NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 M 4.5326 8.3044 120.2869 55.3056 33.8765 173.9167 3 V 4.2109 8.0763 121.6160 59.9625 33.7021 172.9009 4 W 4.6608 9.1386 135.0000 57.4044 31.6191 174.9266 5 T 4.1499 8.2755 124.0105 61.5158 67.0224 172.5650 6 P 4.5259 0.0000 0.0000 63.2380 32.2616 175.6225 7 V 4.0767 7.4484 119.7188 62.5699 33.1668 175.3086 8 N 4.2700 8.6379 125.2447 54.9934 35.9942 173.7326 9 N 4.9442 7.5758 108.2896 52.9627 40.2195 174.1671 10 K 4.1276 8.3942 116.1162 56.4795 32.7101 176.5568 11 M 4.9876 8.3701 121.0199 54.0042 35.0861 175.4587 12 F 4.5325 8.1761 117.1153 57.1360 41.1885 176.6644 13 E 3.5139 8.4388 121.5260 57.2540 27.6774 175.2941 14 T 3.8965 8.3108 122.4099 66.2269 69.0301 174.3884 15 F 4.5193 9.0023 123.8999 57.6156 36.6656 176.5548 16 S 4.4238 8.2220 115.1506 60.6218 62.9402 174.5783 17 Y 4.3722 8.2847 117.0180 58.1393 38.1933 175.0782 18 L 4.6703 7.5734 120.0566 52.1648 43.6123 174.4856 19 P 4.4393 0.0000 0.0000 61.8626 31.7702 175.0654 20 P 4.3167 0.0000 0.0000 62.7407 31.7921 176.3920 21 L 4.0032 8.2932 122.5434 54.6038 42.1408 178.0013 22 T 4.1832 8.2142 114.2228 61.2545 70.9750 175.0872 23 D 4.3566 8.5908 121.1812 57.6187 40.7860 178.8327 24 E 3.9107 8.0741 119.2014 59.4219 29.7438 178.7903 25 Q 3.9385 8.0077 118.0161 58.7894 28.7206 178.7189 26 I 3.7139 8.1198 121.0443 64.4166 37.1398 178.1996 27 A 4.0473 8.2801 121.4937 55.2459 18.1378 179.5435 28 A 3.9627 8.1528 119.1661 55.4430 18.4365 179.9189 29 Q 4.1480 8.1622 116.6337 59.1328 28.7992 179.1404 30 V 3.7530 8.1951 119.3868 66.1286 31.5333 177.7296 31 D 4.4338 8.4923 118.8953 57.5666 40.5977 178.2474 32 Y 4.2044 8.1226 119.9760 60.6638 38.8162 177.9120 33 I 3.7919 7.9717 120.8013 64.6477 37.4293 178.6184 34 V 3.5391 7.8538 118.6054 65.9426 31.1624 177.9309 35 A 3.9706 8.1996 119.8418 54.4197 18.2590 178.2995 36 N 4.1515 7.1799 112.0246 51.9981 38.7189 175.5766 37 G 3.7568 7.1993 107.9330 46.1263 0.0000 174.1563 38 W 4.9621 7.5105 118.9165 56.0674 30.6781 176.2924 39 I 4.3921 8.8140 123.0195 59.4418 37.8967 174.0413 40 P 4.8834 0.0000 0.0000 62.8922 32.8155 175.1934 41 C 4.9935 8.9247 121.4311 58.4142 35.5629 172.4812 42 L 5.3316 8.7373 123.8481 53.2910 44.3499 175.2016 43 E 5.6431 9.2464 120.8214 55.0034 34.2495 174.4841 44 F 5.6560 9.1755 116.0919 56.0322 42.1886 172.9417 45 A 4.4571 8.3811 119.8716 50.2276 22.5639 176.3068 46 E 4.2656 8.6115 118.9436 55.7387 30.7016 177.6680 47 A 4.2710 8.8479 122.9580 55.8873 18.3906 179.6740 48 D 4.5750 8.1231 112.9671 56.2029 41.0570 177.0864 49 K 4.6006 7.9439 117.2751 55.9909 32.7851 176.8139 50 A 3.7646 7.6232 124.4608 53.8366 18.7365 178.2008 51 Y 4.7453 7.3877 111.2530 55.6352 40.4640 176.0370 52 V 3.9481 8.3316 116.1735 62.2912 32.2444 175.6121 53 S 4.7754 8.8999 116.7474 56.6570 66.3703 173.8338 54 N 5.2028 8.5374 114.3885 52.8048 39.0972 176.2320 55 E 3.9733 8.2175 121.0497 59.6895 29.5486 179.1126 56 S 4.0325 8.8976 115.6626 60.6153 62.8388 176.0371 57 A 2.5800 7.6743 123.3982 53.6296 17.7282 179.0244 58 I 3.5312 6.9674 116.8059 63.7265 38.0058 177.1047 59 R 4.2757 7.5012 116.3704 55.6623 30.5299 176.2392 60 F 5.0690 7.1279 118.0074 55.9428 41.2919 177.1061 61 G 4.0163 8.2371 115.6828 46.2257 0.0000 174.9633 62 S 4.6079 8.4378 113.2858 58.9005 62.3101 174.5382 63 V 4.4272 7.3034 107.4393 61.1328 32.9935 177.8218 64 S 4.4516 8.2096 116.0034 60.0399 63.5129 173.5584 65 C 3.9772 8.1334 118.7260 