NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 S 4.4379 8.1933 115.2901 57.9772 63.8982 174.3804 5 I 3.5382 8.4213 129.0144 64.2123 37.0159 177.0015 6 R 3.9425 8.8166 119.6789 59.3867 30.2923 178.4811 7 E 3.9878 7.9378 118.0609 59.4578 29.3821 179.0769 8 E 3.9680 8.0337 118.9170 58.9791 29.6518 178.9732 9 V 3.5252 8.0915 118.8401 66.5084 31.6852 177.8928 10 H 4.2834 8.3277 115.9336 58.6276 28.4134 177.8631 11 R 3.9363 8.1033 120.9296 59.4375 29.8968 178.0607 12 H 4.1016 8.5256 118.3717 59.3751 29.7180 177.2683 13 L 4.1031 7.9791 119.5416 57.6867 41.5759 179.4162 14 G 3.7584 7.9220 105.1955 47.6562 0.0000 176.1962 15 T 3.9937 8.0194 118.1606 66.5780 68.5179 177.3064 16 V 3.6277 7.8940 113.8211 63.9688 31.4133 178.3797 17 A 4.0345 7.6313 119.4960 55.0324 17.9114 179.5924 18 L 4.0327 7.8175 116.8069 57.5148 41.7317 178.4963 19 M 4.4653 7.5179 116.1863 53.7846 32.3161 175.8185 20 Q 3.9036 7.2125 120.9266 55.7893 29.4176 174.9226 21 P 4.3607 0.0000 0.0000 63.0774 32.0110 175.2668 22 A 4.4120 8.0119 121.9051 51.6828 21.6998 176.5243 23 L 4.3215 8.2650 120.2737 53.5975 41.0425 176.0957 24 H 4.4329 8.5588 124.1624 54.8371 29.4624 174.7073 25 Q 4.4181 8.1938 129.4101 54.0069 29.0071 175.0507 26 Q 4.0718 8.4894 125.0752 55.8687 29.4561 176.0331 27 T 4.5675 8.2305 111.7506 60.3875 70.6945 174.5513 28 H 4.6575 8.3555 122.9637 54.8057 29.3345 173.0466 29 A 3.6767 8.0061 125.4727 52.2716 15.8813 175.5735 30 P 4.3858 0.0000 0.0000 61.4829 32.9134 177.0467 31 A 4.2829 8.2584 122.9054 51.1994 19.3487 176.9060 32 P 4.4244 0.0000 0.0000 66.0613 31.4489 178.5861 33 T 4.1377 7.9035 105.3373 63.0721 68.7661 174.3997 34 E 4.4025 8.4974 121.3146 56.3340 30.2240 175.5955 35 I 4.3717 7.4826 121.2666 59.8622 38.0230 176.3498 36 T 4.4138 8.2237 116.6710 60.8210 71.4194 174.9388 37 H 4.2507 8.6819 119.9643 59.6766 29.8018 177.1119 38 T 3.8264 7.9307 117.0078 66.7764 68.3773 176.4356 39 L 3.9086 7.9456 120.7627 57.5136 41.6126 179.2428 40 F 4.0968 8.7792 121.1756 61.4758 39.1390 177.2597 41 R 3.9115 8.3140 117.1434 59.2001 30.0273 178.0369 42 A 4.0207 7.9658 120.7513 55.3687 18.1463 179.3005 43 Y 4.2764 8.0921 114.8497 60.6163 37.9542 177.5405 44 T 4.3222 7.2680 108.5036 60.4984 69.3680 175.0916 45 R 4.0373 6.7699 116.8826 56.3757 30.3546 176.3285 46 V 3.9982 8.0092 112.2544 59.4823 32.2641 175.3263 47 P 4.0904 0.0000 0.0000 65.9319 31.1695 177.3209 48 H 4.4080 6.9901 111.5210 56.7913 28.6926 175.8048 49 D 4.5491 7.7208 121.3988 53.1911 39.3634 175.7483 50 V 4.9720 7.1738 113.2399 59.5135 33.1503 176.2549 51 G 3.8635 7.9514 110.0347 47.2157 0.0000 173.7756 52 G 4.0246 8.9552 113.2177 45.2418 0.0000 173.7033 53 E 4.0536 8.0738 119.9870 55.8528 30.0397 176.3317 54 A 4.3487 8.3567 126.1450 52.3866 19.0947 176.1489 55 D 4.6565 8.1651 119.8585 53.1648 44.4263 174.7305 56 V 4.1739 7.9008 115.8569 59.3086 33.1699 174.2248 57 P 4.5042 0.0000 0.0000 62.2157 31.9525 176.1638 58 I 4.4077 7.2583 113.5170 58.8855 40.4738 175.1081 59 E 4.0067 8.3816 123.1035 55.1601 28.3790 175.6776 60 Y 4.3464 7.9580 123.6332 58.6166 38.5186 175.9741 61 H 5.0196 8.2350 117.4405 53.8159 31.8494 172.6086 62 E 4.4715 8.4986 119.9506 55.3355 30.9131 175.7591 63 K 4.5736 7.9719 119.9129 54.7465 35.1953 175.6508 64 E 4.0876 8.6083 125.4934 56.1683 30.1261 176.0451 65 E 4.2387 8.3675 122.9954 55.6955 30.7293 176.7941 66 E 4.2611 9.0653 126.0943 55.5781 31.7425 178.0330 67 I 3.6994 8.3584 123.3676 64.4858 37.3640 178.8732 68 W 5.0976 8.3923 118.1191 59.0804 27.7922 178.1185 69 E 2.8119 6.9490 119.1993 58.6066 28.8237 178.6314 70 L 3.7354 7.4776 120.3410 58.2522 42.0997 178.8531 71 N 4.4536 8.3490 116.4284 56.5237 38.3586 177.6471 72 T 4.0473 8.0235 117.3045 66.4786 68.5410 176.4717 73 F 4.2272 8.2153 122.4460 61.4188 39.3605 177.0189 