NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -1 S 4.4367 8.1776 115.2856 58.8156 64.3632 175.2578 0 H 4.2785 7.8610 114.1436 56.3645 28.6139 175.2955 1 M 3.7166 7.7635 122.6556 58.3129 32.1501 179.0593 2 R 2.9762 6.7679 118.7849 59.6591 30.1925 178.7522 3 T 3.8513 7.5281 108.7668 64.3396 68.8086 176.0239 4 L 3.9009 7.6062 123.2161 58.1868 42.0894 179.0380 5 L 4.2642 8.3101 119.2292 57.7518 41.5357 179.6920 6 I 2.9480 7.6770 119.6051 64.3047 36.9907 178.7473 7 R 4.0457 8.0715 118.9070 59.2028 29.4911 178.5339 8 Y 3.2017 8.5546 119.8131 60.5969 38.6096 178.2416 9 I 3.3008 7.6571 119.4554 64.1871 37.6120 178.1415 10 L 3.7016 7.8426 119.8320 57.3250 41.4254 179.3728 11 W 4.2471 8.2065 128.4703 60.4491 30.7118 178.0523 12 R 3.1991 7.6595 118.5433 58.6340 29.0612 177.9828 13 N 4.6036 7.4902 117.6708 54.6570 39.0919 175.0086 14 D 4.6787 7.3064 115.1085 52.0160 40.4186 175.2135 15 N 3.6155 8.1244 115.6691 54.1255 36.7277 173.0708 16 D 4.8500 8.4765 118.4838 53.0790 41.6748 175.5906 17 Q 4.6913 8.4290 122.8155 55.8768 31.1559 173.9121 18 T 4.0491 8.2353 114.8295 64.4961 69.7003 174.2011 19 Y 4.9347 7.1841 116.0238 55.5736 42.1713 173.9552 20 Y 4.0799 8.7424 121.7729 58.1968 39.1687 175.6962 21 N 4.2130 7.4247 123.8521 51.0696 40.9799 174.2412 22 D 3.9832 7.7384 128.0805 57.0255 41.4452 177.5260 23 D 4.4528 7.7825 119.2491 57.2792 40.8915 178.4599 24 F 4.3401 7.9858 118.3456 60.2609 38.5657 177.5748 25 K 4.0356 7.5385 118.4488 59.5902 32.2322 178.7132 26 K 4.1052 7.9365 118.3226 59.4858 32.0230 179.4289 27 L 3.8476 7.9266 119.2022 57.7876 41.3565 179.3568 28 M 4.4713 8.1209 119.7269 57.3579 31.5206 178.5503 29 L 4.0912 7.7972 119.1424 57.4016 41.7135 179.1442 30 L 4.1737 7.9411 118.6531 57.1935 41.4692 178.7372 31 D 4.4377 8.1703 119.5285 57.4696 40.5109 178.3042 32 E 4.0296 7.7104 117.3093 58.8119 29.6342 178.3192 33 L 4.2216 7.8991 117.5973 55.3227 41.9429 176.8435 34 V 4.0543 7.2497 119.6594 61.3351 32.2287 175.5272 35 D 4.5672 8.4791 127.0141 54.0911 41.7788 175.9919 36 D 4.4301 8.3962 121.7294 55.6128 41.7909 176.9744 37 G 4.1493 8.9038 111.4902 46.4377 0.0000 175.1590 38 D 4.2806 7.9396 118.3725 57.4579 41.1239 178.7963 39 V 3.5238 7.6820 117.8434 66.0997 31.6973 177.0060 40 C 3.9492 8.1476 117.9600 63.1149 31.1962 175.7065 41 T 3.8908 8.4725 117.2726 66.4334 67.9226 176.6749 42 L 3.9517 7.8694 120.8736 57.9827 41.7258 179.5597 43 I 3.6592 8.2510 119.8765 64.2605 37.0419 178.2989 44 K 3.8819 8.0827 120.2630 59.7922 32.0556 178.6148 45 N 4.3692 8.3819 116.7704 56.4972 38.4208 177.3458 46 M 4.2196 8.2359 121.8116 57.9775 31.6837 179.0314 47 R 4.0076 8.1728 118.1147 59.2240 30.0140 178.9391 48 M 4.1125 7.9984 118.3267 57.7376 32.0671 177.8325 49 T 4.2487 7.8550 107.3650 60.6338 69.7423 174.4616 50 L 3.6262 7.3521 120.5042 55.0629 40.1054 173.7543 51 S 4.4474 7.8314 111.0265 56.7448 66.1339 173.9185 52 D 4.7641 8.3860 118.2095 53.2023 39.2962 177.8936 53 G 3.7952 7.6432 108.7929 48.1833 0.0000 174.1185 54 P 4.3120 0.0000 0.0000 64.8800 31.2657 178.5594 55 L 3.9376 7.7304 118.7956 58.0793 41.9177 178.7877 56 L 3.9427 7.8727 118.0491 57.7451 41.8287 178.8276 57 D 4.4973 8.4325 119.2342 57.5928 40.7249 178.8601 58 R 3.9060 7.9558 118.8770 59.5968 29.8449 178.3644 59 L 4.1670 7.8941 117.1127 56.8398 41.7409 178.0957 60 N 4.6498 7.7776 114.7095 52.9039 39.1903 175.4560 61 Q 4.2241 7.1580 120.2388 54.4970 29.5175 174.3646 62 P 4.2266 0.0000 0.0000 63.0301 31.7114 176.2173 63 V 4.1502 8.2351 120.7861 61.6188 31.8069 