61.5826 27.9527 173.1951 66 L 3.5801 8.4199 123.2842 55.6231 39.0205 173.1902 67 Y 4.3884 7.7429 119.3428 55.9368 40.0561 174.5372 68 Y 4.8403 7.1476 123.1730 56.3104 42.3842 174.6962 69 D 4.4924 8.7982 123.1059 55.4031 41.6992 177.1083 70 N 4.5438 8.9066 116.7875 54.0228 36.0146 176.0569 71 R 3.9368 7.9476 118.3198 59.3578 30.3513 177.1129 72 Y 4.3903 7.6818 114.6312 58.0462 38.3494 175.4195 73 W 5.0886 8.6948 124.8502 55.5720 32.5429 174.5102 74 T 4.4105 8.0918 116.8962 62.4884 69.8175 174.4481 75 M 4.6671 8.5479 126.3722 55.3137 33.1935 175.1543 76 W 4.8061 9.5001 135.0000 56.3314 31.4219 176.7652 77 K 3.4025 8.5377 128.2960 57.5536 30.7989 177.8566 78 L 4.9311 8.2512 124.9686 52.6819 45.1960 174.0005 79 P 4.3642 0.0000 0.0000 63.4119 32.2338 177.5094 80 M 4.3021 8.5667 123.1111 53.7536 30.4493 175.7924 81 F 4.4906 7.3607 118.4809 58.8146 40.0205 176.6146 82 G 3.9949 9.1257 112.8682 45.5139 0.0000 173.0324 83 C 4.2940 7.9393 121.1862 59.4995 31.6817 173.1034 84 R 4.5498 8.6144 122.5412 55.5564 29.9495 174.4615 85 D 4.8047 7.9410 118.8369 52.0265 42.1902 174.4369 86 P 4.3462 0.0000 0.0000 66.3588 31.0500 178.1876 87 M 4.1413 8.1954 117.9446 57.9843 31.8798 178.3898 88 Q 3.9722 7.9952 119.6372 59.0893 29.2274 178.5450 89 V 3.6197 7.7443 118.7297 66.0724 31.8068 177.8079 90 L 4.0324 7.9632 118.7417 57.9618 41.4046 179.7861 91 R 3.9867 8.2780 118.0852 59.2829 29.9329 179.0031 92 E 4.1234 8.1940 118.2953 59.1568 29.4624 179.2158 93 I 3.5323 7.8425 120.0701 64.3766 37.2181 178.4760 94 V 3.4853 7.6331 118.3483 65.9544 31.3617 177.9235 95 A 3.9520 8.0685 120.5001 55.1554 18.2700 179.1522 96 C 2.0000 7.7057 117.7167 62.1243 30.9663 176.0320 97 T 3.7620 7.5264 111.1650 64.2906 68.0373 176.5057 98 K 3.8278 7.7067 121.8400 59.3441 32.3215 178.4438 99 A 3.9700 7.5349 119.9001 53.5125 19.7634 177.6405 100 F 4.7165 7.7475 115.5550 55.1239 39.0942 173.9720 101 P 4.4442 0.0000 0.0000 64.1441 31.9211 177.8352 102 D 4.6296 8.0463 116.6810 53.9517 41.3507 175.6101 103 A 4.7524 7.3551 121.1375 50.5286 20.9923 177.1059 104 Y 4.2235 8.5462 117.7902 58.0208 39.4418 175.3856 105 V 5.2766 8.9225 122.6203 61.2851 35.4359 174.2049 106 R 5.0120 9.5371 123.6551 54.2975 33.1608 173.6714 107 L 4.8279 8.1988 123.4087 53.8897 43.8590 175.6880 108 V 4.8390 8.7116 118.3090 59.6028 36.5188 174.0963 109 A 4.8036 8.0671 121.4498 50.5381 22.8588 175.2201 110 F 5.2402 8.9172 119.0179 55.7060 42.7613 174.1512 111 D 5.3480 8.7979 122.4909 52.7323 42.3561 176.5875 112 N 4.7501 9.1767 123.0877 54.1737 38.3673 176.2616 113 Q 4.2226 8.7344 118.8562 58.7965 29.1190 177.6194 114 K 4.0098 8.3355 115.1519 57.1855 32.9115 176.5662 115 Q 3.4851 8.0159 118.5349 55.8480 26.9378 172.4740 116 V 4.4840 7.7643 117.4126 60.1206 34.9974 173.9795 117 Q 4.3726 8.7246 123.1620 56.4889 29.3000 175.5279 118 I 4.2195 8.1214 124.9180 61.1942 39.7809 174.4450 119 M 4.6126 6.7146 117.3793 54.5877 34.3731 173.7079 120 G 4.8009 8.3002 105.9866 47.1731 0.0000 172.3333 121 F 5.0510 7.0858 115.9761 55.2917 41.1846 172.7865 122 L 4.5185 8.8537 122.6204 55.5439 42.0050 176.7757 123 V 4.5317 8.9651 118.2059 61.4708 34.1469 175.7038 124 Q 4.6010 7.8426 121.3555 54.3995 32.4010 173.3111 125 R 4.3142 8.1089 121.5477 53.0933 32.7305 173.7353 126 P 4.1911 0.0000 0.0000 62.4258 31.9400 177.9972 127 K 4.0062 8.4816 121.2287 59.6717 32.1575 178.4160 128 T 3.9775 7.8151 111.5989 63.7194 67.6286 174.3417 129 A 4.2706 7.6297 