74 A 3.9085 8.1362 120.3312 55.4152 18.1398 179.7439 75 T 3.8840 8.2491 114.3198 67.0669 68.4454 176.7179 76 C 4.6182 8.6431 118.9261 63.1340 28.2584 176.1100 77 E 4.1029 8.4434 120.2818 59.5051 28.9172 179.1920 78 C 4.6539 8.6135 117.2734 62.7919 28.1403 176.0431 79 L 3.9072 8.3576 120.5654 57.6631 41.1048 179.4987 80 A 5.1796 8.3085 121.9761 54.4877 18.1867 179.1497 81 W 4.4894 8.6023 126.2770 60.8560 30.7198 177.5495 82 R 4.3977 8.0672 115.1786 55.6112 29.7488 176.8066 83 G 3.9963 8.0801 105.7302 46.6157 0.0000 175.9323 84 V 3.7207 8.3093 122.5907 64.8145 31.8583 175.5971 85 W 4.9518 7.8671 114.7786 55.1110 30.4091 172.8298 86 T 4.8390 8.5571 109.4312 59.7818 71.6957 175.2141 87 A 3.5892 8.2728 123.1265 55.3971 18.2579 179.9347 88 E 3.7888 7.9402 116.5541 59.4842 29.5852 179.2182 89 E 3.9406 7.7670 118.1376 59.0651 29.3953 179.3220 90 R 3.0795 7.1599 118.6026 59.1667 29.9611 178.6159 91 R 3.6121 7.6168 117.9278 59.2487 29.9975 178.9879 92 R 3.7452 7.7387 118.2006 59.4053 29.5925 178.7943 93 K 4.1477 7.8992 118.2240 59.3855 31.8691 179.2695 94 Q 4.0888 8.4802 121.1480 58.0214 28.5275 176.8797 95 N 4.9203 8.5310 115.4621 53.4001 39.2204 175.1633 96 C 4.1274 7.4799 115.6409 61.2596 30.6466 175.8073 97 D 4.3528 8.3203 118.7406 57.5173 40.5342 178.9755 98 V 3.6506 7.1237 111.1147 62.3905 31.8847 177.4174 99 G 4.1272 8.2831 105.2115 45.7692 0.0000 173.9581 100 Q 4.0325 8.7997 120.7206 59.7850 28.7470 179.3890 101 T 3.9687 7.9751 115.6114 66.9658 68.6163 176.6349 102 V 3.6257 7.8133 119.3844 66.0906 31.4917 177.0575 103 Y 4.2547 8.3984 119.5476 60.2252 38.3796 177.4966 104 L 4.4906 7.6828 117.0725 54.9903 43.1900 178.4008 105 G 3.7985 8.3680 105.5157 45.8474 0.0000 173.8722 106 M 4.6306 7.1985 119.2052 52.9937 34.1750 174.7668 107 P 4.5782 0.0000 0.0000 62.6524 33.3225 176.2648 108 Y 4.1714 8.9044 120.2704 62.2308 38.5573 178.4093 109 Y 4.4143 8.2562 116.5635 60.0964 38.1640 178.4730 110 G 3.9349 8.4185 107.2908 47.9932 0.0000 175.9532 111 R 4.1408 8.3555 120.5181 58.6236 30.0595 179.1730 112 W 4.1474 8.2560 118.8207 59.7023 29.1720 178.2908 113 L 4.2244 8.6731 120.2929 58.3617 41.6129 178.8945 114 L 4.0811 8.2643 118.9408 58.3476 41.6279 179.7783 115 T 4.0554 8.2911 115.4037 66.2938 67.9651 176.8148 116 A 3.9454 8.3268 122.8587 55.1463 17.9601 179.5619 117 A 4.0123 8.0866 119.2974 55.1256 18.3446 179.8326 118 R 3.8566 8.1339 117.4140 59.6769 30.2054 178.6618 119 I 3.7101 7.9267 118.4866 63.9246 37.7718 177.7892 120 L 4.1140 7.4796 118.8157 57.6233 41.4042 179.6929 121 V 3.8700 7.3912 118.6577 65.4572 31.4104 177.9046 122 D 4.3974 8.2574 117.6269 56.7506 40.6469 177.9340 123 K 4.1933 7.7415 116.3882 55.0134 32.3720 176.3646 124 Q 3.4163 7.6809 116.7642 56.9789 26.7363 175.1283 125 F 4.5114 8.1275 117.8464 59.5645 39.3789 176.7040 126 V 4.6798 7.3249 112.4868 58.8823 35.6886 174.3910 127 T 4.2066 8.9136 113.9240 60.9403 71.2737 175.8891 128 L 3.9104 8.2711 122.9396 58.4320 42.0743 179.3157 129 T 3.8384 7.7691 115.4413 66.6528 68.4592 176.2142 130 E 4.0314 8.2496 120.5555 59.1490 29.4241 179.2620 131 L 3.9454 7.8451 120.3917 58.4853 42.2400 178.7036 132 H 4.2360 8.6637 116.4725 59.0662 28.5753 177.5509 133 N 4.3533 8.6744 118.6338 56.2213 38.3429 177.3582 134 K 3.9240 8.2312 121.0134 59.6013 32.2318 178.9707 135 I 3.7259 7.8134 120.2007 64.1273 36.9693 178.6210 136 V 3.5442 7.8503 119.1961 65.9827 31.3472 177.6736 137 E 3.9305 8.4218 119.3104 59.4957 29.4568 178.6783 138 M 4.0349 8.2040 118.6806 58.4945 32.0880 178.7721 139 R 3.9206 8.0596 118.1391 59.5661 30.2401 179.0584 140 E 3.9909 8.1991 118.1928 59.0584 29.1782 179.1543 141 R 3.8543 7.8641 118.2758 59.5890 30.5629 178.4073 142 V 3.7164 7.8884 117.4787 66.0005 31.3380 177.7136 143 A 4.0397 7.8671 119.4930 55.1865 18.3206 179.3372 