NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 M 4.4354 8.2893 120.2172 54.4079 32.5094 174.6637 1 P 5.2216 0.0000 0.0000 61.6008 33.2822 170.4013 2 V 4.9639 8.4308 119.9031 61.3223 35.8564 174.7783 3 F 5.4020 9.3243 129.5044 56.6325 42.4644 173.4975 4 T 4.9509 8.0975 115.6318 59.8350 72.3738 172.7693 5 I 4.5158 8.4618 124.0547 59.5413 40.3424 174.6234 6 R 4.8656 8.4470 126.1558 54.7414 32.2686 174.9677 7 T 5.2534 9.2309 118.6137 59.1725 71.1267 173.8937 8 N 5.3561 8.8106 121.2933 53.3436 38.5128 175.6632 9 V 3.7496 8.0514 121.1324 63.4791 32.9479 175.2544 10 C 4.8299 8.6976 123.8337 58.9923 29.2411 174.8271 11 R 3.9576 9.8455 121.2045 59.7017 28.8263 178.0368 12 D 4.4610 8.0609 115.5773 55.9565 41.3575 176.2790 13 S 4.4902 8.2171 113.7928 58.5896 63.1210 174.4339 14 V 3.8788 7.4939 121.6409 60.9892 30.5027 173.8470 15 P 4.2769 0.0000 0.0000 63.0825 31.5809 177.0872 16 D 4.7460 8.7746 120.2555 54.4214 39.5659 176.6554 17 T 4.3346 7.7658 111.2949 63.8000 70.3563 177.5319 18 L 3.8038 7.6395 121.9067 57.5380 42.0256 178.7081 19 L 4.1669 8.1979 118.2195 58.5312 41.4428 179.8275 20 S 4.1616 8.0168 114.0306 61.4633 62.8419 176.0510 21 D 4.3216 8.3683 121.0352 57.6605 41.0677 178.6030 22 L 4.0721 8.8448 119.8238 57.5293 41.5316 179.8302 23 T 3.9086 7.6396 115.9896 66.3748 68.3494 176.7394 24 K 3.9256 8.3195 121.8883 59.5460 32.1345 178.8929 25 Q 3.9715 8.0870 118.1657 59.1048 28.7383 178.5560 26 L 3.9060 7.9069 119.6896 57.6188 41.4464 179.2512 27 A 4.2065 7.8459 122.0228 54.7954 18.2892 179.5479 28 K 3.9675 7.9791 116.5351 59.7428 31.9195 179.0382 29 A 3.9282 8.3138 120.3418 56.3905 18.5634 179.1614 30 T 4.4994 8.2770 109.0949 61.0303 69.4387 174.9674 31 G 3.9936 7.9868 109.6775 46.6635 0.0000 173.4771 32 K 4.6025 7.4425 117.8154 52.9656 34.7833 174.3140 33 P 4.3780 0.0000 0.0000 63.1143 31.5905 177.3506 34 A 4.0831 8.8064 125.9479 55.0065 18.5987 179.2645 35 E 3.8926 8.0558 112.9092 59.0538 29.9165 177.1375 36 Y 4.4635 7.6282 115.5674 57.7302 37.9767 174.6336 37 I 5.2570 7.5692 120.7113 58.7694 39.3501 174.9598 38 A 4.8644 8.6246 127.4472 50.1344 21.9980 174.6858 39 I 5.1071 8.5009 122.1751 59.7103 40.3776 174.6012 40 H 4.9407 9.1045 125.3414 54.5146 32.7402 171.8729 41 I 4.7197 8.6256 126.4019 59.6047 39.4002 175.5699 42 V 4.2445 9.1836 128.1134 60.7307 32.8621 172.9704 43 P 4.6640 0.0000 0.0000 62.6995 33.8063 175.6508 44 D 4.4027 8.7440 119.0661 55.5565 39.4946 174.1174 45 Q 4.1268 7.5849 118.1731 55.8281 29.2025 175.9869 46 I 4.1549 8.0386 122.5253 60.4495 36.1390 175.0196 47 M 4.8937 8.0016 121.0681 53.5155 34.1517 174.6070 48 S 4.9731 8.3174 113.4062 56.5923 66.5853 173.2012 49 F 4.3968 8.8461 122.9299 57.6519 41.8018 174.7701 50 G 4.0552 9.7072 115.4588 46.6726 0.0000 172.6761 51 D 4.5577 8.4750 115.1019 54.5311 39.3983 173.1808 52 S 4.7305 8.0851 111.3153 56.2686 64.8123 173.9619 53 T 4.8168 8.4650 116.4035 61.7377 68.8076 174.5623 54 D 4.5431 7.6472 121.4129 53.4030 41.4089 174.3261 55 P 4.3738 0.0000 0.0000 63.7590 31.5607 175.4170 56 C 4.9071 9.1341 116.6523 57.6606 33.8964 172.3040 57 A 4.9250 8.6733 118.1207 51.0197 22.8110 175.8082 58 V 4.7670 8.9231 120.9586 61.6546 34.2927 174.5873 59 C 5.2099 9.1508 126.1124 58.2760 32.0020 173.0322 60 S 4.8704 7.9864 112.5848 57.2417 66.4058 173.1777 61 L 5.2723 9.0561 125.9306 53.7062 44.5991 174.4728 62 C 5.3787 9.1321 125.0972 58.2177 30.5710 173.1454 63 S 4.6764 