NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.6463 8.2644 122.4787 51.8539 20.4288 175.4988 2 W 4.9979 9.0212 128.2388 54.8737 34.5370 172.0639 3 K 4.3486 7.3638 126.6045 54.7418 35.0826 175.3974 4 G 3.6546 6.8067 112.3608 46.3824 0.0000 171.5852 5 E 5.4486 9.1780 120.3425 54.5650 33.3270 176.2440 6 V 4.4166 9.0196 122.9354 61.1003 33.8361 174.5948 7 L 4.3666 8.4847 128.5669 54.1654 42.2790 178.4854 8 A 3.2343 8.4768 127.1020 54.8215 18.3078 178.0784 9 N 4.9817 7.9273 110.6251 53.1828 37.5218 175.4595 10 N 4.6146 7.7835 119.6069 52.2360 37.7077 173.9809 11 E 2.6298 8.1345 125.0769 57.9505 30.2727 178.9364 12 A 3.7807 7.7122 121.0219 53.7780 18.6969 177.4128 13 G 3.7835 7.8494 100.1693 44.7322 0.0000 172.7746 14 Q 4.4170 8.9754 120.7963 54.1874 29.9293 174.8008 15 V 3.9838 8.3032 127.7562 63.0669 32.2729 175.6695 16 T 3.4943 8.1099 118.8884 59.6329 70.6912 174.6081 17 S 4.4728 8.0398 113.9951 58.6273 63.4787 173.6246 18 I 4.2149 7.6235 123.7235 60.8997 38.3398 174.6707 19 I 4.7024 8.2515 128.0290 59.6524 38.8344 174.6571 20 Y 4.1282 9.2681 130.3097 57.3086 39.7910 173.9825 21 N 5.2297 8.6328 124.3324 50.2664 42.2177 172.5593 22 P 4.2894 0.0000 0.0000 64.7797 31.6733 176.9053 23 G 3.9644 8.9467 111.6927 45.0652 0.0000 173.2605 24 D 4.3645 7.7002 119.9020 54.4958 41.6159 176.0232 25 V 4.8387 8.3811 121.9562 61.1569 34.2289 174.2785 26 I 5.2858 9.1301 120.3933 59.5766 41.5660 174.1948 27 T 5.1725 8.8816 119.2581 61.9580 72.4666 173.0397 28 I 5.0972 9.0168 125.8589 59.4731 41.3256 174.5332 29 V 4.8477 8.7223 125.4636 61.0062 34.2564 173.9502 30 A 5.3851 8.9556 129.4061 50.2538 21.5582 175.0695 31 A 4.3768 9.3869 121.8289 51.0510 23.6057 176.0471 32 G 3.5936 7.5444 104.6623 43.7556 0.0000 172.0623 33 W 5.8805 8.7423 118.2734 55.1521 33.1919 174.6019 34 A 4.7902 9.5890 124.8575 50.8691 22.8974 174.6365 35 S 5.3755 9.1889 113.5022 56.6970 66.2055 173.8028 36 Y 5.2189 9.2782 122.3612 54.9474 37.7244 175.5331 37 G 4.0243 6.8979 115.5525 45.5286 0.0000 172.5393 38 P 4.3638 0.0000 0.0000 61.7962 32.0973 176.8283 39 T 3.8777 8.2509 113.8999 64.7661 67.5079 174.6653 40 Q 3.8760 7.6780 121.0483 55.5883 29.6772 174.4961 41 K 4.9096 7.4262 119.4828 54.3460 35.7519 175.5991 42 W 5.3331 9.8587 121.4996 55.2229 33.9649 175.9271 43 G 4.6299 8.6879 109.1467 44.6622 0.0000 172.3265 44 P 3.2263 0.0000 0.0000 64.6910 31.2057 178.2393 45 Q 4.2241 7.3359 114.9053 55.6184 29.2312 176.9022 46 G 3.6843 8.2241 106.6796 44.6061 0.0000 172.3419 47 D 4.2145 8.3999 120.6639 52.2685 40.1490 177.9702 48 R 2.0000 7.9603 122.9580 56.7905 29.4865 177.1308 49 E 4.2667 8.1684 117.6799 56.7353 30.5092 175.3215 50 H 4.5818 7.4081 119.8515 54.0224 30.7388 173.0549 51 P 4.4098 0.0000 0.0000 62.1257 32.1932 175.2678 52 D 4.5404 8.4832 119.5967 54.1310 41.1390 176.6605 53 Q 4.4198 8.7473 127.5598 55.8129 29.8371 176.1065 54 G 4.1239 8.5165 102.6557 46.0778 0.0000 174.9068 55 L 4.3186 8.2450 118.3902 53.8442 42.5642 178.3268 56 I 3.7145 8.3163 116.2974 63.3721 37.5932 175.7653 57 C 4.5416 8.2188 121.0723 57.8600 33.4799 173.7655 58 H 4.7075 8.6145 122.8759 56.2920 28.8064 175.5179 59 D 4.6878 7.8794 117.5849 53.7204 41.3954 175.6390 60 A 4.4170 7.1008 120.8896 49.7383 22.2555 176.3050 61 F 4.5116 7.8204 118.2881 56.9198 39.9347 174.7530 62 C 3.8788 8.3010 122.7023 60.9781 31.5480 174.6171 63 G 3.6775 8.4965 115.4377 44.1835 0.0000 173.3434 64 A 4.4574 7.1695 121.9886 51.3054 20.2036 176.6588 65 L 4.5146 8.5829 123.2337 55.0569 43.3848 176.4289 66 V 5.0070 8.7447 118.5845 59.8397 36.5162 173.9022 67 M 5.2762 9.0805 118.0371 54.0263 35.1388 173.9545 68 K 4.8242 8.8773 