NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 K 4.2673 8.3149 120.1301 56.0623 34.3553 175.7901 4 I 4.0351 7.5517 119.8485 60.3911 38.0224 174.1388 5 I 4.0170 9.3789 129.7607 60.9654 38.9904 174.3989 6 H 5.1804 8.6726 124.7139 54.3985 29.1477 175.0187 7 L 4.5806 8.6642 124.4119 54.3303 43.1175 176.3995 8 T 5.0703 8.4049 108.6119 57.9630 72.1795 174.8165 9 D 4.4363 9.0289 121.6744 57.9216 40.5792 178.8957 10 D 4.5315 8.1644 117.3750 56.1962 41.2520 177.6381 11 S 4.6109 7.9060 113.4997 58.3572 63.6815 175.7471 12 F 3.7802 8.0642 125.1456 61.5962 39.0046 175.9942 13 D 4.4786 8.4402 116.9363 58.0023 40.6771 178.5557 14 T 3.9214 7.7139 113.8559 66.8234 68.7910 176.4325 15 D 4.3677 8.2865 119.8167 56.3540 40.8772 177.3355 16 V 3.7569 7.5778 116.9200 64.3974 32.4400 177.7967 17 L 4.0029 7.4458 117.8621 56.9042 41.8194 178.7802 18 K 4.5392 7.5526 115.5458 55.8531 32.5259 176.0231 19 A 4.2725 7.5962 125.1033 52.2962 19.2738 177.7272 20 D 4.7505 8.3946 118.2074 52.5963 41.5679 178.1770 21 G 4.0100 8.6659 108.9764 44.0297 0.0000 172.6985 22 A 4.5169 8.1092 119.9690 51.9374 19.9604 176.7783 23 I 4.9447 8.5548 121.3573 59.5043 41.3726 174.1160 24 L 4.9725 9.0726 130.3276 53.7687 43.6739 175.0261 25 V 4.7037 9.3598 127.5017 61.2215 33.9614 173.6721 26 D 5.3656 8.8210 128.1772 52.7045 43.0186 174.9379 27 F 5.1639 9.2677 126.7256 56.4990 40.3067 175.2431 28 W 5.5366 8.9747 120.1442 54.9008 31.9785 173.6150 29 A 4.1290 8.0473 119.5571 49.9997 21.4839 177.3213 30 E 4.1891 8.3871 119.3116 58.4643 29.8469 178.1017 31 W 4.5965 7.0812 113.7143 56.7047 28.9382 175.8276 32 C 4.6781 7.4153 120.7605 58.1169 32.1711 173.7847 33 G 3.6911 8.7417 115.1739 47.7109 0.0000 173.5171 34 P 4.3004 0.0000 0.0000 65.3047 31.3436 178.4471 35 C 4.1243 8.0566 115.0622 62.7748 27.9027 175.9132 36 K 3.9330 7.6310 120.1683 59.5668 31.7575 178.5790 37 M 4.1665 7.4972 118.2145 58.3801 32.2798 178.2050 38 I 3.8525 7.8216 118.0360 62.9082 38.1887 177.3389 39 A 3.7857 7.8020 122.2771 55.0514 17.8608 177.6841 40 P 4.1604 0.0000 0.0000 65.7881 31.3773 178.9313 41 I 3.7573 7.4929 117.9972 64.4419 37.0831 178.3221 42 L 4.0254 8.1084 122.2255 58.3059 41.0456 179.9493 43 D 4.3245 7.8599 120.7149 58.5909 39.7456 181.4464 44 E 4.2221 7.8546 118.8550 59.0552 29.3252 179.5803 45 I 3.7855 7.6913 119.8897 64.0677 36.8764 178.1876 46 A 4.0406 8.3059 124.2717 56.0343 18.0308 180.1326 47 D 4.4427 7.5882 117.9644 58.6261 39.9464 180.0628 48 E 4.4137 8.2680 119.0381 58.6143 29.8300 177.9316 49 Y 4.4440 8.3095 115.2014 56.5335 38.6566 175.5360 50 Q 4.2023 7.1208 118.2906 57.7416 28.9581 178.5360 51 G 4.0503 8.8290 107.0866 45.6793 0.0000 174.1338 52 K 4.3907 7.8235 118.9862 57.1198 33.9348 175.5889 53 L 4.8152 8.4565 118.2150 53.8034 45.8176 175.3535 54 T 4.5758 8.5064 120.0363 61.7846 71.2449 173.2065 55 V 4.6599 8.3480 126.4100 61.4677 33.4119 174.3741 56 A 5.1922 9.1433 128.9870 50.0777 22.8853 174.7040 57 K 4.9937 9.1148 118.6181 54.4653 36.6787 175.4472 58 L 4.8451 8.8071 124.8269 53.1915 45.3476 174.9727 59 N 3.9083 8.7221 126.6927 52.6209 39.1349 175.5133 60 I 3.9814 8.1922 121.4385 63.6369 37.5951 177.4859 61 D 4.5266 8.4707 123.5657 57.0514 40.8631 177.6042 62 Q 4.2507 8.0038 114.3331 57.4537 29.5187 175.7850 63 N 5.3191 8.0756 115.8033 49.6744 38.8728 172.9087 64 P 4.4198 0.0000 0.0000 64.2920 32.4155 178.9993 65 G 3.7141 8.2425 107.9816 48.7188 0.0000 175.4216 66 T 3.8472 8.4502 116.7884 66.5577 69.0042 176.3910 67 A 3.7231 8.4098 122.7826 55.1483 18.1649 177.6705 68 P 4.1624 0.0000 0.0000 65.7341 31.1593 178.8910 69 K 3.9443 7.9445 116.1258 58.4381 31.8768 177.3161 70 Y 4.3666 7.5334 114.8961 56.7564 38.2855 175.5644 71 G 3.9008 7.8498 107.6527 46.1309 0.0000 174.7748 72 I 3.7176 7.7780 119.1275 61.5944 37.6064 176.5869 73 R 4.6207 8.3448 120.6026 55.5626 32.2167 175.1183 74 G 4.2475 7.5759 104.7205 44.6527 0.0000 172.3475 75 I 4.8288 7.8764 