NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 S 4.4622 8.1927 116.7935 58.2107 63.8182 173.9761 3 V 3.4254 8.3039 126.4035 65.6426 31.3853 175.9717 4 Y 3.9802 8.7964 117.3747 61.2432 37.9041 177.8741 5 D 4.3883 7.6943 117.5512 57.2578 41.2015 178.3577 6 A 4.0983 7.9416 120.7076 54.9128 18.4904 179.3599 7 A 3.8812 8.3101 119.3485 55.0212 18.1544 179.5912 8 A 3.9818 7.7795 118.5136 54.9137 18.4653 178.9851 9 Q 4.2449 7.7686 116.7625 57.1106 29.9501 176.4321 10 L 4.2057 7.4912 120.3270 54.2318 40.3834 177.0536 11 T 4.2717 7.7694 114.9421 60.1956 71.7144 175.0407 12 A 3.9493 8.4627 122.2117 55.7885 18.1841 179.5935 13 D 4.2999 7.9804 116.6079 57.1312 40.8917 179.0006 14 V 3.4814 7.2210 119.2217 66.0001 31.4914 178.2320 15 K 3.7997 8.0638 118.2278 59.1960 31.7478 179.2309 16 K 3.9242 7.9592 119.7628 59.7203 32.0815 178.6681 17 D 4.5204 8.1679 119.1221 57.2236 40.5749 178.7423 18 L 3.8009 8.0528 119.7076 57.9093 41.5965 179.8488 19 R 4.0330 8.2438 118.1869 59.3779 28.4727 178.9639 20 D 4.4689 8.5621 119.2329 57.4020 40.7940 179.0018 21 S 3.2939 8.4993 115.1028 60.7420 62.9284 176.3159 22 W 4.2527 8.7663 132.2548 60.1016 30.1643 177.8182 23 K 3.7682 7.9072 118.0051 59.2904 31.7309 178.8165 24 V 3.7966 7.0989 117.4647 65.3998 31.4021 178.0187 25 I 3.3936 7.6662 119.7729 64.3466 36.9813 178.3039 26 G 2.2452 6.6896 106.2619 45.8911 0.0000 174.1360 27 S 4.2400 7.3626 113.9111 58.9221 63.8162 174.5245 28 D 4.5726 7.3504 120.5397 51.5889 41.5039 175.3760 29 K 3.8884 8.1547 123.9779 58.4680 32.3979 178.4135 30 K 4.0172 7.9979 119.6229 59.3935 32.3037 178.9425 31 G 3.5270 8.1627 105.8567 48.1286 0.0000 175.5036 32 N 4.4621 8.2567 119.7898 55.2137 38.4933 177.9720 33 G 3.5302 8.1100 107.4362 47.8420 0.0000 175.9754 34 V 3.5813 8.0879 122.4114 64.8959 31.5531 177.8518 35 A 3.9566 8.0121 120.5181 55.0141 18.1034 179.5760 36 L 3.7981 7.9049 117.3887 58.2457 41.7479 179.7427 37 M 3.5095 7.7072 118.7074 58.4015 31.8405 179.0257 38 T 3.8555 8.0829 110.1322 64.7423 68.8973 176.9379 39 T 3.8793 7.8458 118.9709 66.1026 68.3404 176.4556 40 L 3.8870 7.8323 122.4587 58.3278 41.9967 179.1844 41 F 4.5410 7.9277 117.4433 60.4169 38.5298 177.6819 42 A 4.0333 7.9123 119.8660 55.3794 18.3547 179.1167 43 D 4.6368 8.2174 116.0313 55.7827 42.5307 176.8643 44 N 5.0747 8.4952 116.9525 49.8277 39.3801 174.4318 45 Q 4.4399 8.6207 122.1430 58.6133 28.8698 178.9728 46 E 4.1048 8.2963 118.7675 59.0916 29.6275 178.7794 47 T 4.4730 8.3928 110.7202 64.3011 68.8353 176.4338 48 I 3.7403 7.9804 123.3046 63.9636 36.7206 178.0464 49 G 3.6315 7.7692 105.9370 48.0441 0.0000 174.6231 50 Y 4.2076 7.9695 116.3793 58.7217 38.3571 175.9936 51 F 4.9713 8.2757 120.1719 56.6608 40.1881 177.5669 52 K 3.9230 8.3323 124.4726 59.4913 32.2137 178.5824 53 R 3.9935 7.9942 117.8377 59.0790 30.1064 177.2847 54 L 4.2239 7.9357 116.7586 55.4981 42.7840 178.8690 55 G 3.9640 7.6031 106.9624 47.2756 0.0000 177.8305 56 D 4.6520 8.3556 117.5465 52.6508 38.5224 176.5838 57 V 3.8053 7.8522 116.6286 63.5355 31.7612 177.4070 