118.5565 54.6453 35.8631 175.5187 69 I 4.5714 8.6456 125.2884 59.5589 39.2760 177.6101 70 G 3.9464 9.1704 119.1523 45.8918 0.0000 172.8511 71 N 4.7722 9.1438 118.0577 52.3512 37.4167 175.1074 72 S 4.4280 7.5768 113.4246 57.6584 64.1331 173.7918 73 G 3.8845 8.2053 110.8111 44.8244 0.0000 173.1900 74 T 4.2602 8.1656 109.4761 61.8447 69.5934 173.9557 75 I 4.5916 8.8032 124.5504 58.7112 40.6109 173.3477 76 P 4.4440 0.0000 0.0000 62.9760 31.6622 175.7672 77 V 3.9214 8.2949 121.5554 63.8665 34.0273 175.7348 78 N 4.0524 8.0524 117.8810 54.6920 37.5129 177.9130 79 T 3.7980 8.2316 116.3143 63.9039 69.1078 174.7077 80 G 4.5603 5.9846 107.7304 44.6412 0.0000 171.9769 81 L 4.6633 7.9151 118.5692 52.7120 45.1126 175.4435 82 F 4.9288 8.9727 124.8527 57.2639 40.8983 175.7142 83 R 3.8432 7.7614 129.3098 55.6218 28.0307 176.1210 84 W 4.7817 8.7410 127.7934 55.7286 32.7267 174.7178 85 V 4.4960 7.2747 123.5581 60.5961 33.4256 175.1853 86 A 2.8124 7.7686 129.6964 50.3053 19.2136 175.3966 87 P 4.2584 0.0000 0.0000 62.0537 32.0334 175.8109 88 N 4.3770 8.3193 118.2890 55.4761 39.1025 174.8551 89 N 4.3786 8.8613 120.4097 53.4267 36.3216 174.0275 90 V 4.0919 7.4506 119.0777 61.7086 31.7601 175.0598 91 Q 4.8478 8.3948 123.4012 55.9230 31.1443 172.5446 92 G 3.7807 8.9389 105.1301 43.3013 0.0000 172.9350 93 A 4.5468 8.5539 120.6725 52.2735 19.7235 176.6698 94 I 4.7088 8.4927 122.0868 60.1115 39.3772 174.8837 95 T 4.8471 8.7259 123.9603 61.6681 71.4259 173.1124 96 L 4.9783 8.7369 126.7656 53.5160 44.0947 175.7951 97 I 5.0126 8.7468 123.3523 59.5019 41.7523 174.1361 98 Y 4.6251 8.9616 127.8680 57.8100 40.3836 174.0705 99 N 4.8310 8.5133 125.8161 53.0824 40.0951 173.2211 100 D 4.5700 8.2128 124.9140 53.0081 45.6323 173.5885 101 V 4.2824 8.0438 119.5297 61.1334 32.2185 173.3595 102 P 5.3330 0.0000 0.0000 63.9923 31.6087 176.3739 103 G 4.1331 9.6386 110.8566 45.4265 0.0000 174.0623 104 T 4.6425 7.9124 108.5250 61.7279 69.1146 174.9638 105 Y 4.2426 8.2630 121.4498 60.3221 38.4936 177.9919 106 G 3.7109 8.2748 108.5153 48.2691 0.0000 173.8611 107 N 4.6938 8.1647 115.4076 52.9368 37.8957 174.4131 108 N 4.8660 8.0004 117.5851 53.0505 39.8784 174.1014 109 S 4.5841 8.7646 114.5913 58.0285 66.3881 174.7078 110 G 4.0579 9.5109 110.1855 45.3070 0.0000 171.7896 111 S 4.7626 7.6997 111.4846 57.5823 66.4500 173.7908 112 F 5.3994 8.8500 118.5387 55.8132 42.0694 174.7476 113 S 5.0998 9.2955 118.4099 57.3792 63.8584 172.9978 114 V 5.0258 9.0476 126.7564 61.2357 35.2187 173.6911 115 N 5.6298 9.1594 123.5691 51.5570 42.3309 173.4417 116 I 5.1184 9.3701 123.5720 59.5954 40.9581 174.7917 117 G 4.5600 9.2726 114.0437 44.2710 0.0000 171.9119 118 K 4.9739 8.5818 120.3909 55.4655 33.1584 176.3210 119 D 4.8733 8.9770 124.2953 52.3202 43.6613 176.0451 120 Q 4.0683 8.4743 118.8566 56.9658 29.2760 177.5420 121 S 4.1458 8.2848 114.4419 58.9075 62.6557 174.0513 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 A 8.26 4.65 1.33 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 0.00 0.00 2 W 9.02 5.00 0.00 3.42 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 3 K 7.36 4.35 0.00 1.61 1.27 0.00 1.76 0.00 0.00 1.56 0.00 0.00 2.67 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.00 1.39 7.81 4 G 6.81 3.65 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 0.00 0.00 0.00 5 E 9.18 5.45 0.00 1.87 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 0.00 2.21 2.25 0.00 6 V 9.02 4.42 2.34 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 1.27 0.00 0.00 1.17 0.00 0.00 7 L 8.48 4.37 0.00 1.70 1.69 0.94 0.97 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 8 A 8.48 3.23 