.74 3.68 0.00 2.00 1.97 0.00 1.72 0.00 0.00 1.87 0.00 0.00 2.83 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.39 1.35 7.81 6 Q 8.94 3.98 0.00 1.99 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.57 0.00 0.00 0.00 0.00 0.00 2.32 2.53 0.00 7 L 6.98 3.82 0.00 1.70 1.72 0.95 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 8 E 7.99 4.15 0.00 2.10 1.90 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 2.36 2.45 0.00 9 Q 8.07 4.15 0.00 2.29 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.80 0.00 0.00 0.00 0.00 0.00 2.55 2.38 0.00 10 E 9.18 3.85 0.00 2.10 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 2.34 0.00 11 Q 7.19 4.45 0.00 2.24 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.48 0.00 0.00 0.00 0.00 0.00 2.26 2.39 0.00 12 M 8.03 3.63 0.00 1.80 2.05 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.31 0.00 13 K 8.08 4.37 0.00 1.83 1.79 0.00 1.61 0.00 0.00 1.73 0.00 0.00 2.96 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.48 1.46 7.81 14 Q 8.25 4.54 0.00 1.98 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.52 7.09 0.00 0.00 0.00 0.00 0.00 2.22 2.27 0.00 15 D 8.06 4.41 0.00 2.58 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 16 V 7.58 3.66 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 0.77 0.00 0.00 0.93 0.00 0.00 17 P 0.00 4.53 0.00 2.09 1.96 0.00 3.51 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 1.73 1.83 0.00 18 S 8.32 4.30 0.00 3.84 3.79 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 0.00 0.00 0.00 19 F 8.09 5.28 0.00 2.79 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 20 R 7.55 4.52 0.00 2.02 1.84 0.00 3.23 0.00 0.00 3.39 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.42 0.00 21 P 0.00 4.48 0.00 2.22 2.15 0.00 3.71 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.96 0.00 22 G 7.61 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 0.00 0.00 0.00 23 D 7.84 4.48 0.00 2.57 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 T 9.51 4.02 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 1.36 0.00 0.00 25 V 7.64 3.28 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.00 0.00 1.03 0.00 0.00 26 E 8.04 4.90 0.00 2.05 1.84 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 2.37 2.36 0.00 27 V 8.60 4.00 1.88 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 0.18 0.00 0.00 0.83 0.00 0.00 28 K 8.63 4.85 0.00 1.71 1.75 0.00 1.73 0.00 0.00 1.72 0.00 0.00 2.91 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.46 1.52 7.81 29 V 8.77 4.85 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 0.79 0.00 0.00 1.12 0.00 0.00 30 W 8.50 5.21 0.00 3.30 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 31 V 9.02 4.20 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 0.66 0.00 0.00 1.03 0.00 0.00 32 V 8.35 3.66 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 0.72 0.00 0.00 0.91 0.00 0.00 33 E 7.84 3.45 0.00 2.04 1.63 0.00 0.00 0.00 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 2.35 0.00 34 G 8.79 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 35 S 8.75 4.64 0.00 3.85 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 36 K 7.10 4.83 0.00 1.70 1.73 0.00 1.79 0.00 0.00 1.73 0.00 0.00 3.06 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.33 1.32 7.81 37 K 8.07 4.39 0.00 1.45 1.60 0.00 1.47 0.00 0.00 1.61 0.00 0.00 2.94 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.06 1.06 7.81 38 R 8.27 4.10 0.00 1.76 2.00 0.00 3.17 0.00 0.00 3.24 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.70 0.00 39 L 8.37 4.90 0.00 1.55 1.68 1.19 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 40 Q 9.34 4.40 0.00 2.21 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.84 0.00 0.00 0.00 0.00 0.00 2.50 2.41 0.00 41 A 8.66 4.98 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 9.61 4.51 0.00 3.19 3.17 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 43 E 8.60 4.27 0.00 1.85 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 2.34 2.26 0.00 44 G 8.31 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 0.00 0.00 0.00 0.00 45 V 8.33 4.54 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 0.89 0.00 0.00 0.92 0.00 0.00 46 V 7.91 3.80 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 0.39 0.00 0.00 0.35 0.00 0.00 47 I 8.74 4.19 1.88 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.73 0.88 0.00 0.00 48 A 7.10 4.89 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 49 I 8.12 4.65 1.82 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.78 0.92 0.00 0.00 50 R 8.96 3.97 0.00 1.97 1.58 0.00 3.34 0.00 0.00 3.52 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 1.83 0.00 51 N 10.06 4.25 0.00 2.96 3.01 0.00 0.00 6.59 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 52 R 8.13 4.63 0.00 2.07 1.90 0.00 3.50 0.00 0.00 3.26 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.76 0.00 53 G 8.17 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 54 L 8.83 4.01 0.00 1.50 1.51 0.89 0.92 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 55 H 7.67 4.48 0.00 3.22 3.26 0.00 5.78 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 S 8.23 4.65 0.00 3.81 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 8.37 5.59 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 58 F 8.39 4.82 0.00 3.44 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 59 T 8.04 4.01 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 1.28 0.00 0.00 60 V 7.61 5.28 2.37 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 