144 S 4.2855 8.3457 111.3252 59.6431 63.1065 175.4614 145 G 3.9551 8.0360 111.1632 45.2526 0.0000 175.0473 146 Q 3.8785 7.4921 121.0495 57.3194 29.1820 175.9384 147 G 3.8819 8.9099 102.3324 44.8441 0.0000 173.4977 148 L 4.5160 9.2338 120.5115 54.0961 43.6051 176.9434 149 G 3.7655 8.2573 119.2868 46.5936 0.0000 172.4342 150 E 4.2191 8.3649 120.6254 56.9376 30.5471 177.3222 151 Y 4.3128 7.6308 118.3913 60.3992 38.5258 175.3159 152 L 4.8548 8.2585 121.9485 52.4441 44.7872 173.9827 153 P 4.7530 0.0000 0.0000 61.5635 32.2984 174.5304 154 P 4.8194 0.0000 0.0000 62.4919 31.1883 176.6007 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 S 8.19 4.44 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 5 I 8.42 3.54 1.86 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 1.63 0.51 0.89 0.00 0.00 6 R 8.82 3.94 0.00 1.83 2.02 0.00 3.27 0.00 0.00 3.33 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.69 0.00 7 E 7.94 3.99 0.00 2.21 2.01 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 2.35 2.33 0.00 8 E 8.03 3.97 0.00 2.06 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 0.00 2.30 2.32 0.00 9 V 8.09 3.53 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 0.84 0.00 0.00 0.89 0.00 0.00 10 H 8.33 4.28 0.00 3.22 3.33 0.00 5.67 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 R 8.10 3.94 0.00 2.02 2.11 0.00 3.11 0.00 0.00 3.10 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.64 0.00 12 H 8.53 4.10 0.00 3.35 3.50 0.00 5.84 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 L 7.98 4.10 0.00 1.85 1.74 0.95 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 14 G 7.92 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 15 T 8.02 3.99 4.29 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 1.19 0.00 0.00 16 V 7.89 3.63 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 0.58 0.00 0.00 0.90 0.00 0.00 17 A 7.63 4.03 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 18 L 7.82 4.03 0.00 1.73 1.74 0.91 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 19 M 7.52 4.47 0.00 1.99 2.17 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 2.52 0.00 20 Q 7.21 3.90 0.00 1.97 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.88 6.87 0.00 0.00 0.00 0.00 0.00 2.38 2.40 0.00 21 P 0.00 4.36 0.00 2.08 1.97 0.00 3.77 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 2.03 2.08 0.00 22 A 8.01 4.41 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 L 8.27 4.32 0.00 1.65 1.67 0.93 1.05 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 24 H 8.56 4.43 0.00 3.07 3.26 0.00 5.89 0.00 0.00 0.00 0.00 6.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 Q 8.19 4.42 0.00 2.03 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.74 6.72 0.00 0.00 0.00 0.00 0.00 2.25 2.36 0.00 26 Q 8.49 4.07 0.00 2.13 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.48 0.00 0.00 0.00 0.00 0.00 2.40 2.39 0.00 27 T 8.23 4.57 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 1.28 0.00 0.00 28 H 8.36 4.66 0.00 3.12 3.24 0.00 5.85 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 A 8.01 3.68 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 30 P 0.00 4.39 0.00 2.06 2.02 0.00 3.61 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 2.02 2.09 0.00 31 A 8.26 4.28 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 32 P 0.00 4.42 0.00 2.20 2.16 0.00 3.61 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.11 0.00 33 T 7.90 4.14 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 34 E 8.50 4.40 0.00 2.10 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 2.28 2.42 0.00 35 I 7.48 4.37 2.10 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 1.44 0.59 1.16 0.00 0.00 36 T 8.22 4.41 4.29 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 1.25 0.00 0.00 37 