174.7387 64 N 4.8067 8.9161 125.0737 53.8901 39.4530 175.4035 65 N 5.1239 7.5045 116.1533 51.4377 41.0927 174.7527 66 I 3.2235 8.5000 120.5234 64.0387 37.8200 177.4936 67 E 3.8708 8.0978 119.7766 59.4050 29.6021 178.3841 68 D 4.3126 8.3894 118.8229 57.1051 40.9354 178.6427 69 A 3.8928 7.6286 121.3279 55.0103 18.3488 179.8196 70 K 3.9287 8.2127 117.3030 59.6909 32.1005 179.5796 71 R 3.9060 8.0322 118.9404 59.6274 30.0522 178.2596 72 M 4.0740 8.2332 118.0852 58.3765 32.1212 178.3950 73 I 3.8139 7.7193 119.7116 64.3118 37.3532 178.1967 74 A 4.0738 8.1965 121.6761 55.2419 18.1538 179.5377 75 I 3.7362 8.0535 117.2720 64.2124 37.9760 178.3626 76 S 4.1558 8.1410 115.6663 61.4772 62.7116 176.4829 77 A 3.7338 8.1956 123.4891 55.1872 18.1579 179.9160 78 K 3.8956 8.5190 117.4129 59.4120 31.9680 179.8804 79 V 3.5793 8.1282 118.6205 65.8173 31.3447 177.7785 80 A 4.1050 8.1563 120.7044 55.3067 17.6858 179.6496 81 R 4.2327 7.8072 118.2900 59.1518 30.0099 178.1279 82 D 4.4701 7.9657 116.3218 55.9846 41.1290 178.1058 83 I 3.8530 7.9448 119.0711 61.2261 38.5095 176.4919 84 G 4.0424 7.3432 107.5539 45.6418 0.0000 174.3953 85 E 4.1874 8.4672 119.5733 58.7782 29.9894 178.6185 86 R 4.0158 7.9382 117.6958 58.5528 30.3808 177.1068 87 S 4.1043 7.5821 114.6215 59.2172 63.1877 175.3861 88 E 4.3020 8.4933 127.1316 54.9185 27.8099 174.9678 89 I 4.0766 7.1728 120.6128 59.3577 39.6644 177.1966 90 R 4.2117 7.6495 124.3886 54.0571 28.8213 176.6460 91 W 3.8709 7.9478 122.6377 59.4852 29.2949 177.2599 92 E 4.2391 8.1782 116.8520 59.4893 28.7041 179.0039 93 E 3.9991 8.1823 119.6746 59.2872 29.4342 179.3059 94 S 4.0813 7.6763 114.7485 61.2732 62.8497 176.5181 95 F 4.0912 7.8012 120.8053 60.5392 38.5778 177.7189 96 T 3.9990 7.9079 115.2420 66.8154 68.3970 176.7362 97 I 3.6978 7.4463 121.5285 64.1801 37.2823 178.0341 98 L 3.9659 8.0172 121.3501 58.5524 41.8773 179.2102 99 F 4.7197 8.3426 118.1036 60.5993 38.6385 177.9178 100 R 4.3511 8.0486 114.8661 59.1966 29.3499 178.2870 101 M 4.3649 7.9053 118.2593 56.5351 32.5205 176.6930 102 I 4.7268 7.6184 109.5740 59.3877 39.2903 176.8975 103 E 2.0000 8.5054 121.8764 59.2990 28.7469 179.1849 104 T 3.8022 7.6587 109.3880 64.4353 68.9567 174.9561 105 Y 4.4031 7.9077 117.5938 58.1357 37.9423 177.0517 106 F 4.6976 8.1342 121.4805 60.9787 39.0317 177.3069 107 D 4.4204 8.1939 117.8640 57.5512 40.3450 178.3244 108 D 4.4330 8.1778 118.8660 57.3982 40.9074 178.7241 109 L 4.1890 8.5001 119.8693 58.1065 41.4566 179.2267 110 M 4.2645 8.4007 117.3156 58.3689 32.0757 177.8096 111 I 4.1435 7.6534 119.5688 63.8069 37.6354 177.5444 112 D 4.4131 9.0727 118.1779 57.1373 40.9616 178.0023 113 L 3.9810 7.6105 118.7327 55.7985 42.8700 176.7611 114 Y 4.6601 7.0269 115.0291 55.3479 38.0960 175.8753 115 G 3.7653 8.1632 111.4294 45.3609 0.0000 170.6619 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 8.18 4.44 0.00 3.89 3.89 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 0 H 7.86 4.28 0.00 3.40 3.40 0.00 5.53 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1 M 7.76 3.72 0.00 1.08 0.87 0.00 0.00 0.00 0.00 0.00 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.42 0.00 2 R 6.77 2.98 0.00 1.51 1.66 0.00 3.02 0.00 0.00 3.17 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.58 0.00 3 T 7.53 3.85 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 1.16 0.00 0.00 4 L 7.61 3.90 0.00 1.71 1.74 0.92 0.79 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 5 L 8.31 4.26 0.00 1.92 1.96 1.24 0.94 