NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 M 4.1966 8.3049 120.3499 53.2404 32.9357 177.5827 5 T 2.9322 8.9665 113.9094 62.7643 65.5306 169.3163 6 D 4.3399 9.4395 128.0055 55.2530 41.9272 175.9881 7 R 4.3915 8.4875 124.2283 56.3866 30.8885 177.3510 8 Y 3.5729 8.7585 119.7538 56.5755 36.1739 175.9170 9 S 4.3217 7.3316 112.4848 58.5562 64.4466 174.8277 10 F 4.9226 6.4869 115.9114 54.9430 39.9035 175.4566 11 S 4.3512 8.6422 117.5523 58.8477 63.0408 174.6309 12 L 4.5781 8.4780 122.8826 54.9741 42.3254 176.4036 13 T 4.4272 7.7581 115.7811 61.8039 70.0191 172.9070 14 T 4.5543 7.9430 115.6272 59.4968 72.1681 172.2810 15 F 4.7938 8.5121 120.0001 56.5979 40.0557 176.2205 16 S 4.7044 8.7608 120.0986 56.3240 64.4191 173.4315 17 P 4.3708 0.0000 0.0000 65.4844 31.0466 177.7144 18 S 4.2952 8.0609 110.3599 58.6712 63.4645 174.9073 19 G 3.9802 8.8508 110.0333 45.6135 0.0000 173.5564 20 K 4.4653 7.8007 118.9093 55.1843 33.5256 176.1674 21 L 4.6978 7.3229 121.8552 51.7168 40.9021 177.5131 22 G 3.2480 7.6588 108.0502 47.7869 0.0000 172.1201 23 Q 3.9501 7.7847 119.9798 58.4986 28.7744 179.7353 24 I 3.6744 7.5498 120.4821 64.2269 37.1413 178.0453 25 D 4.3283 7.6982 119.1808 57.6986 40.6883 178.1425 26 Y 4.4113 7.9896 117.1836 61.2377 37.9806 178.5820 27 A 4.0462 8.3109 121.7252 55.5053 18.4700 179.5217 28 L 3.9804 8.1058 117.2184 58.3301 41.7994 179.9169 29 T 3.8561 8.0683 115.2497 66.8009 68.2617 176.4303 30 A 4.0651 7.9591 121.0780 55.1049 18.6034 179.5482 31 V 3.7434 7.6147 116.5336 66.0050 31.4074 178.4089 32 K 4.0071 7.8337 117.4301 59.5576 31.9230 179.0772 33 Q 4.2335 7.9447 117.2561 57.5212 28.8263 177.1739 34 G 3.7448 7.0315 108.0385 44.8412 0.0000 173.4112 35 V 3.6405 7.8778 119.7984 62.5666 31.9143 176.1113 36 T 4.1677 8.2044 122.8632 64.2476 69.5360 173.1438 37 S 4.9909 8.2007 117.8804 57.1730 66.2326 172.7912 38 L 4.8637 9.3554 122.0164 54.6205 44.5892 174.8479 39 G 4.5785 8.3641 104.5841 44.9409 0.0000 172.4862 40 I 4.7006 8.9761 124.2875 59.2261 41.0997 174.0935 41 K 4.7071 8.8369 128.4962 55.2017 33.3241 175.6107 42 A 4.8615 8.9465 131.7240 50.4689 21.6472 175.8890 43 T 4.1737 8.4390 106.6066 63.8311 69.1537 174.9048 44 N 4.9729 8.8299 118.7468 50.3864 37.8895 174.1228 45 G 4.0401 7.1240 107.7809 46.6999 0.0000 171.6005 46 V 5.1133 7.6744 118.0924 61.1168 35.1485 174.7212 47 V 4.7072 8.7314 123.5955 59.9096 34.7870 174.0981 48 I 5.1533 8.4097 116.3847 59.3047 40.3013 174.2552 49 A 4.7088 8.7788 125.1688 51.6616 23.1920 174.5458 50 T 4.6142 8.0799 112.6906 61.5876 70.7276 171.6419 51 E 4.4824 7.9752 124.0156 54.5637 31.1290 176.7266 52 K 4.2652 8.4826 126.6543 55.0975 31.3007 176.9104 53 K 4.2327 7.9451 127.7309 54.6738 30.3226 176.1758 54 S 3.9750 7.8647 113.0727 59.2263 62.8263 173.9520 55 S 4.5018 8.6553 122.3511 58.2629 63.0199 173.8455 56 S 4.5631 7.3211 112.2260 56.9081 64.5951 175.4761 57 P 4.3348 0.0000 0.0000 65.0575 31.1953 177.0528 58 L 4.2145 7.4338 117.7204 55.6201 42.0866 176.9322 59 A 4.2757 7.7325 121.5460 52.1900 19.0243 177.4713 60 M 4.6201 7.9582 119.7256 52.6765 32.1171 176.9474 61 S 4.0409 8.3784 117.9669 61.3194 64.0902 176.8743 62 E 4.1061 8.3703 120.5909 59.4139 29.3071 178.7690 63 T 3.9713 7.9552 107.4417 63.1478 68.7452 173.4174 64 L 4.6765 7.6654 123.7365 53.3421 44.1366 175.2922 65 S 4.8427 8.7462 121.9926 56.9083 64.9836 174.2779 66 K 4.3615 8.6617 123.1893 56.6968 32.7504 175.7537 67 V 4.7344 7.7305 118.6657 61.4830 32.6059 174.5319 68 S 4.9414 9.1463 124.7984 56.4950 65.7712 173.3637 69 L 4.5783 8.4736 125.7302 55.0062 42.2014 175.9883 70 L 4.3467 9.2200 127.2543 56.4195 42.7803 176.4662 71 T 4.7582 