9.0478 117.7391 57.0272 66.0461 173.4790 64 I 4.5200 7.7066 127.7455 60.0185 35.5549 176.1264 65 G 3.6978 8.5138 114.6629 45.0534 0.0000 172.0513 66 K 4.2054 8.6009 116.8608 56.8923 29.4657 175.3855 67 I 4.6122 7.0126 119.4335 59.6832 39.6740 175.4502 68 G 4.2637 7.6074 112.0530 44.8963 0.0000 172.3591 69 G 3.7095 8.2391 106.8728 45.9559 0.0000 173.2088 70 P 4.2789 0.0000 0.0000 65.6249 31.6051 178.4039 71 Q 3.4648 7.8722 117.1425 58.8738 28.5944 178.0124 72 N 3.5637 7.7072 116.8391 56.3170 38.5339 177.6727 73 K 3.8953 7.4242 118.1463 59.4210 32.2151 178.9790 74 S 3.9676 7.6372 113.3161 61.7698 62.0506 175.6791 75 Y 4.3644 7.6632 119.3653 61.7988 37.5139 178.5903 76 T 4.1427 8.3383 117.8881 66.1113 68.6584 176.0189 77 K 3.8310 8.3068 120.9286 59.9708 32.1741 178.1708 78 L 3.9435 8.0486 120.2227 58.3260 41.9656 178.8839 79 L 3.9655 9.0786 119.7317 58.0971 41.5171 179.5715 80 C 4.2011 9.2141 117.8655 62.6155 28.1309 175.9033 81 D 4.3397 8.2361 120.6838 57.4719 40.3702 178.8467 82 I 3.7545 7.8027 120.3045 64.4006 37.0759 178.5857 83 L 4.0447 8.3078 120.3820 57.7166 41.4015 179.6191 84 T 4.3224 7.7394 111.0863 63.7351 68.7664 176.9207 85 K 3.8754 7.6973 121.2026 59.3788 32.3821 178.5467 86 Q 4.1630 8.1399 116.8594 58.2809 29.0045 177.0895 87 L 4.4041 7.6883 116.2358 53.7587 42.4916 175.9016 88 N 4.8036 7.8689 115.0615 54.2040 37.1198 173.4084 89 I 4.2873 7.5225 117.7268 58.1262 38.5913 173.7873 90 P 4.2554 0.0000 0.0000 62.5803 31.6094 177.1948 91 A 3.9890 8.6115 124.0518 55.3406 18.3942 178.6337 92 N 4.4285 7.9865 111.2432 54.7250 38.1072 175.3491 93 R 3.3144 7.3322 119.0939 54.8287 30.4454 176.1482 94 V 4.9516 7.0824 117.3959 61.7299 34.8513 173.6751 95 Y 5.3713 9.1619 125.1561 56.5397 41.3238 174.9919 96 I 4.9121 8.2481 121.8983 59.8843 40.9458 174.3310 97 N 4.4665 8.9491 125.9842 52.1635 39.6432 173.8679 98 Y 4.9305 8.1222 121.7058 56.8363 40.3866 174.3147 99 Y 5.0222 9.0867 120.8581 56.4162 42.6067 174.0238 100 D 5.2045 8.9047 124.0296 52.7894 42.0981 175.2496 101 L 4.4936 8.7457 126.6121 54.2309 43.5438 175.7415 102 N 4.7558 8.5800 119.7531 51.8749 40.4056 175.4073 103 A 3.9631 8.9733 128.5457 55.6016 18.4426 179.2626 104 A 4.1938 8.0809 116.2244 54.4905 18.5645 177.6128 105 N 4.8804 8.6531 113.0841 52.8335 39.1421 175.4372 106 V 4.3518 7.7819 119.1457 60.6582 32.4742 174.8070 107 G 4.0353 8.5561 115.6306 45.1848 0.0000 171.1983 108 W 4.7667 10.5772 130.5143 57.5154 34.0961 173.9142 109 N 3.4704 9.1630 123.3135 54.5992 36.6656 174.3084 110 G 4.0235 8.6238 105.0288 45.1439 0.0000 173.9097 111 S 4.3630 7.9629 113.3995 57.2894 64.6794 171.3784 112 T 5.3960 8.1145 108.1728 59.4556 71.2094 173.4368 113 F 4.3967 8.8195 117.8704 57.6570 39.1077 176.0474 114 A 4.3266 7.8668 129.7902 52.3415 18.6802 177.5157 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 0 M 8.29 4.44 0.00 1.53 1.25 0.00 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.43 0.00 1 P 0.00 5.22 0.00 2.18 2.13 0.00 3.74 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 2.06 1.83 0.00 2 V 8.43 4.96 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 1.10 0.00 0.00 0.97 0.00 0.00 3 F 9.32 5.40 0.00 3.14 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 4 T 8.10 4.95 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 1.17 0.00 0.00 5 I 8.46 4.52 1.82 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.70 0.91 0.00 0.00 6 R 8.45 4.87 0.00 