NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4403 8.3044 120.3323 52.6193 34.8143 175.3429 2 L 5.6181 6.8556 135.0000 54.8115 44.1210 170.9932 3 M 4.3742 7.0336 116.7985 51.8387 35.4310 173.8480 4 P 4.4004 0.0000 0.0000 62.9542 31.6842 177.7573 5 R 3.7499 8.5778 121.7654 58.7185 30.3315 176.7621 6 R 4.7154 7.1783 114.4546 55.3969 34.3867 174.2036 7 M 4.8580 8.0590 118.8341 53.7376 36.2290 175.7177 8 K 3.9065 8.6713 121.9384 58.8516 32.5109 177.2090 9 Y 4.9477 7.3249 113.7165 56.1183 41.1596 175.6000 10 R 4.1954 8.8909 123.2563 58.3009 30.7250 176.7158 11 K 4.6763 7.8779 115.4930 54.3944 34.2856 175.4238 12 Q 4.5683 8.1371 119.3493 53.8608 31.5436 174.8663 13 Q 4.1199 8.6004 118.7843 56.4154 29.2864 177.7681 14 R 4.1191 8.5483 117.5892 58.9447 30.5139 174.3720 15 G 4.0443 8.0992 111.7916 44.9846 0.0000 173.4403 16 R 4.2279 8.4381 123.3543 55.5668 31.1709 175.1991 17 L 4.6234 8.0913 119.9767 52.6807 42.5521 177.2831 18 K 4.3909 8.4687 124.4903 55.8114 34.1436 177.1915 19 G 3.8943 8.3897 112.5748 45.3532 0.0000 172.3311 20 A 3.4819 8.5387 123.7956 53.9582 18.0156 176.1777 21 T 4.4767 7.8091 107.0041 61.9960 71.0535 173.4628 22 K 3.8855 7.9532 121.6228 55.6238 32.0451 174.7971 23 G 4.0804 8.1709 107.2391 44.8009 0.0000 172.4166 24 G 3.6590 8.5604 108.0479 45.8532 0.0000 174.2575 25 D 4.8251 7.6339 116.7941 52.6441 40.2226 175.4028 26 Y 4.6607 6.6823 116.9997 54.5845 42.4468 174.5076 27 V 3.2454 8.1925 115.8764 64.4624 30.2200 176.3619 28 A 3.8127 10.5642 114.5478 52.8803 16.3166 179.1443 29 F 4.5366 8.3119 118.0770 59.6274 47.7662 174.1385 30 G 4.4494 8.1674 108.9627 44.9797 0.0000 171.0338 31 D 4.6249 8.8938 117.4714 55.6104 42.4753 176.9642 32 Y 5.5115 8.2010 114.7594 56.2710 42.0606 175.2634 33 G 4.6562 9.1397 108.4184 44.5117 0.0000 170.7390 34 L 5.4793 9.4573 123.5331 53.0245 44.5833 175.6732 35 V 5.0368 9.0045 125.4526 59.8088 35.0223 174.5702 36 A 4.7405 8.7596 123.7653 51.5659 19.8916 177.9033 37 L 4.7575 8.6528 119.4145 54.7609 43.7506 176.7633 38 E 4.8609 7.9746 115.8424 53.4894 32.4550 173.6207 39 P 5.3158 0.0000 0.0000 62.4207 32.4137 174.8415 40 A 4.3207 7.7749 122.0947 52.2067 21.8335 174.7600 41 W 5.3368 8.4826 118.6377 55.3586 31.2159 176.0428 42 I 4.8101 8.6945 126.0991 59.6944 38.8622 175.8367 43 T 4.4430 9.6009 117.4064 60.9102 69.8929 175.3464 44 A 3.9819 8.4420 125.2001 55.6297 18.2127 180.4724 45 Q 3.9652 8.0001 115.4581 59.6698 28.9854 178.4800 46 Q 4.1246 8.2748 120.3033 59.1571 28.5969 178.2705 47 I 4.1076 8.1318 121.6520 63.7947 37.2675 177.5412 48 E 4.0769 9.2226 121.0976 58.6120 29.7323 178.8008 49 A 4.2134 8.4644 120.5819 54.6418 19.1851 179.0773 50 A 3.9454 7.7957 118.2086 55.1174 18.3892 179.1131 51 R 3.8751 8.5876 118.7751 58.7617 30.0878 178.4912 52 V 3.3696 8.0113 116.0752 66.2959 31.5913 178.0866 53 A 3.8343 7.7868 120.7679 55.3036 18.4379 179.2090 54 M 3.7824 8.8858 117.5875 58.8061 32.2114 178.8184 55 V 3.4466 7.4767 111.9623 64.4028 31.5075 178.6355 56 R 3.9964 7.8894 117.2370 59.8069 29.8639 177.7658 57 H 4.0693 7.7504 118.1435 57.3789 31.1495 175.8781 58 F 4.6927 6.8015 119.0180 54.3269 36.8131 175.2762 59 R 3.8981 7.6845 117.0325 57.5854 29.6649 176.4228 60 R 3.8776 9.0283 123.1530 56.2823 26.8524 175.9338 61 G 3.7188 7.6241 112.8800 43.8114 0.0000 169.2634 62 G 3.8549 8.0132 110.2068 45.4747 0.0000 170.9992 63 K 4.4926 7.9491 119.3276 54.6048 34.6056 176.2474 64 I 4.5435 8.2420 127.5326 59.9430 39.1694 174.8411 65 F 5.0979 9.5442 125.9347 55.7754 41.2630 174.7338 66 I 3.9382 8.3974 118.5441 59.4471 37.4937 175.6325 67 R 3.9643 8.9914 129.7560 57.5708 