58 S 4.3059 7.9866 112.9104 60.8573 63.2625 175.5822 59 Q 4.1795 8.4971 121.4239 55.7664 28.9032 177.2634 60 G 3.7777 8.5417 109.2882 46.2423 0.0000 176.1427 61 M 3.8808 9.0574 121.8825 58.3822 31.8544 177.0433 62 A 4.0420 7.6921 119.6187 53.9344 18.9146 177.2925 63 N 4.5602 8.3286 115.4766 52.9971 39.4086 175.0544 64 D 4.3776 8.7303 129.0103 57.5075 40.9838 178.9438 65 K 4.0156 8.0155 118.3867 59.3898 32.0842 179.0277 66 L 4.0105 7.9033 120.1507 58.0964 42.1046 178.7849 67 R 3.9938 8.4214 119.1358 59.2677 30.1547 178.6432 68 G 3.6738 8.4774 105.9525 48.1485 0.0000 175.0638 69 H 4.2456 8.4924 121.1511 59.0307 30.0203 177.4565 70 S 4.0607 8.4657 117.2866 61.7151 62.4517 176.8222 71 I 3.9190 7.7144 121.1875 64.5494 37.2311 178.3022 72 I 4.0265 7.7945 120.2764 64.0886 36.9537 178.0635 73 L 4.0265 8.1219 121.4063 58.7493 41.8878 179.1579 74 M 4.2348 7.9650 117.8502 58.4868 31.8294 178.2280 75 Y 3.8816 8.0343 116.0778 60.1627 38.0227 177.8933 76 A 3.6735 7.8555 121.7918 55.0113 18.3966 179.6713 77 L 3.3777 7.3940 116.9800 57.4541 41.6470 179.1125 78 Q 3.4011 7.7009 119.6107 59.0684 28.7070 178.1197 79 N 4.1967 7.5725 116.3105 56.7689 39.4186 176.3728 80 F 4.4770 7.5279 118.9806 60.7270 38.9189 177.6721 81 I 3.4809 7.5703 119.4354 64.5535 36.6387 178.3289 82 D 4.4362 7.9741 118.1677 56.6508 40.9130 177.7703 83 Q 4.3935 7.6586 116.6226 55.8524 28.7788 177.2921 84 L 3.9436 7.4763 121.1906 57.5321 41.7150 177.6502 85 D 4.5377 7.8810 115.5917 54.7563 41.5582 176.4872 86 N 4.8127 8.0223 118.0525 50.1721 39.9041 171.9200 87 P 4.1917 0.0000 0.0000 65.7776 31.6361 177.7879 88 D 4.4724 8.2474 117.0373 57.4063 40.7080 178.5201 89 D 4.3606 8.1279 118.9817 56.8767 40.9476 178.2072 90 L 3.8399 7.8770 120.9082 58.2282 41.9825 179.3168 91 V 3.2726 7.6663 118.3422 66.0037 31.4011 177.7979 92 C 4.1099 7.9141 113.9664 60.9893 29.3683 176.1587 93 V 3.6053 7.9167 121.0425 65.8355 31.1299 178.1900 94 V 3.4358 7.8816 118.2504 66.0833 31.1275 177.8050 95 E 3.9366 8.0782 117.2199 59.1720 29.3691 179.0628 96 K 4.1072 8.1037 119.6389 59.5018 32.6731 178.4796 97 F 4.1660 8.6479 120.9676 61.5465 39.1851 176.9804 98 A 3.7602 8.4719 120.2701 54.7050 18.0764 179.4226 99 V 3.4994 7.4433 117.1447 66.7766 31.5803 178.2129 100 N 4.3637 7.9895 115.0651 56.3734 38.4017 177.0965 101 H 4.1161 7.5154 116.1055 58.6069 28.6717 177.8562 102 I 3.7381 8.0295 122.0455 64.6821 36.7101 178.5838 103 T 3.8777 7.7228 115.5798 66.4710 68.3365 176.0778 104 R 4.1766 7.6412 116.8711 55.5186 30.5036 176.3213 105 K 3.8465 8.0332 117.5845 57.4351 30.0150 176.0477 106 I 4.1231 7.6911 120.3666 60.1020 37.5057 177.2854 107 S 4.4982 8.4507 120.9544 57.4697 65.4110 174.7663 108 A 4.0384 8.4970 123.0743 55.1726 17.8046 179.7601 109 A 3.9903 7.9125 118.1027 55.2550 18.9044 178.9565 110 E 4.0783 8.0611 117.8196 59.4823 29.7726 178.7906 111 F 4.1042 8.5648 120.8680 61.1992 39.4839 177.1901 112 G 3.8635 8.4407 105.0666 47.2923 0.0000 175.3055 113 K 4.1835 7.7883 119.5705 58.5483 32.3262 178.3042 114 I 3.8160 7.7429 118.8976 62.8997 