124.7619 53.0415 18.6575 177.2300 130 R 4.6647 8.8075 120.1884 55.8852 31.7167 175.4112 131 D 5.1859 8.7924 115.7237 52.0097 39.6842 175.2795 132 F 5.3706 7.8512 113.0239 55.5721 41.1213 173.5941 133 Q 4.4223 8.3140 119.5967 52.8972 31.3428 174.2437 134 P 4.4657 0.0000 0.0000 62.4210 32.2497 176.9992 135 A 3.9522 8.8499 122.8194 55.6323 18.1775 179.2035 136 N 4.7184 8.0933 108.9798 53.7140 37.6105 175.3888 137 K 4.4591 7.8203 117.2677 56.4036 33.1702 177.3307 138 R 3.5820 7.7233 121.2130 57.7229 30.1428 176.6563 139 S 5.1127 7.5010 110.1110 56.3389 66.0078 174.2495 140 V 3.9944 8.6053 114.4545 61.7636 32.2575 175.6255 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 1.99 2.16 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 2.54 2.58 0.00 3 V 8.08 4.21 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 1.06 0.00 0.00 0.97 0.00 0.00 4 W 9.14 4.66 0.00 3.49 3.05 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 0.00 0.00 0.00 5 T 8.28 4.15 4.08 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 1.11 0.00 0.00 6 P 0.00 4.53 0.00 2.23 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 1.96 0.00 7 V 7.45 4.08 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 0.91 0.00 0.00 8 N 8.64 4.27 0.00 2.92 2.86 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 7.58 4.94 0.00 2.64 2.68 0.00 0.00 7.30 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 8.39 4.13 0.00 1.99 1.70 0.00 1.44 0.00 0.00 0.61 0.00 0.00 2.39 0.00 0.00 2.28 0.00 0.00 0.00 0.00 1.19 1.26 7.81 11 M 8.37 4.99 0.00 2.10 2.11 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.67 0.00 12 F 8.18 4.53 0.00 3.06 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 13 E 8.44 3.51 0.00 2.12 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 2.18 2.12 0.00 14 T 8.31 3.90 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 0.18 0.00 0.00 15 F 9.00 4.52 0.00 3.30 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 16 S 8.22 4.42 0.00 4.12 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 0.00 17 Y 8.28 4.37 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 7.57 4.67 0.00 1.85 1.61 0.86 0.90 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 4.44 0.00 2.03 1.99 0.00 3.70 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 2.02 2.12 0.00 20 P 0.00 4.32 0.00 2.04 2.01 0.00 3.69 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 2.06 2.17 0.00 21 L 8.29 4.00 0.00 1.57 1.47 0.14 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 22 T 8.21 4.18 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 8.59 4.36 0.00 2.78 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 8.07 3.91 0.00 2.02 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 0.00 2.35 2.39 0.00 25 Q 8.01 3.94 0.00 2.28 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.58 0.00 0.00 0.00 0.00 0.00 2.25 2.32 0.00 26 I 8.12 3.71 2.06 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 1.66 0.87 1.08 0.00 0.00 27 A 8.28 4.05 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.15 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 8.16 4.15 0.00 2.56 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.75 0.00 0.00 0.00 0.00 0.00 2.45 2.08 0.00 30 V 8.20 3.75 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 1.09 0.00 0.00 1.10 0.00 0.00 31 D 8.49 4.43 0.00 2.98 2.76 0.00 0.00 0.00 0.00 0.00 0.00 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 8.12 4.20 