30.4160 176.3370 68 I 4.4521 7.3431 111.0108 58.9571 39.9530 174.7258 69 F 4.8238 8.2912 123.2033 55.7034 41.6938 172.3313 70 P 4.3147 0.0000 0.0000 62.7887 31.2453 175.6312 71 D 4.3937 8.2011 120.1091 51.8608 41.2050 174.7929 72 K 4.3008 7.6809 123.4559 54.7533 33.3343 173.9478 73 P 4.3546 0.0000 0.0000 62.6053 32.0636 174.9964 74 Y 4.6371 8.7987 126.3798 56.4879 40.4093 174.2105 75 T 4.7146 7.9581 123.0904 61.8911 70.8090 174.3402 76 K 4.2605 8.2394 126.7183 54.8273 34.9034 176.1096 77 K 4.0902 8.6741 127.4164 55.3785 32.6989 175.0818 78 P 4.2609 0.0000 0.0000 62.2745 31.9859 175.6243 79 L 4.1203 8.2082 120.9682 56.0451 42.8570 176.1925 80 E 3.8177 8.6817 122.4784 56.9324 26.2821 174.0517 81 V 4.4750 7.1342 110.7864 59.6207 36.1759 175.4385 82 R 4.2500 8.2053 121.8097 55.6060 31.2382 175.6000 83 M 4.2698 8.3048 118.6816 55.6980 33.3420 176.2782 84 G 3.7230 9.2693 106.9878 47.5835 0.0000 172.9863 85 K 3.6924 8.9932 115.6168 57.6123 28.7752 176.2197 86 G 3.7905 8.4398 104.4413 44.5717 0.0000 172.7690 87 K 4.3497 8.0575 119.2408 54.1184 33.3378 176.1797 88 G 3.9908 8.5567 113.5633 46.6285 0.0000 171.9182 89 N 4.8316 8.3662 116.6578 52.1376 40.1851 173.3266 90 V 4.4919 8.0797 118.3741 62.2076 32.0025 176.1297 91 E 4.2404 9.8935 128.4265 56.6615 30.6461 176.9927 92 G 3.8742 6.6413 104.6708 46.1130 0.0000 170.3024 93 Y 5.2374 7.7496 115.5283 56.4757 42.5416 175.0247 94 V 4.9068 8.9971 113.3997 59.7663 36.9180 174.3859 95 A 4.5178 9.1929 126.2096 50.1763 20.5966 176.6506 96 V 3.9572 8.4371 123.1168 63.9233 31.6753 175.5093 97 V 4.1864 8.8191 129.3871 61.1998 32.1364 175.2459 98 K 4.6226 8.4191 127.5696 54.8418 34.0363 174.7049 99 P 4.2300 0.0000 0.0000 65.1965 31.0844 176.4651 100 G 4.0429 8.8179 113.2558 45.2762 0.0000 173.8833 101 R 4.1926 7.8173 121.0638 56.3808 31.4905 175.3332 102 V 4.4446 8.0674 125.1175 62.3865 32.0810 175.1886 103 M 4.1336 9.3782 128.3386 57.0351 33.5047 176.2268 104 F 5.4215 8.1999 116.2272 55.6348 42.7813 174.0672 105 E 5.4084 9.3102 121.2933 54.8815 33.8251 175.0960 106 V 4.9217 9.1711 116.2805 59.6872 36.1271 174.5447 107 A 4.8135 8.4503 125.0172 50.6908 23.1591 176.1134 108 G 4.0495 9.9220 105.9313 45.5829 0.0000 173.7369 109 V 4.3205 7.1625 115.9409 60.7632 34.6583 173.6504 110 T 4.0627 8.0899 116.8939 61.8311 68.1403 174.7255 111 E 4.4947 9.0897 126.4194 59.8282 29.4859 178.9226 112 E 3.9883 8.2438 118.5968 59.3266 29.4698 178.3793 113 Q 4.1761 8.4077 117.3800 57.6965 28.6694 178.0041 114 A 4.3721 7.6535 121.9130 54.9734 19.3797 178.9501 115 M 3.7435 7.7492 117.1493 58.7415 31.9779 178.8213 116 E 3.9246 8.0043 118.6605 59.1117 29.5426 178.1454 117 A 3.7250 7.4441 120.5302 55.4910 18.3892 179.7025 118 L 3.9393 8.6480 117.5081 57.7706 41.5188 179.4406 119 R 3.9050 7.4684 117.9245 59.5816 30.1003 178.2705 120 I 3.9514 7.7923 119.4118 64.0300 36.7413 178.0186 121 A 4.0567 7.5866 120.1785 54.3058 17.8946 179.4202 122 G 3.6430 7.7849 103.1327 46.9949 0.0000 174.9021 123 H 4.5719 7.8466 116.8596 56.7998 29.2494 176.4931 124 K 4.3051 7.3311 117.3920 55.4900 32.9580 176.1455 125 L 4.6440 6.9808 120.5543 52.3926 43.2095 175.7149 126 P 4.6517 0.0000 0.0000 63.3631 30.8178 175.6558 127 I 4.4954 7.5582 111.9598 60.8268 40.4226 173.5699 128 K 4.6240 8.6762 120.4773 56.0768 34.1055 176.2940 129 T 5.4262 7.6630 112.9149 60.4016 72.1348 172.3874 130 K 4.3897 8.1908 117.6529 56.3201 35.2745 174.7288 131 I 5.1222 8.5061 126.3101 59.9924 40.1777 174.7802 132 V 4.5045 8.9260 117.2048 61.6792 36.6832 176.7899 133 R 4.6320 9.0335 123.6247 57.0417 28.2994 176.9694 134 R 4.9960 5.8400 107.2643 