37.7981 177.3072 115 N 4.4912 8.2750 117.9593 56.3986 38.3624 177.2735 116 G 3.6024 8.0381 106.6119 47.4318 0.0000 173.4094 117 P 4.2103 0.0000 0.0000 65.3244 31.2461 178.6397 118 I 3.4776 7.6785 118.1104 64.1794 37.0129 178.2084 119 K 3.8674 8.1444 120.5048 59.6645 31.9382 178.9140 120 K 3.9672 8.0952 118.5188 59.4513 31.4523 179.6128 121 V 3.5421 7.9339 118.7087 65.7389 31.3095 178.0084 122 L 3.9839 8.1764 118.9425 57.9487 41.4743 179.5097 123 A 4.2388 8.4716 122.0330 54.4484 18.0208 179.8009 124 S 4.0149 7.9948 111.7065 60.8372 63.2799 175.2547 125 K 4.3247 7.5669 117.7992 55.6519 31.7633 175.8800 126 N 4.1167 7.9194 114.9008 54.3948 36.3906 174.2621 127 F 4.3615 8.2424 117.9653 56.0029 40.2547 176.6783 128 G 4.2172 8.5522 114.4304 44.1062 0.0000 172.4630 129 D 4.5251 8.9210 118.6091 57.5347 40.7444 178.7129 130 K 3.8550 8.1848 119.5322 59.8526 32.1358 178.3100 131 Y 4.1289 8.3501 116.6921 60.8992 37.8711 177.7781 132 A 4.1919 8.3548 121.3201 55.3632 18.4859 179.1781 133 N 4.2963 8.5184 114.6652 56.4766 38.7694 177.3836 134 A 3.9213 7.8504 121.4778 55.1746 18.4615 179.8135 135 W 3.9542 8.6092 117.1672 59.6532 29.0231 178.6635 136 A 4.1109 8.4331 121.0649 55.1246 17.5778 179.8467 137 K 3.9280 7.8618 116.2196 59.2977 32.4747 179.1229 138 L 3.9109 7.7625 120.5413 58.1167 41.9546 179.1032 139 V 3.7584 8.1243 118.0741 66.0953 31.4229 177.8071 140 A 4.3784 8.2145 121.8301 54.4225 17.8878 179.8130 141 V 3.4145 7.3467 116.0906 65.9817 31.7691 178.1894 142 V 3.4707 7.4261 117.4537 66.0958 31.3433 177.7680 143 Q 3.8661 8.2445 117.7360 59.0036 28.2882 178.9174 144 A 3.9966 7.9287 120.5639 54.4841 18.4669 178.6680 145 A 4.1813 7.9134 117.5969 52.9586 18.9997 177.3914 146 L 4.1642 7.4109 122.1171 54.6351 41.8973 176.3686 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 S 8.19 4.46 0.00 3.92 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 3 V 8.30 3.43 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 0.95 0.00 0.00 0.89 0.00 0.00 4 Y 8.80 3.98 0.00 3.02 2.94 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 0.00 0.00 0.00 5 D 7.69 4.39 0.00 2.90 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 6 A 7.94 4.10 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 7 A 8.31 3.88 1.27 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 0.00 0.00 8 A 7.78 3.98 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 9 Q 7.77 4.24 0.00 2.14 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 7.14 0.00 0.00 0.00 0.00 0.00 2.34 2.41 0.00 10 L 7.49 4.21 0.00 1.69 1.52 0.76 0.59 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 11 T 7.77 4.27 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 1.18 0.00 0.00 12 A 8.46 3.95 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 13 D 7.98 4.30 0.00 2.66 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 14 V 7.22 3.48 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 0.98 0.00 0.00 0.87 0.00 0.00 15 K 8.06 3.80 0.00 1.79 1.78 0.00 1.71 0.00 0.00 1.50 0.00 0.00 2.85 