0.00 3.08 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 7.97 3.79 2.13 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.78 1.06 0.00 0.00 34 V 7.85 3.54 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 1.01 0.00 0.00 0.98 0.00 0.00 35 A 8.20 3.97 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 36 N 7.18 4.15 0.00 1.44 1.42 0.00 0.00 7.02 8.76 0.00 0.00 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 7.20 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.51 4.96 0.00 3.33 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 39 I 8.81 4.39 2.12 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.02 0.72 0.00 0.00 40 P 0.00 4.88 0.00 2.08 1.97 0.00 3.78 0.00 0.00 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.12 0.00 41 C 8.92 4.99 0.00 3.08 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 42 L 8.74 5.33 0.00 1.85 1.62 0.89 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 43 E 9.25 5.64 0.00 2.05 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 2.37 2.33 0.00 44 F 9.18 5.66 0.00 3.11 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 45 A 8.38 4.46 -0.25 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 46 E 8.61 4.27 0.00 2.17 2.10 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 2.29 2.27 0.00 47 A 8.85 4.27 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 8.12 4.58 0.00 2.70 2.76 0.00 0.00 0.00 0.00 0.00 0.00 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 7.94 4.60 0.00 1.58 1.64 0.00 1.70 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.31 1.41 7.81 50 A 7.62 3.76 0.39 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 51 Y 7.39 4.75 0.00 2.90 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 52 V 8.33 3.95 1.98 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 0.54 0.00 0.00 0.76 0.00 0.00 53 S 8.90 4.78 0.00 4.03 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 54 N 8.54 5.20 0.00 2.75 2.85 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 8.22 3.97 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 2.38 2.37 0.00 56 S 8.90 4.03 0.00 4.03 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 57 A 7.67 2.58 1.15 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 58 I 6.97 3.53 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 1.47 0.80 0.87 0.00 0.00 59 R 7.50 4.28 0.00 1.85 1.99 0.00 3.19 0.00 0.00 3.21 7.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.56 0.00 60 F 7.13 5.07 0.00 2.99 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 61 G 8.24 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 62 S 8.44 4.61 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 7.30 4.43 1.82 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 0.66 0.00 0.00 0.46 0.00 0.00 64 S 8.21 4.45 0.00 4.10 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 0.00 65 C 8.13 3.98 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 8.42 3.58 0.00 1.77 1.75 0.95 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 67 Y 7.74 4.39 0.00 2.90 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 68 Y 7.15 4.84 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 8.80 4.49 0.00 2.79 2.66 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 0.00 0.00 0.00 0.00 70 N 8.91 4.54 0.00 3.05 3.22 0.00 0.00 6.99 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 7.95 3.94 0.00 1.50 1.69 0.00 3.07 0.00 0.00 3.27 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.57 