56.8544 36.0121 174.8393 135 D 4.3780 7.2819 116.8503 54.1519 38.0938 178.5336 136 A 4.6418 8.5360 116.0459 52.9139 17.7640 179.0495 137 Y 4.6552 7.2091 116.9726 58.3387 36.7024 175.8996 138 D 4.6980 8.5258 128.3410 53.2325 42.6566 175.9906 139 E 4.6205 7.0447 112.3368 55.5435 30.6479 176.8022 140 A 4.0382 7.5969 127.4977 53.1432 19.0968 177.1523 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 M 8.30 4.44 0.00 2.06 2.05 0.00 0.00 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.52 0.00 2 L 6.86 5.62 0.00 1.80 1.66 1.15 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 3 M 7.03 4.37 0.00 1.74 0.85 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.38 0.00 4 P 0.00 4.40 0.00 2.35 2.23 0.00 2.78 0.00 0.00 3.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.74 0.00 5 R 8.58 3.75 0.00 1.81 2.03 0.00 3.22 0.00 0.00 3.21 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.66 0.00 6 R 7.18 4.72 0.00 1.55 1.75 0.00 3.11 0.00 0.00 3.21 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.58 0.00 7 M 8.06 4.86 0.00 2.10 1.92 0.00 0.00 0.00 0.00 0.00 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.54 0.00 8 K 8.67 3.91 0.00 1.35 1.00 0.00 1.58 0.00 0.00 1.58 0.00 0.00 2.41 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.22 1.30 7.81 9 Y 7.32 4.95 0.00 2.95 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 10 R 8.89 4.20 0.00 1.82 1.98 0.00 3.24 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 1.62 1.71 0.00 11 K 7.88 4.68 0.00 1.75 1.65 0.00 1.72 0.00 0.00 1.80 0.00 0.00 3.01 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.31 1.38 7.81 12 Q 8.14 4.57 0.00 2.09 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.94 0.00 0.00 0.00 0.00 0.00 2.18 2.28 0.00 13 Q 8.60 4.12 0.00 2.07 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 7.13 0.00 0.00 0.00 0.00 0.00 2.35 2.38 0.00 14 R 8.55 4.12 0.00 1.93 2.25 0.00 3.36 0.00 0.00 3.31 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.78 0.00 15 G 8.10 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 16 R 8.44 4.23 0.00 1.82 1.89 0.00 3.21 0.00 0.00 3.23 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.66 0.00 17 L 8.09 4.62 0.00 1.67 1.63 0.92 1.13 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 18 K 8.47 4.39 0.00 1.74 1.80 0.00 1.65 0.00 0.00 1.74 0.00 0.00 3.13 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.51 7.81 19 G 8.39 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 0.00 0.00 0.00 20 A 8.54 3.48 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 21 T 7.81 4.48 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 1.22 0.00 0.00 22 K 7.95 3.89 0.00 1.87 1.70 0.00 1.71 0.00 0.00 1.70 0.00 0.00 2.80 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.30 1.41 7.81 23 G 8.17 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 0.00 0.00 0.00 0.00 24 G 8.56 3.66 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 0.00 0.00 0.00 25 D 7.63 4.83 0.00 2.78 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 26 Y 6.68 4.66 0.00 2.83 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 27 V 8.19 3.25 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 1.20 0.00 0.00 0.65 0.00 0.00 28 A 10.56 3.81 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 0.00 0.00 0.00 0.00 0.00 29 F 8.31 4.54 0.00 3.17 2.42 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 30 G 8.17 4.45 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 0.00 0.00 0.00 0.00 31 D 8.89 4.62 0.00 2.14 2.15 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 32 Y 8.20 5.51 0.00 3.04 