H 8.68 4.25 0.00 3.27 3.39 0.00 5.87 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 T 7.93 3.83 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 1.19 0.00 0.00 39 L 7.95 3.91 0.00 1.98 1.90 1.01 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 40 F 8.78 4.10 0.00 3.28 3.27 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 41 R 8.31 3.91 0.00 1.78 2.03 0.00 3.34 0.00 0.00 3.22 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.65 0.00 42 A 7.97 4.02 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 43 Y 8.09 4.28 0.00 2.87 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 44 T 7.27 4.32 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 0.54 0.00 0.00 45 R 6.77 4.04 0.00 1.95 2.06 0.00 3.04 0.00 0.00 3.18 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.54 0.00 46 V 8.01 4.00 1.89 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 0.71 0.00 0.00 0.95 0.00 0.00 47 P 0.00 4.09 0.00 1.50 1.90 0.00 3.43 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.00 0.00 48 H 6.99 4.41 0.00 3.40 3.33 0.00 5.57 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 D 7.72 4.55 0.00 2.67 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 50 V 7.17 4.97 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 0.90 0.00 0.00 1.00 0.00 0.00 51 G 7.95 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 0.00 0.00 0.00 52 G 8.96 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 53 E 8.07 4.05 0.00 2.20 1.90 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 2.33 2.27 0.00 54 A 8.36 4.35 1.24 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 0.00 0.00 55 D 8.17 4.66 0.00 2.61 2.52 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.90 4.17 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 0.77 0.00 0.00 0.90 0.00 0.00 57 P 0.00 4.50 0.00 1.97 1.90 0.00 3.58 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.03 0.00 58 I 7.26 4.41 1.71 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 0.89 -0.13 0.82 0.00 0.00 59 E 8.38 4.01 0.00 1.88 1.89 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 2.28 2.30 0.00 60 Y 7.96 4.35 0.00 3.01 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 61 H 8.24 5.02 0.00 3.16 3.25 0.00 5.71 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 E 8.50 4.47 0.00 1.98 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 0.00 2.27 2.21 0.00 63 K 7.97 4.57 0.00 1.68 1.59 0.00 1.80 0.00 0.00 1.73 0.00 0.00 3.03 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.30 1.45 7.81 64 E 8.61 4.09 0.00 1.98 1.84 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 2.29 2.28 0.00 65 E 8.37 4.24 0.00 1.81 1.74 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 2.07 2.08 0.00 66 E 9.07 4.26 0.00 1.21 1.66 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 2.21 2.37 0.00 67 I 8.36 3.70 2.16 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 1.70 0.71 0.88 0.00 0.00 68 W 8.39 5.10 0.00 3.51 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 69 E 6.95 2.81 0.00 1.46 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 1.47 1.47 0.00 70 L 7.48 3.74 0.00 1.71 1.75 0.89 0.73 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 71 N 8.35 4.45 0.00 3.11 2.99 0.00 0.00 7.06 6.66 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 72 T 8.02 4.05 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 1.63 0.00 0.00 73 F 8.22 4.23 0.00 2.78 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 74 A 8.14 3.91 1.44 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 0.00 0.00 75 T 8.25 3.88 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 1.29 0.00 0.00 76 C 8.64 4.62 0.00 3.56 3.42 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 77 E 8.44 4.10 0.00 1.78 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 