0.00 72 Y 7.68 4.39 0.00 3.06 2.85 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 73 W 8.69 5.09 0.00 3.07 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 74 T 8.09 4.41 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 0.97 0.00 0.00 75 M 8.55 4.67 0.00 2.09 2.04 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.78 0.00 76 W 9.50 4.81 0.00 3.65 3.28 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 77 K 8.54 3.40 0.00 1.68 0.76 0.00 1.70 0.00 0.00 1.53 0.00 0.00 2.73 0.00 0.00 2.36 0.00 0.00 0.00 0.00 0.80 0.21 7.81 78 L 8.25 4.93 0.00 1.60 1.57 1.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 79 P 0.00 4.36 0.00 0.64 1.81 0.00 3.65 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 2.15 0.00 80 M 8.57 4.30 0.00 2.04 2.01 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 2.69 2.53 0.00 81 F 7.36 4.49 0.00 3.10 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 82 G 9.13 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 83 C 7.94 4.29 0.00 3.03 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 84 R 8.61 4.55 0.00 1.90 1.93 0.00 3.04 0.00 0.00 3.15 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.58 0.00 85 D 7.94 4.80 0.00 2.75 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 86 P 0.00 4.35 0.00 2.33 2.34 0.00 3.77 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.08 0.00 87 M 8.20 4.14 0.00 2.10 2.30 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.56 0.00 88 Q 8.00 3.97 0.00 2.15 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.81 0.00 0.00 0.00 0.00 0.00 2.40 2.41 0.00 89 V 7.74 3.62 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 1.04 0.00 0.00 0.97 0.00 0.00 90 L 7.96 4.03 0.00 1.91 1.72 0.95 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 91 R 8.28 3.99 0.00 2.03 2.01 0.00 3.15 0.00 0.00 3.18 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.90 0.00 92 E 8.19 4.12 0.00 2.26 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 2.61 2.66 0.00 93 I 7.84 3.53 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 1.35 1.09 0.86 0.00 0.00 94 V 7.63 3.49 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 0.98 0.00 0.00 0.97 0.00 0.00 95 A 8.07 3.95 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 96 C 7.71 2.00 0.00 1.25 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 0.00 0.00 0.00 0.00 97 T 7.53 3.76 4.33 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 1.14 0.00 0.00 98 K 7.71 3.83 0.00 1.76 1.98 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 1.38 1.38 7.81 99 A 7.53 3.97 1.19 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 0.00 0.00 100 F 7.75 4.72 0.00 2.81 2.79 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 0.00 101 P 0.00 4.44 0.00 2.12 2.11 0.00 3.26 0.00 0.00 3.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.87 0.00 102 D 8.05 4.63 0.00 2.69 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 7.36 4.75 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 0.00 104 Y 8.55 4.22 0.00 2.59 2.81 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 0.00 105 V 8.92 5.28 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 0.97 0.00 0.00 0.90 0.00 0.00 106 R 9.54 5.01 0.00 1.82 1.93 0.00 2.32 0.00 0.00 2.25 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.37 0.00 107 L 8.20 4.83 0.00 1.51 0.78 0.84 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 108 V 8.71 4.84 1.61 