7.3104 106.2376 58.7068 71.8717 172.3304 72 P 4.5178 0.0000 0.0000 64.5463 31.1866 176.4025 73 D 4.9205 8.3346 117.5339 53.7770 42.5931 175.0100 74 I 4.6547 8.0766 120.3574 59.6125 41.0953 174.6829 75 G 4.6004 8.8785 112.6301 44.4385 0.0000 171.7165 76 A 5.1659 9.2010 121.5612 50.2766 22.9301 175.6244 77 V 5.3230 8.6399 118.2521 60.1656 34.7304 173.2312 78 Y 4.8618 7.8775 118.1363 56.4036 41.9326 173.6586 79 S 4.2121 8.6495 114.0671 57.3628 67.6092 172.6175 80 G 3.9466 8.4301 111.8067 44.9218 0.0000 175.8790 81 M 4.4358 9.0167 127.1681 54.4514 32.3483 176.4782 82 G 3.7741 8.9561 111.8831 47.5105 0.0000 172.0271 83 P 4.2326 0.0000 0.0000 65.1911 31.3911 178.2697 84 D 4.3146 8.0551 116.8308 57.7004 40.7873 178.0458 85 Y 3.9675 7.8038 119.8097 60.5375 38.4381 178.1736 86 R 3.5529 7.9884 119.6335 59.6105 30.1759 179.0245 87 V 3.5730 7.5405 111.7274 64.2775 31.3883 178.5607 88 L 3.8713 7.8229 118.8482 57.7542 41.4016 179.7499 89 V 3.3763 7.4479 118.2743 65.7929 31.3342 177.9526 90 D 4.2793 7.6705 118.6781 57.1526 40.7037 178.8144 91 K 3.9490 8.2042 119.2535 59.4627 32.1202 179.5887 92 S 4.0815 8.3111 115.7213 61.8035 62.5775 177.0376 93 R 3.9559 7.7944 119.2986 58.8889 29.9145 178.9057 94 K 4.0714 8.0075 119.8174 59.4548 32.3261 179.3584 95 V 3.7624 8.5460 120.8880 64.1814 31.1015 178.1020 96 A 4.0712 8.0828 121.0854 54.9422 17.9970 178.6943 97 H 4.3522 8.4976 115.4879 58.4976 29.1486 177.5757 98 T 3.9092 7.9082 110.8087 64.6315 68.2137 175.2721 99 S 4.7376 7.7825 114.2838 58.1193 62.5789 173.5219 100 Y 4.5152 6.9452 120.4566 58.0097 45.1815 175.2463 101 K 4.0085 8.5985 124.5847 59.5045 32.9073 177.3958 102 R 4.1412 8.1613 121.6896 56.3608 29.9576 176.0699 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 4 M 8.30 4.20 0.00 2.00 1.54 0.00 0.00 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.53 0.00 5 T 8.97 2.93 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 1.20 0.00 0.00 6 D 9.44 4.34 0.00 2.65 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 7 R 8.49 4.39 0.00 1.59 1.82 0.00 3.22 0.00 0.00 3.17 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.57 0.00 8 Y 8.76 3.57 0.00 2.95 2.55 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 9 S 7.33 4.32 0.00 3.98 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 10 F 6.49 4.92 0.00 3.16 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 11 S 8.64 4.35 0.00 3.96 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 12 L 8.48 4.58 0.00 1.63 1.74 0.81 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 13 T 7.76 4.43 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 1.03 0.00 0.00 14 T 7.94 4.55 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 1.23 0.00 0.00 15 F 8.51 4.79 0.00 3.09 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 16 S 8.76 4.70 0.00 4.02 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 17 P 0.00 4.37 0.00 2.08 2.19 0.00 3.70 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 2.05 2.11 0.00 18 S 8.06 4.30 0.00 4.00 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 19 G 8.85 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 0.00 0.00 0.00 20 K 7.80 4.47 0.00 1.76 1.85 0.00 1.66 0.00 0.00 1.67 0.00 0.00 2.96 0.00 0.00 3.33 0.00 0.00 0.00 0.00 1.44 1.56 7.81 21 L 7.32 4.70 0.00 1.53 1.36 0.67 0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 22 G 7.66 3.25 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 23 Q 7.78 3.95 0.00 1.96 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.87 0.00 0.00 0.00 0.00 0.00 2.40 2.51 0.00 24 I 7.55 3.67 1.89 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.45 0.88 