0.38 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 0.00 0.00 0.00 0.00 0.00 0.00 9 N 7.93 4.98 0.00 2.97 3.11 0.00 0.00 5.91 8.04 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 10 N 7.78 4.61 0.00 2.78 2.87 0.00 0.00 7.02 7.71 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 11 E 8.13 2.63 0.00 1.32 1.60 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 2.01 1.47 0.00 12 A 7.71 3.78 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 13 G 7.85 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 0.00 0.00 0.00 14 Q 8.98 4.42 0.00 2.22 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.54 6.95 0.00 0.00 0.00 0.00 0.00 2.75 2.37 0.00 15 V 8.30 3.98 2.03 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 0.77 0.00 0.00 0.89 0.00 0.00 16 T 8.11 3.49 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 -0.03 0.00 0.00 17 S 8.04 4.47 0.00 4.09 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 18 I 7.62 4.21 1.83 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.91 0.98 0.00 0.00 19 I 8.25 4.70 1.86 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 1.23 0.83 0.99 0.00 0.00 20 Y 9.27 4.13 0.00 3.12 3.02 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 0.00 0.00 0.00 21 N 8.63 5.23 0.00 2.52 2.56 0.00 0.00 6.53 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 22 P 0.00 4.29 0.00 2.00 2.04 0.00 3.64 0.00 0.00 3.66 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 23 G 8.95 3.96 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 0.00 0.00 0.00 24 D 7.70 4.36 0.00 1.58 2.30 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 25 V 8.38 4.84 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 1.09 0.00 0.00 0.97 0.00 0.00 26 I 9.13 5.29 2.10 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.22 1.16 0.00 0.00 27 T 8.88 5.17 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 1.27 0.00 0.00 28 I 9.02 5.10 1.79 0.00 0.00 nan 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.71 0.95 0.00 0.00 29 V 8.72 4.85 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 0.96 0.00 0.00 0.98 0.00 0.00 30 A 8.96 5.39 1.10 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 0.00 0.00 31 A 9.39 4.38 1.16 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 32 G 7.54 3.59 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 0.00 0.00 0.00 33 W 8.74 5.88 0.00 3.31 3.07 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 34 A 9.59 4.79 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 S 9.19 5.38 0.00 4.10 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 36 Y 9.28 5.22 0.00 3.27 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 37 G 6.90 4.02 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 0.00 0.00 0.00 0.00 0.00 0.00 38 P 0.00 4.36 0.00 2.28 2.11 0.00 2.73 0.00 0.00 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.91 0.00 39 T 8.25 3.88 4.20 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 1.15 0.00 0.00 40 Q 7.68 3.88 0.00 1.76 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.55 0.00 0.00 0.00 0.00 0.00 1.22 1.90 0.00 41 K 7.43 4.91 0.00 1.50 1.88 0.00 1.70 0.00 0.00 1.83 0.00 0.00 2.86 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.32 1.30 7.81 42 W 9.86 5.33 0.00 3.57 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 43 G 8.69 4.63 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 0.00 0.00 0.00 0.00 0.00 0.00 44 P 0.00 3.23 0.00 1.78 1.39 0.00 3.25 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.27 0.00 45 Q 7.34 4.22 0.00 2.11 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.63 0.00 0.00 0.00 0.00 0.00 2.33 2.26 