1.81 1.79 0.00 3.20 0.00 0.00 3.06 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.42 0.00 7 T 9.23 5.25 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 1.21 0.00 0.00 8 N 8.81 5.36 0.00 2.74 3.02 0.00 0.00 6.32 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 9 V 8.05 3.75 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 0.94 0.00 0.00 0.93 0.00 0.00 10 C 8.70 4.83 0.00 3.03 2.83 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 11 R 9.85 3.96 0.00 1.94 2.55 0.00 3.24 0.00 0.00 3.10 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.62 0.00 12 D 8.06 4.46 0.00 2.64 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 13 S 8.22 4.49 0.00 3.92 3.87 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 14 V 7.49 3.88 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 0.78 0.00 0.00 0.96 0.00 0.00 15 P 0.00 4.28 0.00 2.23 1.99 0.00 3.66 0.00 0.00 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.12 0.00 16 D 8.77 4.75 0.00 2.79 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 17 T 7.77 4.33 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 1.22 0.00 0.00 18 L 7.64 3.80 0.00 1.94 1.78 0.97 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 19 L 8.20 4.17 0.00 1.75 1.76 0.97 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 20 S 8.02 4.16 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 21 D 8.37 4.32 0.00 2.81 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 22 L 8.84 4.07 0.00 1.74 1.70 1.12 -0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 23 T 7.64 3.91 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 1.22 0.00 0.00 24 K 8.32 3.93 0.00 1.94 1.95 0.00 1.63 0.00 0.00 1.65 0.00 0.00 2.93 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.44 1.48 7.81 25 Q 8.09 3.97 0.00 2.15 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.55 0.00 0.00 0.00 0.00 0.00 2.52 2.53 0.00 26 L 7.91 3.91 0.00 1.76 1.65 0.71 0.56 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 27 A 7.85 4.21 1.45 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 0.00 0.00 0.00 28 K 7.98 3.97 0.00 1.93 1.85 0.00 1.71 0.00 0.00 1.65 0.00 0.00 2.97 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.46 1.64 7.81 29 A 8.31 3.93 1.53 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 0.00 0.00 30 T 8.28 4.50 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 1.02 0.00 0.00 31 G 7.99 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 32 K 7.44 4.60 0.00 1.76 1.67 0.00 1.64 0.00 0.00 1.58 0.00 0.00 2.86 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.31 1.50 7.81 33 P 0.00 4.38 0.00 2.53 2.17 0.00 3.62 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 2.24 2.19 0.00 34 A 8.81 4.08 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 E 8.06 3.89 0.00 1.82 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 2.06 1.47 0.00 36 Y 7.63 4.46 0.00 3.09 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 37 I 7.57 5.26 2.01 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 1.12 1.86 0.95 0.00 0.00 38 A 8.62 4.86 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 39 I 8.50 5.11 1.95 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.83 1.03 0.00 0.00 40 H 9.10 4.94 0.00 3.14 3.04 0.00 5.55 0.00 0.00 0.00 0.00 6.