1.40 0.00 0.00 1.26 0.00 0.00 61 R 8.69 4.37 0.00 1.74 1.85 0.00 3.41 0.00 0.00 3.50 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.56 0.00 62 K 8.26 4.05 0.00 1.56 1.67 0.00 1.06 0.00 0.00 0.86 0.00 0.00 2.48 0.00 0.00 2.66 0.00 0.00 0.00 0.00 1.16 1.30 7.81 63 I 7.69 3.53 1.85 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.93 0.90 0.00 0.00 64 S 7.28 4.62 0.00 3.83 2.92 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 65 N 8.72 4.61 0.00 2.68 2.79 0.00 0.00 6.86 7.65 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 66 G 8.11 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 0.00 0.00 0.00 0.00 67 E 7.65 4.56 0.00 2.00 1.80 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 2.30 2.28 0.00 68 G 8.46 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 69 V 8.18 4.69 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 0.95 0.00 0.00 1.05 0.00 0.00 70 E 8.71 4.95 0.00 1.93 1.75 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 2.18 2.31 0.00 71 R 8.33 4.07 0.00 1.07 0.66 0.00 2.21 0.00 0.00 2.25 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.86 0.00 72 V 8.00 4.58 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 0.73 0.00 0.00 0.82 0.00 0.00 73 F 7.81 4.32 0.00 2.29 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 0.00 0.00 0.00 74 Q 8.09 5.12 0.00 1.94 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.35 5.99 0.00 0.00 0.00 0.00 0.00 2.27 2.17 0.00 75 T 6.50 2.63 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 1.03 0.00 0.00 76 H 8.08 4.68 0.00 3.18 3.23 0.00 5.68 0.00 0.00 0.00 0.00 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 S 8.17 4.65 0.00 3.70 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 P 0.00 3.98 0.00 1.99 1.93 0.00 3.55 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 2.08 2.05 0.00 79 V 7.31 2.82 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 0.82 0.00 0.00 0.83 0.00 0.00 80 V 7.86 3.39 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 0.58 0.00 0.00 0.53 0.00 0.00 81 D 6.94 3.92 0.00 2.35 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 0.00 0.00 0.00 82 S 8.50 4.62 0.00 3.92 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 83 I 7.85 4.53 1.84 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.23 0.84 0.00 0.00 84 S 8.45 4.66 0.00 3.98 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 85 V 8.34 4.49 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 0.84 0.00 0.00 1.01 0.00 0.00 86 K 8.17 3.59 0.00 1.88 1.56 0.00 1.59 0.00 0.00 1.66 0.00 0.00 2.88 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.65 1.42 7.81 87 R 8.90 4.75 0.00 1.88 1.76 0.00 3.12 0.00 0.00 3.39 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.60 0.00 88 R 8.01 4.63 0.00 1.95 1.85 0.00 2.68 0.00 0.00 2.26 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.43 0.00 89 G 8.71 4.40 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 0.00 90 A 9.07 4.42 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 91 V 8.13 4.06 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 0.97 0.00 0.00 0.94 0.00 0.00 92 R 8.68 3.68 0.00 1.98 1.99 0.00 3.31 0.00 0.00 3.12 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.58 0.00 93 K 7.13 4.20 0.00 1.66 1.66 0.00 1.61 0.00 0.00 1.46 0.00 0.00 2.80 0.00 0.00 2.54 0.00 0.00 0.00 0.00 1.34 1.40 7.81 94 A 8.86 4.15 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 95 K 7.76 4.40 0.00 1.53 0.98 0.00 1.49 0.00 0.00 1.66 0.00 0.00 3.12 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.23 0.86 7.81 96 L 8.33 4.81 0.00 1.63 1.31 1.00 0.67 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 97 Y 7.45 4.39 0.00 3.15 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 98 Y 8.36 4.22 0.00 3.14 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 99 L 6.74 4.01 0.00 1.25 1.44 0.85 0.70 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 0.00 100 R 7.77 3.94 0.00 2.02 1.77 0.00 3.31 0.00 0.00 3.53 7.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.62 0.00 101 E 8.38 4.39 0.00 2.07 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 2.30 2.41 0.00 102 R 7.60 4.27 0.00 1.74 2.03 0.00 3.58 0.00 0.00 3.28 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.42 0.00 103 T 7.63 3.48 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 0.00 104 G 8.38 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 0.00 0.00 0.00 0.00 105 K 8.94 4.10 0.00 1.96 1.95 0.00 1.69 0.00 0.00 1.82 0.00 0.00 2.95 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.42 1.36 7.81 106 A 7.87 4.05 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 0.00 107 A 8.04 4.20 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 0.00 108 R 7.00 3.73 0.00 2.00 1.93 0.00 3.13 0.00 0.00 3.27 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.62 0.00 109 I 8.08 4.50 1.86 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 1.32 0.61 0.94 0.00 0.00 110 K 8.73 4.14 0.00 1.79 1.79 0.00 1.57 0.00 0.00 1.89 0.00 0.00 2.99 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.54 1.52 7.81 111 E 8.72 4.01 0.00 2.08 2.13 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 2.36 2.38 0.00 112 R 8.74 4.00 0.00 1.85 1.94 0.00 3.41 0.00 0.00 3.15 7.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.67 0.00 113 L 7.71 3.53 0.00 1.98 1.69 0.92 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 114 N 8.19 4.61 0.00 2.71 2.65 0.00 0.00 7.06 7.56 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