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 6 I 7.68 2.95 1.89 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 0.48 1.09 0.77 0.00 0.00 7 R 8.07 4.05 0.00 2.18 2.22 0.00 3.19 0.00 0.00 3.13 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.92 0.00 8 Y 8.55 3.20 0.00 2.95 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 9 I 7.66 3.30 1.93 0.00 0.00 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 1.47 0.83 0.63 0.00 0.00 10 L 7.84 3.70 0.00 1.70 1.66 1.04 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 11 W 8.21 4.25 0.00 3.42 3.03 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 0.00 0.00 0.00 12 R 7.66 3.20 0.00 1.36 1.47 0.00 2.34 0.00 0.00 2.68 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.27 0.00 13 N 7.49 4.60 0.00 2.25 2.66 0.00 0.00 6.93 7.84 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 14 D 7.31 4.68 0.00 2.74 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 15 N 8.12 3.62 0.00 2.74 2.88 0.00 0.00 6.79 8.00 0.00 0.00 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 D 8.48 4.85 0.00 2.67 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 Q 8.43 4.69 0.00 2.07 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.61 6.67 0.00 0.00 0.00 0.00 0.00 2.55 2.45 0.00 18 T 8.24 4.05 3.45 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 0.34 0.00 0.00 19 Y 7.18 4.93 0.00 2.85 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 20 Y 8.74 4.08 0.00 2.88 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 21 N 7.42 4.21 0.00 1.93 1.70 0.00 0.00 6.84 8.49 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 22 D 7.74 3.98 0.00 2.81 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 23 D 7.78 4.45 0.00 2.70 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 24 F 7.99 4.34 0.00 2.70 2.67 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 25 K 7.54 4.04 0.00 1.73 2.03 0.00 2.07 0.00 0.00 1.85 0.00 0.00 3.10 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.53 1.61 7.81 26 K 7.94 4.11 0.00 1.99 1.70 0.00 1.90 0.00 0.00 1.66 0.00 0.00 3.00 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.44 1.63 7.81 27 L 7.93 3.85 0.00 0.95 0.51 0.58 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 28 M 8.12 4.47 0.00 2.23 2.42 0.00 0.00 0.00 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3.29 2.83 0.00 29 L 7.80 4.09 0.00 1.75 1.72 0.91 1.04 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 30 L 7.94 4.17 0.00 2.07 1.76 0.89 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 31 D 8.17 4.44 0.00 2.97 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 32 E 7.71 4.03 0.00 2.02 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.37 0.00 33 L 7.90 4.22 0.00 1.82 1.71 0.99 0.74 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 34 V 7.25 4.05 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 0.78 0.00 0.00 0.95 0.00 0.00 35 D 8.48 4.57 0.00 2.71 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 36 D 8.40 4.43 0.00 2.78 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 37 G 8.90 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 0.00 0.00 0.00 0.00 38 D 7.94 4.28 0.00 2.89 2.69 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 39 V 7.68 3.52 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 0.83 0.00 0.00 0.93 0.00 0.00 40 C 8.15 3.95 0.00 3.02 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 41 T 8.47 3.89 4.37 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 1.20 0.00 0.00 42 L 7.87 3.95 0.00 1.99 1.71 0.93 