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 I 8.63 4.72 1.90 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 1.27 0.82 0.92 0.00 0.00 42 V 9.18 4.24 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 1.04 0.00 0.00 0.67 0.00 0.00 43 P 0.00 4.66 0.00 2.36 2.07 0.00 3.97 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 1.93 1.97 0.00 44 D 8.74 4.40 0.00 2.78 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 45 Q 7.58 4.13 0.00 2.13 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.91 0.00 0.00 0.00 0.00 0.00 2.57 2.50 0.00 46 I 8.04 4.15 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 1.47 0.50 0.91 0.00 0.00 47 M 8.00 4.89 0.00 2.07 1.99 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.53 0.00 48 S 8.32 4.97 0.00 3.96 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 49 F 8.85 4.40 0.00 2.97 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 50 G 9.71 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 51 D 8.47 4.56 0.00 2.85 2.83 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 52 S 8.09 4.73 0.00 3.87 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 53 T 8.47 4.82 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 1.22 0.00 0.00 54 D 7.65 4.54 0.00 2.70 2.62 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 0.00 55 P 0.00 4.37 0.00 2.00 2.03 0.00 3.65 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 2.02 2.10 0.00 56 C 9.13 4.91 0.00 3.17 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 57 A 8.67 4.93 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 58 V 8.92 4.77 2.12 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 1.03 0.00 0.00 1.04 0.00 0.00 59 C 9.15 5.21 0.00 2.85 2.58 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 60 S 7.99 4.87 0.00 4.02 3.93 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 61 L 9.06 5.27 0.00 1.92 1.52 0.98 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 62 C 9.13 5.38 0.00 2.94 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 63 S 9.05 4.68 0.00 3.81 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 64 I 7.71 4.52 1.64 0.00 0.00 0.47 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 1.45 0.87 0.00 0.00 65 G 8.51 3.70 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 0.00 0.00 0.00 66 K 8.60 4.21 0.00 1.94 2.04 0.00 1.87 0.00 0.00 1.74 0.00 0.00 2.96 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.33 1.47 7.81 67 I 7.01 4.61 2.11 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 1.51 1.06 1.00 0.00 0.00 68 G 7.61 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 69 G 8.24 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 70 P 0.00 4.28 0.00 2.17 2.27 0.00 3.65 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 2.00 2.02 0.00 71 Q 7.87 3.46 0.00 2.05 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.84 0.00 0.00 0.00 0.00 0.00 2.40 2.36 0.00 72 N 7.71 3.56 0.00 2.52 2.12 0.00 0.00 7.16 9.03 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 73 K 7.42 3.90 0.00 1.92 1.80 0.00 1.64 0.00 0.00 1.54 0.00 0.00 2.91 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.43 1.37 7.81 74 S 7.64 3.97 0.00 3.76 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 75 Y 7.66 4.36 0.00 3.12 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 76 T 8.34 4.14 4.48 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 1.34 0.00 0.00 77 K 8.31 3.83 0.00 1.83 1.97 0.00 1.62 0.00 0.00 1.56 0.00 0.00 2.91 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.45 1.47 7.81 78 L 8.05 3.94 0.00 1.91 1.85 0.92 