112.5470 57.9096 40.9932 173.2709 76 P 4.7960 0.0000 0.0000 63.2585 33.1200 174.9517 77 T 4.9104 8.5896 117.6029 61.9099 71.7971 172.9346 78 L 5.1514 9.0129 127.5542 53.3797 43.5774 175.4064 79 L 5.0348 9.2727 125.4122 52.8487 44.3367 175.4365 80 L 4.8951 8.9334 127.0227 53.8781 43.5599 175.0618 81 F 5.2334 9.4648 125.9917 56.2086 41.9245 175.6930 82 K 4.5102 9.1958 121.9521 55.5308 36.3173 176.2231 83 N 4.2797 9.7536 124.0348 54.5257 35.8615 175.4631 84 G 4.1398 8.5896 102.7135 46.0641 0.0000 173.7657 85 E 4.8039 7.8905 118.6968 53.9921 32.3017 175.7433 86 V 3.4509 8.2781 121.8209 62.4223 31.3323 175.7454 87 A 4.2302 8.9469 130.3236 54.4095 18.4281 176.8992 88 A 4.8625 7.6149 114.2903 50.9156 23.6244 173.9963 89 T 5.1302 8.2971 111.8364 61.2094 70.4454 172.9589 90 K 4.5869 8.8460 126.8915 54.5602 36.7354 175.1938 91 V 4.5952 8.5294 123.2896 61.1723 33.5889 174.2284 92 G 4.1371 8.2884 113.1236 43.5107 0.0000 174.4810 93 A 4.2787 8.0637 124.3629 50.7517 16.8074 177.5754 94 L 4.2823 7.6446 121.0487 54.1271 42.9265 177.9119 95 S 4.5418 8.5757 116.9241 56.9902 65.7885 175.1966 96 K 3.9331 8.5702 121.8069 59.8120 31.6817 178.6043 97 G 3.6408 8.0276 105.2178 48.0517 0.0000 175.5820 98 Q 4.3374 7.8124 122.0186 57.8125 28.6158 178.9815 99 L 4.0378 8.0779 120.2461 57.7635 41.7214 179.2852 100 K 3.9870 8.4915 119.0811 59.7134 31.5929 179.2035 101 E 4.0585 8.5518 117.6591 59.0394 29.6924 179.0059 102 F 4.2788 8.1148 121.7021 61.2737 39.4769 176.9970 103 L 3.7236 8.6160 121.5566 58.1924 41.2575 179.4177 104 D 4.5047 8.3816 120.5512 58.9365 39.8156 180.8835 105 A 4.2989 7.7168 120.7313 54.7726 18.4472 178.9105 106 N 4.4300 7.4873 112.9221 54.9837 38.9893 175.9807 107 L 4.2629 8.2418 124.8214 54.9524 41.8670 176.6199 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 3 K 8.31 4.27 0.00 1.74 1.93 0.00 1.72 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.33 1.41 7.81 4 I 7.55 4.04 1.74 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.51 0.72 0.00 0.00 5 I 9.38 4.02 1.78 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.56 0.84 0.00 0.00 6 H 8.67 5.18 0.00 3.07 3.33 0.00 5.69 0.00 0.00 0.00 0.00 6.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 L 8.66 4.58 0.00 1.66 1.68 0.72 0.69 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 8 T 8.40 5.07 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 1.24 0.00 0.00 9 D 9.03 4.44 0.00 2.73 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 10 D 8.16 4.53 0.00 2.68 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 11 S 7.91 4.61 0.00 4.17 4.11 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 12 F 8.06 3.78 0.00 3.34 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 13 D 8.44 4.48 0.00 2.94 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 14 T 7.71 3.92 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 1.19 0.00 0.00 15 D 8.29 4.37 0.00 2.53 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 16 V 7.58 3.76 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 0.00 0.00 -0.21 0.00 0.00 -0.14 0.00 0.00 17 L 7.45 4.00 0.00 1.96 1.78 1.20 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 18 K 7.55 4.54 0.00 1.65 1.77 0.00 1.70 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 3.31 0.00 0.00 0.00 0.00 1.37 1.50 7.81 19 A 7.60 4.27 1.21 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 0.00 0.00 20 D 8.39 4.75 0.00 2.70 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 21 G 8.67 4.01 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 0.00 0.00 0.00 22 A 8.11 4.52 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 23 I 8.55 4.94 1.87 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.78 0.83 0.00 0.00 24 L 9.07 4.97 0.00 1.74 1.52 1.11 0.54 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 25 V 9.36 4.70 2.31 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 0.41 0.00 0.00 0.79 0.00 