0.00 0.00 25 D 7.70 4.33 0.00 2.64 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 26 Y 7.99 4.41 0.00 3.05 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 27 A 8.31 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 28 L 8.11 3.98 0.00 1.99 1.77 0.93 0.61 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 29 T 8.07 3.86 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 1.22 0.00 0.00 30 A 7.96 4.07 1.38 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 31 V 7.61 3.74 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 1.12 0.00 0.00 1.02 0.00 0.00 32 K 7.83 4.01 0.00 1.99 1.86 0.00 1.78 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.48 1.64 7.81 33 Q 7.94 4.23 0.00 2.06 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.93 0.00 0.00 0.00 0.00 0.00 2.68 2.52 0.00 34 G 7.03 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 0.00 0.00 0.00 35 V 7.88 3.64 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 0.80 0.00 0.00 0.87 0.00 0.00 36 T 8.20 4.17 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 1.16 0.00 0.00 37 S 8.20 4.99 0.00 3.70 3.63 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 38 L 9.36 4.86 0.00 1.64 1.74 0.90 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 39 G 8.36 4.58 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 0.00 0.00 0.00 40 I 8.98 4.70 1.87 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 0.92 0.91 0.00 0.00 41 K 8.84 4.71 0.00 1.76 1.70 0.00 1.74 0.00 0.00 1.71 0.00 0.00 2.77 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.36 1.43 7.81 42 A 8.95 4.86 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 43 T 8.44 4.17 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 44 N 8.83 4.97 0.00 2.80 2.88 0.00 0.00 5.88 7.00 0.00 0.00 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 G 7.12 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 46 V 7.67 5.11 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 0.92 0.00 0.00 0.93 0.00 0.00 47 V 8.73 4.71 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 0.93 0.00 0.00 48 I 8.41 5.15 1.88 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 1.29 0.75 0.92 0.00 0.00 49 A 8.78 4.71 1.20 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 0.00 0.00 50 T 8.08 4.61 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 1.13 0.00 0.00 51 E 7.98 4.48 0.00 1.91 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 2.21 2.24 0.00 52 K 8.48 4.27 0.00 1.77 1.76 0.00 1.92 0.00 0.00 1.64 0.00 0.00 2.98 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.40 1.41 7.81 53 K 7.95 4.23 0.00 1.66 1.73 0.00 1.76 0.00 0.00 1.66 0.00 0.00 3.04 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.40 1.47 7.81 54 S 7.86 3.97 0.00 3.86 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 S 8.66 4.50 0.00 3.91 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 56 S 7.32 4.56 0.00 3.79 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 57 P 0.00 4.33 0.00 2.21 2.17 0.00 3.81 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 1.99 1.99 0.00 58 L 7.43 4.21 0.00 1.62 1.76 0.92 0.76 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 59 A 7.73 4.28 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 60 M 7.96 4.62 0.00 2.34 1.99 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.48 0.00 61 S 8.38 4.04 0.00 3.98 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 62 E 8.37 4.11 0.00 2.11 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 0.00 2.40 2.36 0.00 63 T 7.96 3.97 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 1.24 0.00 0.00 64 L 7.67 4.68 0.00 1.64 1.59 0.96 