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 33 G 9.14 4.66 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 0.00 0.00 0.00 34 L 9.46 5.48 0.00 1.86 1.76 1.03 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 35 V 9.00 5.04 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 0.76 0.00 0.00 1.00 0.00 0.00 36 A 8.76 4.74 1.28 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 0.00 0.00 37 L 8.65 4.76 0.00 1.64 1.71 0.97 0.61 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 38 E 7.97 4.86 0.00 1.90 1.85 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 2.17 2.29 0.00 39 P 0.00 5.32 0.00 2.10 2.12 0.00 3.49 0.00 0.00 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.82 0.00 40 A 7.77 4.32 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 41 W 8.48 5.34 0.00 3.18 2.89 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 42 I 8.69 4.81 1.92 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 1.36 0.95 0.98 0.00 0.00 43 T 9.60 4.44 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 1.14 0.00 0.00 44 A 8.44 3.98 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 45 Q 8.00 3.97 0.00 2.27 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.83 0.00 0.00 0.00 0.00 0.00 2.41 2.40 0.00 46 Q 8.27 4.12 0.00 2.28 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.85 0.00 0.00 0.00 0.00 0.00 2.39 2.41 0.00 47 I 8.13 4.11 2.15 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 1.55 0.86 1.05 0.00 0.00 48 E 9.22 4.08 0.00 2.09 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 2.34 2.41 0.00 49 A 8.46 4.21 1.33 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 0.00 0.00 50 A 7.80 3.95 1.23 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 0.00 0.00 0.00 0.00 0.00 51 R 8.59 3.88 0.00 2.16 1.91 0.00 3.22 0.00 0.00 3.19 7.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.81 0.00 52 V 8.01 3.37 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 1.00 0.00 0.00 1.00 0.00 0.00 53 A 7.79 3.83 1.28 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 0.00 0.00 54 M 8.89 3.78 0.00 1.76 2.01 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 2.27 2.42 0.00 55 V 7.48 3.45 2.13 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 0.99 0.00 0.00 0.96 0.00 0.00 56 R 7.89 4.00 0.00 1.85 1.94 0.00 3.31 0.00 0.00 3.13 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.74 0.00 57 H 7.75 4.07 0.00 2.98 3.01 0.00 5.74 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 F 6.80 4.69 0.00 3.06 3.23 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 0.00 0.00 0.00 59 R 7.68 3.90 0.00 1.97 2.09 0.00 2.75 0.00 0.00 3.89 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.70 0.00 60 R 9.03 3.88 0.00 2.04 2.09 0.00 3.18 0.00 0.00 3.26 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.65 0.00 61 G 7.62 3.72 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 0.00 0.00 0.00 62 G 8.01 3.85 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 0.00 0.00 0.00 63 K 7.95 4.49 0.00 1.69 1.29 0.00 1.52 0.00 0.00 1.12 0.00 0.00 3.12 0.00 0.00 2.92 0.00 0.00 0.00 0.00 0.94 1.24 7.81 64 I 8.24 4.54 1.95 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 1.60 0.90 1.11 0.00 0.00 65 F 9.54 5.10 0.00 3.09 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 66 I 8.40 3.94 1.76 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 1.25 0.54 1.06 0.00 0.00 67 R 8.99 3.96 0.00 1.62 1.98 0.00 2.79 0.00 0.00 3.25 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.40 0.00 68 I 7.34 4.45 1.82 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 1.02 0.73 0.80 0.00 0.00 69 F 8.29 4.82 