0.64 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 79 L 9.08 3.97 0.00 1.76 1.74 0.34 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 80 C 9.21 4.20 0.00 2.99 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 81 D 8.24 4.34 0.00 2.93 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 82 I 7.80 3.75 1.98 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 1.51 0.79 0.92 0.00 0.00 83 L 8.31 4.04 0.00 1.80 1.75 1.11 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 84 T 7.74 4.32 4.23 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 1.33 0.00 0.00 85 K 7.70 3.88 0.00 1.85 1.97 0.00 1.79 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 1.48 7.81 86 Q 8.14 4.16 0.00 2.14 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.50 0.00 0.00 0.00 0.00 0.00 2.55 2.55 0.00 87 L 7.69 4.40 0.00 1.84 1.70 0.95 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 88 N 7.87 4.80 0.00 2.84 2.88 0.00 0.00 7.28 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 89 I 7.52 4.29 1.86 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 1.45 0.75 0.86 0.00 0.00 90 P 0.00 4.26 0.00 2.37 2.13 0.00 3.64 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.90 0.00 91 A 8.61 3.99 1.29 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 0.00 0.00 92 N 7.99 4.43 0.00 2.73 2.88 0.00 0.00 5.87 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 93 R 7.33 3.31 0.00 1.48 1.42 0.00 2.96 0.00 0.00 2.95 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 1.22 0.00 94 V 7.08 4.95 2.20 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 0.85 0.00 0.00 0.93 0.00 0.00 95 Y 9.16 5.37 0.00 3.02 2.74 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 96 I 8.25 4.91 1.69 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 1.41 0.68 0.37 0.00 0.00 97 N 8.95 4.47 0.00 2.37 2.17 0.00 0.00 6.51 7.45 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 98 Y 8.12 4.93 0.00 2.84 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 99 Y 9.09 5.02 0.00 2.87 2.74 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 0.00 100 D 8.90 5.20 0.00 2.77 2.63 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 0.00 101 L 8.75 4.49 0.00 1.62 1.57 0.92 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 102 N 8.58 4.76 0.00 2.73 2.69 0.00 0.00 6.84 8.15 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 0.00 103 A 8.97 3.96 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 0.00 104 A 8.08 4.19 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 0.00 105 N 8.65 4.88 0.00 2.81 2.84 0.00 0.00 6.65 8.02 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 0.00 106 V 7.78 4.35 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 1.29 0.00 0.00 0.97 0.00 0.00 107 G 8.56 4.04 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 0.00 0.00 0.00 108 W 10.58 4.77 0.00 3.57 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 0.00 109 N 9.16 3.47 0.00 1.44 1.42 0.00 0.00 7.37 7.98 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 0.00 110 G 8.62 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 0.00 111 S 7.96 4.36 0.00 3.74 3.61 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.11 5.40 4.53 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 1.24 0.00 0.00 113 F 8.82 4.40 0.00 3.23 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 0.00 114 A 7.87 4.33 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