0.00 46 G 8.22 3.68 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 0.00 0.00 0.00 47 D 8.40 4.21 0.00 1.58 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 0.00 0.00 0.00 48 R 7.96 2.00 0.00 1.18 1.41 0.00 3.03 0.00 0.00 3.21 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.45 0.00 49 E 8.17 4.27 0.00 2.11 2.03 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 2.21 2.20 0.00 50 H 7.41 4.58 0.00 2.91 2.91 0.00 5.94 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 P 0.00 4.41 0.00 2.16 1.97 0.00 3.31 0.00 0.00 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.84 0.00 52 D 8.48 4.54 0.00 2.70 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 53 Q 8.75 4.42 0.00 2.03 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.97 0.00 0.00 0.00 0.00 0.00 2.21 2.43 0.00 54 G 8.52 4.12 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 0.00 0.00 0.00 55 L 8.25 4.32 0.00 1.65 1.73 0.94 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 56 I 8.32 3.71 1.89 0.00 0.00 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 1.34 0.55 1.08 0.00 0.00 57 C 8.22 4.54 0.00 2.86 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 58 H 8.61 4.71 0.00 3.17 3.28 0.00 5.78 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 D 7.88 4.69 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 60 A 7.10 4.42 1.07 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 0.00 0.00 61 F 7.82 4.51 0.00 3.23 2.91 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 62 C 8.30 3.88 0.00 2.63 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 0.00 0.00 0.00 63 G 8.50 3.68 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 0.00 0.00 0.00 64 A 7.17 4.46 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 65 L 8.58 4.51 0.00 1.65 1.55 1.14 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 66 V 8.74 5.01 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 0.64 0.00 0.00 1.02 0.00 0.00 67 M 9.08 5.28 0.00 1.88 2.08 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.30 0.00 68 K 8.88 4.82 0.00 1.66 1.68 0.00 1.59 0.00 0.00 1.63 0.00 0.00 2.82 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.58 1.35 7.81 69 I 8.65 4.57 1.87 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 1.16 1.26 1.05 0.00 0.00 70 G 9.17 3.95 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 0.00 71 N 9.14 4.77 0.00 2.82 2.91 0.00 0.00 5.92 7.64 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 72 S 7.58 4.43 0.00 3.99 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 73 G 8.21 3.88 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 0.00 0.00 0.00 74 T 8.17 4.26 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 1.26 0.00 0.00 75 I 8.80 4.59 1.77 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 1.28 0.86 0.85 0.00 0.00 76 P 0.00 4.44 0.00 1.82 1.85 0.00 3.57 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 1.94 1.98 0.00 77 V 8.29 3.92 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 0.90 0.00 0.00 nan 0.00 0.00 78 N 8.05 4.05 0.00 2.80 2.18 0.00 0.00 6.85 6.99 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 79 T 8.23 3.80 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 1.11 0.00 0.00 80 G 5.98 4.56 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 0.00 81 L 7.92 4.66 0.00 1.50 1.35 -0.49 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 82 F 8.97 4.93 0.00 2.94 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 83 R 7.76 3.84 0.00 1.84 1.80 0.00 2.98 0.00 0.00 2.82 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.50 0.00 84 W 8.74 4.78 0.00 3.31 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 85 V 7.27 4.50 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 0.79 0.00 0.00 0.88 0.00 0.00 86 A 7.77 2.81 0.52 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 0.00 0.00 87 P 0.00 4.26 0.00 2.13 1.93 0.00 3.49 0.00 0.00 3.