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 65 S 8.75 4.84 0.00 3.93 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 K 8.66 4.36 0.00 1.81 1.84 0.00 1.60 0.00 0.00 1.69 0.00 0.00 2.53 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.62 1.47 7.81 67 V 7.73 4.73 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 0.85 0.00 0.00 0.95 0.00 0.00 68 S 9.15 4.94 0.00 3.84 3.73 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 69 L 8.47 4.58 0.00 1.67 1.58 0.93 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 70 L 9.22 4.35 0.00 1.61 1.68 0.91 0.78 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 71 T 7.31 4.76 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 72 P 0.00 4.52 0.00 2.20 2.22 0.00 3.70 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 1.98 1.99 0.00 73 D 8.33 4.92 0.00 2.60 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 74 I 8.08 4.65 1.86 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 1.13 0.63 0.90 0.00 0.00 75 G 8.88 4.60 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 0.00 0.00 0.00 76 A 9.20 5.17 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 77 V 8.64 5.32 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 0.99 0.00 0.00 0.90 0.00 0.00 78 Y 7.88 4.86 0.00 2.93 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 79 S 8.65 4.21 0.00 3.74 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 80 G 8.43 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 81 M 9.02 4.44 0.00 2.11 2.09 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.74 2.64 0.00 82 G 8.96 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 83 P 0.00 4.23 0.00 2.16 2.12 0.00 3.63 0.00 0.00 3.80 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 84 D 8.06 4.31 0.00 2.90 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 85 Y 7.80 3.97 0.00 2.44 2.35 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 86 R 7.99 3.55 0.00 1.97 1.97 0.00 3.13 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.61 0.00 87 V 7.54 3.57 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 0.73 0.00 0.00 0.96 0.00 0.00 88 L 7.82 3.87 0.00 1.72 1.60 0.93 0.55 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 89 V 7.45 3.38 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 0.87 0.00 0.00 -0.02 0.00 0.00 90 D 7.67 4.28 0.00 2.75 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 91 K 8.20 3.95 0.00 1.88 1.82 0.00 1.62 0.00 0.00 1.61 0.00 0.00 2.89 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.42 1.58 7.81 92 S 8.31 4.08 0.00 3.95 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 93 R 7.79 3.96 0.00 1.88 1.96 0.00 3.18 0.00 0.00 3.11 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.72 0.00 94 K 8.01 4.07 0.00 1.88 1.90 0.00 1.61 0.00 0.00 1.68 0.00 0.00 2.99 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.43 1.41 7.81 95 V 8.55 3.76 2.16 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 1.08 0.00 0.00 0.95 0.00 0.00 96 A 8.08 4.07 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 97 H 8.50 4.35 0.00 3.41 3.36 0.00 5.84 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 T 7.91 3.91 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 1.29 0.00 0.00 99 S 7.78 4.74 0.00 4.11 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 0.00 100 Y 6.95 4.52 0.00 2.91 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 0.00 101 K 8.60 4.01 0.00 1.75 1.78 0.00 1.70 0.00 0.00 1.56 0.00 0.00 2.77 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.45 1.44 7.81 102 R 8.16 4.14 0.00 1.93 1.83 0.00 3.27 0.00 0.00 3.28 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.72 0.00