0.00 26 D 8.82 5.37 0.00 2.81 2.48 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 0.00 27 F 9.27 5.16 0.00 3.16 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 28 W 8.97 5.54 0.00 3.41 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 29 A 8.05 4.13 -0.13 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 30 E 8.39 4.19 0.00 2.03 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 2.37 2.22 0.00 31 W 7.08 4.60 0.00 3.54 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 32 C 7.42 4.68 0.00 2.64 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 33 G 8.74 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 0.00 0.00 0.00 34 P 0.00 4.30 0.00 2.18 2.12 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 2.14 2.20 0.00 35 C 8.06 4.12 0.00 3.17 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 36 K 7.63 3.93 0.00 1.72 2.06 0.00 1.83 0.00 0.00 1.72 0.00 0.00 3.03 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.44 1.47 7.81 37 M 7.50 4.17 0.00 1.98 2.26 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 2.79 2.54 0.00 38 I 7.82 3.85 1.83 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 1.39 1.30 0.88 0.00 0.00 39 A 7.80 3.79 1.12 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 40 P 0.00 4.16 0.00 2.12 2.08 0.00 3.63 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.12 0.00 41 I 7.49 3.76 2.00 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 1.60 1.11 0.88 0.00 0.00 42 L 8.11 4.03 0.00 1.72 1.62 0.81 0.92 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 43 D 7.86 4.32 0.00 2.70 2.68 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 44 E 7.85 4.22 0.00 2.18 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 0.00 2.32 2.47 0.00 45 I 7.69 3.79 1.93 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 1.64 0.85 0.62 0.00 0.00 46 A 8.31 4.04 1.34 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 0.00 0.00 0.00 0.00 0.00 0.00 47 D 7.59 4.44 0.00 2.79 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 48 E 8.27 4.41 0.00 2.23 2.14 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 2.37 2.47 0.00 49 Y 8.31 4.44 0.00 3.10 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 50 Q 7.12 4.20 0.00 2.28 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.63 0.00 0.00 0.00 0.00 0.00 2.51 2.33 0.00 51 G 8.83 4.05 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 0.00 0.00 0.00 52 K 7.82 4.39 0.00 1.74 1.96 0.00 1.88 0.00 0.00 1.66 0.00 0.00 2.79 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.31 1.39 7.81 53 L 8.46 4.82 0.00 1.67 1.59 0.94 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 54 T 8.51 4.58 4.21 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 1.15 0.00 0.00 55 V 8.35 4.66 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 0.98 0.00 0.00 0.87 0.00 0.00 56 A 9.14 5.19 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 K 9.11 4.99 0.00 1.75 1.82 0.00 1.36 0.00 0.00 1.29 0.00 0.00 2.56 0.00 0.00 2.54 0.00 0.00 0.00 0.00 1.23 1.21 7.81 58 L 8.81 4.85 0.00 1.62 1.09 1.02 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 59 N 8.72 3.91 0.00 2.23 2.42 0.00 0.00 6.90 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 60 I 8.19 3.98 1.91 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 1.24 0.68 1.04 0.00 0.00 61 D 8.47 4.53 0.00 2.76 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 62 Q 8.00 4.25 0.00 2.13 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.54 7.26 0.00 0.00 0.00 0.00 0.00 2.38 2.30 0.00 63 N 8.08 5.32 0.00 2.87 3.05 0.00 0.00 7.02 7.54 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 64 P 0.00 4.42 0.00 2.18 2.18 0.00 3.89 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 1.96 0.00 65 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 66 T 8.45 3.85 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 0.41 0.00 0.00 67 A 8.41 3.72 