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.01 0.00 88 N 8.32 4.38 0.00 2.64 2.70 0.00 0.00 7.10 7.79 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 89 N 8.86 4.38 0.00 2.91 2.98 0.00 0.00 6.91 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 90 V 7.45 4.09 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 0.75 0.00 0.00 0.91 0.00 0.00 91 Q 8.39 4.85 0.00 2.45 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.16 0.00 0.00 0.00 0.00 0.00 2.37 2.38 0.00 92 G 8.94 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 0.00 0.00 0.00 93 A 8.55 4.55 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 94 I 8.49 4.71 1.75 0.00 0.00 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 1.25 0.82 0.78 0.00 0.00 95 T 8.73 4.85 4.18 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 1.20 0.00 0.00 96 L 8.74 4.98 0.00 1.56 1.62 0.90 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 97 I 8.75 5.01 1.93 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 1.11 1.04 1.00 0.00 0.00 98 Y 8.96 4.63 0.00 3.17 3.08 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 0.00 0.00 0.00 99 N 8.51 4.83 0.00 2.82 2.44 0.00 0.00 6.42 8.74 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 0.00 100 D 8.21 4.57 0.00 2.30 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 0.00 101 V 8.04 4.28 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 1.07 0.00 0.00 0.94 0.00 0.00 102 P 0.00 5.33 0.00 2.14 2.06 0.00 3.92 0.00 0.00 4.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.14 0.00 103 G 9.64 4.13 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 0.00 0.00 0.00 104 T 7.91 4.64 4.28 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 1.25 0.00 0.00 105 Y 8.26 4.24 0.00 3.10 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 0.00 106 G 8.27 3.71 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 0.00 0.00 0.00 107 N 8.16 4.69 0.00 2.89 3.07 0.00 0.00 6.27 6.96 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 0.00 108 N 8.00 4.87 0.00 2.96 2.63 0.00 0.00 6.51 7.25 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 0.00 109 S 8.76 4.58 0.00 3.88 3.88 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 0.00 110 G 9.51 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 0.00 111 S 7.70 4.76 0.00 3.88 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 0.00 112 F 8.85 5.40 0.00 3.09 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 0.00 113 S 9.30 5.10 0.00 3.91 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 0.00 114 V 9.05 5.03 2.51 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 1.10 0.00 0.00 1.12 0.00 0.00 115 N 9.16 5.63 0.00 2.68 2.68 0.00 0.00 6.66 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 0.00 116 I 9.37 5.12 2.09 0.00 0.00 0.81 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 1.18 1.00 0.00 0.00 117 G 9.27 4.56 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 0.00 118 K 8.58 4.97 0.00 1.66 1.73 0.00 1.72 0.00 0.00 1.65 0.00 0.00 2.87 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.42 1.49 7.81 119 D 8.98 4.87 0.00 2.64 2.52 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 0.00 120 Q 8.47 4.07 0.00 2.02 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.78 0.00 0.00 0.00 0.00 0.00 2.36 2.36 0.00 121 S 8.28 4.15 0.00 3.90 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