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 0.44 0.00 0.00 0.50 0.00 0.00 109 A 8.07 4.80 1.14 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 0.00 0.00 110 F 8.92 5.24 0.00 2.99 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 0.00 111 D 8.80 5.35 0.00 2.35 2.44 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 0.00 112 N 9.18 4.75 0.00 2.94 3.05 0.00 0.00 6.32 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 8.73 4.22 0.00 2.24 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 7.06 0.00 0.00 0.00 0.00 0.00 2.46 2.54 0.00 114 K 8.34 4.01 0.00 1.75 1.87 0.00 1.88 0.00 0.00 1.63 0.00 0.00 2.98 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.47 1.61 7.81 115 Q 8.02 3.49 0.00 2.14 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.71 0.00 0.00 0.00 0.00 0.00 2.24 2.32 0.00 116 V 7.76 4.48 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 0.51 0.00 0.00 0.91 0.00 0.00 117 Q 8.72 4.37 0.00 2.17 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.87 0.00 0.00 0.00 0.00 0.00 2.18 1.98 0.00 118 I 8.12 4.22 1.19 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.06 0.34 -0.58 0.00 0.00 119 M 6.71 4.61 0.00 2.24 2.29 0.00 0.00 0.00 0.00 0.00 2.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.73 0.00 120 G 8.30 4.80 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 0.00 0.00 0.00 121 F 7.09 5.05 0.00 3.22 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 0.00 122 L 8.85 4.52 0.00 1.59 1.61 0.61 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 123 V 8.97 4.53 2.10 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 0.75 0.00 0.00 0.92 0.00 0.00 124 Q 7.84 4.60 0.00 1.99 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.80 0.00 0.00 0.00 0.00 0.00 2.27 2.23 0.00 125 R 8.11 4.31 0.00 1.25 1.50 0.00 2.21 0.00 0.00 2.45 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 1.28 0.00 126 P 0.00 4.19 0.00 2.05 1.99 0.00 2.40 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.83 0.00 127 K 8.48 4.01 0.00 1.72 1.87 0.00 1.72 0.00 0.00 1.62 0.00 0.00 2.91 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.43 1.39 7.81 128 T 7.82 3.98 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 0.00 129 A 7.63 4.27 1.50 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 0.00 0.00 0.00 0.00 0.00 0.00 130 R 8.81 4.66 0.00 1.80 1.88 0.00 3.31 0.00 0.00 3.28 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.54 0.00 131 D 8.79 5.19 0.00 2.90 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 0.00 132 F 7.85 5.37 0.00 3.21 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 0.00 133 Q 8.31 4.42 0.00 1.87 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 7.06 0.00 0.00 0.00 0.00 0.00 2.28 2.03 0.00 134 P 0.00 4.47 0.00 2.34 2.18 0.00 3.52 0.00 0.00 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.88 0.00 135 A 8.85 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 8.09 4.72 0.00 2.83 2.94 0.00 0.00 5.83 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 7.82 4.46 0.00 1.71 1.70 0.00 1.60 0.00 0.00 1.63 0.00 0.00 2.92 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.29 1.29 7.81 138 R 7.72 3.58 0.00 1.47 0.66 0.00 3.06 0.00 0.00 3.15 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.56 0.00 139 S 7.50 5.11 0.00 4.06 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 0.00 140 V 8.61 3.99 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 0.97 0.00 0.00