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 43 I 8.25 3.66 1.99 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 1.62 0.99 0.90 0.00 0.00 44 K 8.08 3.88 0.00 1.94 2.00 0.00 1.62 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.43 1.48 7.81 45 N 8.38 4.37 0.00 2.87 2.83 0.00 0.00 7.09 7.77 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 46 M 8.24 4.22 0.00 2.04 2.21 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.46 0.00 47 R 8.17 4.01 0.00 1.84 1.95 0.00 3.11 0.00 0.00 3.15 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.72 0.00 48 M 8.00 4.11 0.00 1.99 2.10 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 2.62 2.84 0.00 49 T 7.86 4.25 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 1.20 0.00 0.00 50 L 7.35 3.63 0.00 1.75 1.73 0.89 0.70 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 51 S 7.83 4.45 0.00 3.89 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 52 D 8.39 4.76 0.00 2.63 2.61 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 53 G 7.64 3.80 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 54 P 0.00 4.31 0.00 2.13 2.09 0.00 3.67 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.11 0.00 55 L 7.73 3.94 0.00 1.66 1.71 0.90 0.69 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 56 L 7.87 3.94 0.00 1.74 1.67 0.89 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 57 D 8.43 4.50 0.00 2.83 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 58 R 7.96 3.91 0.00 1.93 2.10 0.00 3.29 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.73 0.00 59 L 7.89 4.17 0.00 1.80 1.72 0.96 0.93 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 60 N 7.78 4.65 0.00 2.96 2.85 0.00 0.00 7.01 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 61 Q 7.16 4.22 0.00 2.09 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.83 0.00 0.00 0.00 0.00 0.00 2.39 2.56 0.00 62 P 0.00 4.23 0.00 2.19 2.07 0.00 3.72 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.97 0.00 63 V 8.24 4.15 2.22 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 0.65 0.00 0.00 0.97 0.00 0.00 64 N 8.92 4.81 0.00 2.87 2.88 0.00 0.00 6.82 7.61 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 65 N 7.50 5.12 0.00 2.99 2.93 0.00 0.00 6.35 7.85 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 66 I 8.50 3.22 2.09 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 1.54 1.66 0.95 0.00 0.00 67 E 8.10 3.87 0.00 2.10 2.27 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 2.36 2.44 0.00 68 D 8.39 4.31 0.00 2.73 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 69 A 7.63 3.89 1.04 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 70 K 8.21 3.93 0.00 1.94 1.87 0.00 1.66 0.00 0.00 1.56 0.00 0.00 2.89 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.67 7.81 71 R 8.03 3.91 0.00 1.95 2.07 0.00 3.09 0.00 0.00 3.09 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.64 0.00 72 M 8.23 4.07 0.00 2.26 2.14 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 2.62 2.62 0.00 73 I 7.72 3.81 2.16 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 1.64 0.68 1.08 0.00 0.00 74 A 8.20 4.07 1.43 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 0.00 0.00 0.00 75 I 8.05 3.74 1.89 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 1.54 1.44 1.00 0.00 0.00 76 S 8.14 4.16 0.00 4.20 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 77 A 8.20 3.73 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 78 K 8.52 3.90 0.00 1.84 1.86 0.00 1.68 0.00 0.00 1.57 0.00 0.00 2.90 