0.00 1.80 1.75 0.00 78 C 8.61 4.65 0.00 3.24 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 79 L 8.36 3.91 0.00 2.04 1.33 0.57 0.59 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 80 A 8.31 5.18 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 W 8.60 4.49 0.00 3.35 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 82 R 8.07 4.40 0.00 1.66 1.73 0.00 3.08 0.00 0.00 2.52 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.42 0.00 83 G 8.08 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 0.00 0.00 0.00 84 V 8.31 3.72 1.93 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 0.54 0.00 0.00 0.46 0.00 0.00 85 W 7.87 4.95 0.00 3.63 3.16 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 0.00 0.00 0.00 0.00 86 T 8.56 4.84 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 1.26 0.00 0.00 87 A 8.27 3.59 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 88 E 7.94 3.79 0.00 1.93 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 2.34 2.30 0.00 89 E 7.77 3.94 0.00 2.19 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 2.36 2.32 0.00 90 R 7.16 3.08 0.00 0.67 1.18 0.00 2.49 0.00 0.00 2.52 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.74 0.00 91 R 7.62 3.61 0.00 1.86 1.85 0.00 3.32 0.00 0.00 3.03 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.66 0.00 92 R 7.74 3.75 0.00 1.79 2.00 0.00 3.31 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.77 0.00 93 K 7.90 4.15 0.00 2.06 1.92 0.00 1.90 0.00 0.00 1.92 0.00 0.00 3.06 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.51 1.69 7.81 94 Q 8.48 4.09 0.00 1.82 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.73 0.00 0.00 0.00 0.00 0.00 2.16 2.25 0.00 95 N 8.53 4.92 0.00 2.73 2.85 0.00 0.00 6.81 7.69 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 96 C 7.48 4.13 0.00 2.98 2.70 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 97 D 8.32 4.35 0.00 2.72 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 98 V 7.12 3.65 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 0.79 0.00 0.00 1.09 0.00 0.00 99 G 8.28 4.13 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 0.00 100 Q 8.80 4.03 0.00 2.21 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.83 0.00 0.00 0.00 0.00 0.00 2.49 2.62 0.00 101 T 7.98 3.97 4.29 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 1.25 0.00 0.00 102 V 7.81 3.63 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 1.11 0.00 0.00 0.98 0.00 0.00 103 Y 8.40 4.25 0.00 3.24 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 0.00 104 L 7.68 4.49 0.00 1.65 1.68 1.06 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 105 G 8.37 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 0.00 106 M 7.20 4.63 0.00 2.12 2.22 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.68 0.00 107 P 0.00 4.58 0.00 2.45 2.16 0.00 3.77 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 2.28 2.25 0.00 108 Y 8.90 4.17 0.00 2.97 2.84 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 0.00 109 Y 8.26 4.41 0.00 2.94 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 0.00 110 G 8.42 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 0.00 0.00 0.00 111 R 8.36 4.14 0.00 2.17 2.07 0.00 3.33 0.00 0.00 3.48 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.93 0.00 112 W 8.26 4.15 0.00 3.81 3.58 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 0.00 113 L 8.67 4.22 0.00 2.20 2.10 1.07 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 114 L 8.26 4.08 0.00 1.85 1.78 0.99 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 115 T 8.29 4.06 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 1.47 0.00 0.00 116 A 8.33 3.95 1.54 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 0.00 0.00 0.00 0.00 0.00 0.00 117 A 8.09 4.01 