0.00 2.76 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 70 P 0.00 4.31 0.00 2.03 1.92 0.00 3.44 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 1.48 1.78 0.00 71 D 8.20 4.39 0.00 2.67 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 72 K 7.68 4.30 0.00 1.58 1.53 0.00 1.18 0.00 0.00 0.61 0.00 0.00 2.81 0.00 0.00 2.72 0.00 0.00 0.00 0.00 0.99 1.37 7.81 73 P 0.00 4.35 0.00 1.90 1.85 0.00 3.68 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 2.18 2.32 0.00 74 Y 8.80 4.64 0.00 2.89 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 75 T 7.96 4.71 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 1.15 0.00 0.00 76 K 8.24 4.26 0.00 1.43 1.53 0.00 1.63 0.00 0.00 1.73 0.00 0.00 3.08 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.35 1.42 7.81 77 K 8.67 4.09 0.00 1.75 1.70 0.00 1.81 0.00 0.00 1.68 0.00 0.00 2.75 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.41 1.41 7.81 78 P 0.00 4.26 0.00 2.02 2.03 0.00 3.65 0.00 0.00 3.55 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 79 L 8.21 4.12 0.00 1.60 1.55 0.93 0.95 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 80 E 8.68 3.82 0.00 2.12 1.94 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 2.22 2.31 0.00 81 V 7.13 4.48 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 0.70 0.00 0.00 0.97 0.00 0.00 82 R 8.21 4.25 0.00 1.79 1.89 0.00 3.20 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 1.62 1.64 0.00 83 M 8.30 4.27 0.00 1.99 2.03 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 2.59 2.47 0.00 84 G 9.27 3.72 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 0.00 0.00 0.00 85 K 8.99 3.69 0.00 1.91 1.97 0.00 1.59 0.00 0.00 1.85 0.00 0.00 3.12 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.31 1.47 7.81 86 G 8.44 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 0.00 0.00 0.00 87 K 8.06 4.35 0.00 1.69 1.67 0.00 1.77 0.00 0.00 1.67 0.00 0.00 2.81 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.29 1.37 7.81 88 G 8.56 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 89 N 8.37 4.83 0.00 2.82 2.97 0.00 0.00 5.49 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 90 V 8.08 4.49 1.94 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 0.52 0.00 0.00 0.86 0.00 0.00 91 E 9.89 4.24 0.00 1.94 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 0.00 2.30 2.45 0.00 92 G 6.64 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 0.00 0.00 0.00 93 Y 7.75 5.24 0.00 2.78 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 94 V 9.00 4.91 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 0.88 0.00 0.00 0.47 0.00 0.00 95 A 9.19 4.52 1.17 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 0.00 0.00 0.00 0.00 0.00 96 V 8.44 3.96 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 0.91 0.00 0.00 0.80 0.00 0.00 97 V 8.82 4.19 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 0.93 0.00 0.00 1.04 0.00 0.00 98 K 8.42 4.62 0.00 1.77 1.95 0.00 1.75 0.00 0.00 2.06 0.00 0.00 2.86 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.56 1.50 7.81 99 P 0.00 4.23 0.00 1.94 2.04 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 2.04 2.24 0.00 100 G 8.82 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 0.00 101 R 7.82 4.19 0.00 1.87 1.88 0.00 3.21 0.00 0.00 3.05 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.55 0.00 102 V 8.07 4.44 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 0.82 0.00 0.00 0.85 0.00 0.00 103 M 9.38 4.13 0.00 1.75 2.29 0.00 0.00 0.00 0.00 0.00 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.50 0.00 104 F 8.20 5.42 0.00 3.05 