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 68 P 0.00 4.16 0.00 2.12 2.09 0.00 3.71 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.17 0.00 69 K 7.94 3.94 0.00 1.52 1.45 0.00 1.56 0.00 0.00 1.58 0.00 0.00 2.98 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.35 1.51 7.81 70 Y 7.53 4.37 0.00 2.78 2.90 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 71 G 7.85 3.90 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 0.00 72 I 7.78 3.72 1.78 0.00 0.00 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.41 0.90 0.00 0.00 73 R 8.34 4.62 0.00 1.73 1.90 0.00 3.24 0.00 0.00 3.22 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.76 0.00 74 G 7.58 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 0.00 0.00 0.00 0.00 75 I 7.88 4.83 1.88 0.00 0.00 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.71 0.98 0.00 0.00 76 P 0.00 4.80 0.00 2.27 2.26 0.00 3.64 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 1.99 0.00 77 T 8.59 4.91 4.35 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 1.22 0.00 0.00 78 L 9.01 5.15 0.00 1.51 1.64 0.84 0.45 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 79 L 9.27 5.03 0.00 1.92 1.50 0.97 0.15 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 80 L 8.93 4.90 0.00 1.79 1.59 0.71 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 81 F 9.46 5.23 0.00 3.07 2.93 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 82 K 9.20 4.51 0.00 1.65 1.69 0.00 1.80 0.00 0.00 1.64 0.00 0.00 2.80 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.37 1.43 7.81 83 N 9.75 4.28 0.00 2.89 2.95 0.00 0.00 7.19 7.65 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 84 G 8.59 4.14 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 0.00 85 E 7.89 4.80 0.00 2.19 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 2.51 2.40 0.00 86 V 8.28 3.45 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 0.55 0.00 0.00 0.48 0.00 0.00 87 A 8.95 4.23 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 88 A 7.61 4.86 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 89 T 8.30 5.13 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 1.22 0.00 0.00 90 K 8.85 4.59 0.00 1.06 1.26 0.00 1.48 0.00 0.00 1.43 0.00 0.00 2.83 0.00 0.00 2.82 0.00 0.00 0.00 0.00 0.61 0.47 7.81 91 V 8.53 4.60 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 0.84 0.00 0.00 0.91 0.00 0.00 92 G 8.29 4.14 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 0.00 93 A 8.06 4.28 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 94 L 7.64 4.28 0.00 1.59 1.56 0.66 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 95 S 8.58 4.54 0.00 4.06 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 96 K 8.57 3.93 0.00 1.88 1.87 0.00 1.65 0.00 0.00 1.83 0.00 0.00 3.04 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.53 1.61 7.81 97 G 8.03 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 0.00 0.00 0.00 98 Q 7.81 4.34 0.00 2.05 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.78 0.00 0.00 0.00 0.00 0.00 2.38 2.26 0.00 99 L 8.08 4.04 0.00 1.97 1.68 0.87 0.79 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 0.00 100 K 8.49 3.99 0.00 1.95 2.01 0.00 1.90 0.00 0.00 1.98 0.00 0.00 3.04 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.55 1.71 7.81 101 E 8.55 4.06 0.00 2.24 2.25 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 2.62 2.46 0.00 102 F 8.11 4.28 0.00 3.23 3.33 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 0.00 103 L 8.62 3.72 0.00 1.71 1.55 0.20 0.94 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 0.00 104 D 8.38 4.50 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 0.00 105 A 7.72 4.30 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 0.00 106 N 7.49 4.43 0.00 2.35 2.62 0.00 0.00 7.08 7.22 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 0.00 107 L 8.24 4.26 0.00 1.64 1.59 0.91 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00