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 0.00 118 R 8.13 3.86 0.00 2.12 2.14 0.00 3.18 0.00 0.00 3.13 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.93 0.00 119 I 7.93 3.71 1.58 0.00 0.00 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 1.11 0.96 0.05 0.00 0.00 120 L 7.48 4.11 0.00 1.91 1.73 0.88 0.62 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 0.00 121 V 7.39 3.87 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 1.25 0.00 0.00 0.97 0.00 0.00 122 D 8.26 4.40 0.00 2.67 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 0.00 123 K 7.74 4.19 0.00 1.84 1.28 0.00 2.09 0.00 0.00 1.83 0.00 0.00 3.08 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.35 1.46 7.81 124 Q 7.68 3.42 0.00 1.96 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.51 7.01 0.00 0.00 0.00 0.00 0.00 2.21 2.19 0.00 125 F 8.13 4.51 0.00 3.14 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 0.00 126 V 7.32 4.68 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 0.88 0.00 0.00 0.93 0.00 0.00 127 T 8.91 4.21 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 1.19 0.00 0.00 128 L 8.27 3.91 0.00 1.70 1.61 0.83 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 129 T 7.77 3.84 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 1.21 0.00 0.00 130 E 8.25 4.03 0.00 2.17 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 2.31 0.00 131 L 7.85 3.95 0.00 1.77 1.80 0.93 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 132 H 8.66 4.24 0.00 3.28 3.31 0.00 5.69 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 N 8.67 4.35 0.00 2.85 2.87 0.00 0.00 6.70 8.23 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 0.00 134 K 8.23 3.92 0.00 1.95 2.02 0.00 1.53 0.00 0.00 1.65 0.00 0.00 3.04 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.44 1.53 7.81 135 I 7.81 3.73 2.02 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 1.40 0.61 0.88 0.00 0.00 136 V 7.85 3.54 2.24 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 0.99 0.00 0.00 0.95 0.00 0.00 137 E 8.42 3.93 0.00 2.12 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 0.00 2.31 2.50 0.00 138 M 8.20 4.03 0.00 2.06 2.28 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.85 0.00 139 R 8.06 3.92 0.00 2.02 1.97 0.00 3.10 0.00 0.00 3.14 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.83 0.00 140 E 8.20 3.99 0.00 2.15 1.99 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 2.32 2.63 0.00 141 R 7.86 3.85 0.00 2.13 2.12 0.00 3.29 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.66 0.00 142 V 7.89 3.72 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 0.96 0.00 0.00 0.98 0.00 0.00 143 A 7.87 4.04 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 0.00 144 S 8.35 4.29 0.00 4.00 4.09 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 0.00 0.00 0.00 0.00 145 G 8.04 3.96 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 0.00 0.00 0.00 146 Q 7.49 3.88 0.00 2.00 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.55 0.00 0.00 0.00 0.00 0.00 2.38 2.31 0.00 147 G 8.91 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 0.00 0.00 0.00 148 L 9.23 4.52 0.00 1.65 1.64 0.94 1.55 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 0.00 149 G 8.26 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 0.00 150 E 8.36 4.22 0.00 1.94 1.90 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 1.48 1.92 0.00 151 Y 7.63 4.31 0.00 3.23 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 0.00 152 L 8.26 4.85 0.00 1.75 1.53 0.95 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 153 P 0.00 4.75 0.00 2.23 2.05 0.00 3.86 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.00 0.00 154 P 0.00 4.82 0.00 2.07 2.09 0.00 3.76 0.00 0.00 4.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.17 0.00