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 9.31 5.41 0.00 2.16 2.15 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 2.36 2.35 0.00 106 V 9.17 4.92 2.19 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 1.10 0.00 0.00 1.18 0.00 0.00 107 A 8.45 4.81 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 0.00 108 G 9.92 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 0.00 109 V 7.16 4.32 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 0.65 0.00 0.00 0.48 0.00 0.00 110 T 8.09 4.06 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 1.27 0.00 0.00 111 E 9.09 4.49 0.00 2.29 2.04 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 2.29 2.48 0.00 112 E 8.24 3.99 0.00 2.10 1.97 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 2.41 2.42 0.00 113 Q 8.41 4.18 0.00 2.46 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.48 0.00 0.00 0.00 0.00 0.00 2.55 2.46 0.00 114 A 7.65 4.37 1.60 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 0.00 115 M 7.75 3.74 0.00 1.99 2.12 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.75 0.00 116 E 8.00 3.92 0.00 2.10 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 2.43 2.46 0.00 117 A 7.44 3.73 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 0.00 118 L 8.65 3.94 0.00 1.67 1.73 1.04 1.12 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 0.00 119 R 7.47 3.90 0.00 1.96 2.18 0.00 3.28 0.00 0.00 3.23 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.70 0.00 120 I 7.79 3.95 1.91 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.65 0.87 0.00 0.00 121 A 7.59 4.06 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 G 7.78 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 0.00 123 H 7.85 4.57 0.00 3.34 3.33 0.00 5.65 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 0.00 124 K 7.33 4.31 0.00 1.70 1.81 0.00 1.68 0.00 0.00 1.69 0.00 0.00 3.02 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.60 1.54 7.81 125 L 6.98 4.64 0.00 1.83 1.59 1.04 1.08 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 0.00 126 P 0.00 4.65 0.00 2.17 2.14 0.00 3.79 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.18 0.00 127 I 7.56 4.50 1.87 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 1.25 0.52 0.92 0.00 0.00 128 K 8.68 4.62 0.00 1.73 1.74 0.00 1.80 0.00 0.00 1.87 0.00 0.00 2.87 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.45 1.58 7.81 129 T 7.66 5.43 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 1.24 0.00 0.00 130 K 8.19 4.39 0.00 1.82 1.65 0.00 1.72 0.00 0.00 1.85 0.00 0.00 2.89 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.37 1.41 7.81 131 I 8.51 5.12 1.84 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 1.35 0.75 0.95 0.00 0.00 132 V 8.93 4.50 2.41 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 0.97 0.00 0.00 1.13 0.00 0.00 133 R 9.03 4.63 0.00 1.94 1.85 0.00 3.38 0.00 0.00 3.28 7.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 2.01 0.00 134 R 5.84 5.00 0.00 1.88 1.89 0.00 3.63 0.00 0.00 3.64 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.73 0.00 135 D 7.28 4.38 0.00 2.57 1.80 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 0.00 136 A 8.54 4.64 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 0.00 137 Y 7.21 4.66 0.00 2.97 2.86 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 0.00 138 D 8.53 4.70 0.00 2.56 2.49 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 0.00 139 E 7.04 4.62 0.00 1.16 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 0.00 2.31 2.32 0.00 140 A 7.60 4.04 1.11 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 0.00 0.00