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.44 1.57 7.81 79 V 8.13 3.58 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 1.18 0.00 0.00 1.04 0.00 0.00 80 A 8.16 4.11 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 R 7.81 4.23 0.00 1.73 1.95 0.00 3.05 0.00 0.00 3.18 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.33 0.00 82 D 7.97 4.47 0.00 2.68 2.69 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 83 I 7.94 3.85 2.04 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 1.45 0.63 1.19 0.00 0.00 84 G 7.34 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 85 E 8.47 4.19 0.00 2.10 2.27 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 2.26 2.33 0.00 86 R 7.94 4.02 0.00 1.83 2.04 0.00 3.22 0.00 0.00 3.22 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.65 0.00 87 S 7.58 4.10 0.00 3.95 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 88 E 8.49 4.30 0.00 1.90 1.86 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 2.28 2.46 0.00 89 I 7.17 4.08 0.67 0.00 0.00 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.25 -0.45 0.00 0.00 90 R 7.65 4.21 0.00 1.70 1.99 0.00 3.08 0.00 0.00 3.29 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.52 0.00 91 W 7.95 3.87 0.00 3.18 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 92 E 8.18 4.24 0.00 2.32 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 2.38 2.41 0.00 93 E 8.18 4.00 0.00 1.99 1.96 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 2.29 2.37 0.00 94 S 7.68 4.08 0.00 3.79 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 95 F 7.80 4.09 0.00 3.22 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 96 T 7.91 4.00 4.46 0.00 0.00 0.00 0.00 0.00 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 97 I 7.45 3.70 1.86 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 1.41 1.05 0.91 0.00 0.00 98 L 8.02 3.97 0.00 1.80 1.65 1.01 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 99 F 8.34 4.72 0.00 3.24 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 0.00 100 R 8.05 4.35 0.00 2.03 2.14 0.00 3.09 0.00 0.00 3.26 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.74 0.00 101 M 7.91 4.36 0.00 2.07 2.40 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 2.85 2.85 0.00 102 I 7.62 4.73 1.97 0.00 0.00 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 1.85 1.03 0.99 0.00 0.00 103 E 8.51 2.00 0.00 1.55 1.71 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 2.34 2.16 0.00 104 T 7.66 3.80 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 1.13 0.00 0.00 105 Y 7.91 4.40 0.00 3.27 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 0.00 106 F 8.13 4.70 0.00 3.13 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 0.00 107 D 8.19 4.42 0.00 2.80 2.75 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 0.00 108 D 8.18 4.43 0.00 3.01 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 0.00 109 L 8.50 4.19 0.00 1.99 1.80 1.21 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 110 M 8.40 4.26 0.00 2.17 2.30 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.66 0.00 111 I 7.65 4.14 2.04 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.29 0.94 0.00 0.00 112 D 9.07 4.41 0.00 2.81 2.67 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 0.00 113 L 7.61 3.98 0.00 0.89 0.13 0.65 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 114 Y 7.03 4.66 0.00 2.96 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 0.00 115 G 8.16 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