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.35 1.59 7.81 16 K 7.96 3.92 0.00 1.98 2.00 0.00 1.57 0.00 0.00 1.67 0.00 0.00 3.07 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.45 1.57 7.81 17 D 8.17 4.52 0.00 2.76 2.51 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 18 L 8.05 3.80 0.00 1.64 1.27 0.54 -0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 19 R 8.24 4.03 0.00 2.00 2.04 0.00 3.12 0.00 0.00 3.18 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.79 0.00 20 D 8.56 4.47 0.00 2.94 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 S 8.50 3.29 0.00 3.40 3.22 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 22 W 8.77 4.25 0.00 3.70 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 23 K 7.91 3.77 0.00 2.04 1.89 0.00 1.78 0.00 0.00 1.68 0.00 0.00 3.00 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.50 1.53 7.81 24 V 7.10 3.80 2.29 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 1.13 0.00 0.00 1.11 0.00 0.00 25 I 7.67 3.39 1.59 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 1.15 0.71 0.65 0.00 0.00 26 G 6.69 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 0.00 0.00 0.00 0.00 0.00 0.00 27 S 7.36 4.24 0.00 3.87 3.95 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 28 D 7.35 4.57 0.00 2.62 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 29 K 8.15 3.89 0.00 1.78 1.74 0.00 1.29 0.00 0.00 0.92 0.00 0.00 2.90 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.28 1.41 7.81 30 K 8.00 4.02 0.00 1.83 1.79 0.00 1.73 0.00 0.00 1.83 0.00 0.00 2.94 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.50 1.51 7.81 31 G 8.16 3.53 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 0.00 32 N 8.26 4.46 0.00 2.74 2.73 0.00 0.00 7.00 6.97 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 33 G 8.11 3.53 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 0.00 34 V 8.09 3.58 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 1.12 0.00 0.00 0.94 0.00 0.00 35 A 8.01 3.96 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 36 L 7.90 3.80 0.00 1.77 1.58 0.81 0.65 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 37 M 7.71 3.51 0.00 1.37 1.81 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.64 0.00 38 T 8.08 3.86 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 39 T 7.85 3.88 4.32 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 1.21 0.00 0.00 40 L 7.83 3.89 0.00 1.67 1.50 0.92 0.83 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 41 F 7.93 4.54 0.00 3.03 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 42 A 7.91 4.03 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 43 D 8.22 4.64 0.00 2.74 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 44 N 8.50 5.07 0.00 2.97 2.91 0.00 0.00 6.60 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 45 Q 8.62 4.44 0.00 2.29 2.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.90 0.00 0.00 0.00 0.00 0.00 2.45 2.33 0.00 46 E 8.30 4.10 0.00 2.22 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 0.00 2.48 2.39 0.00 47 T 8.39 4.47 4.67 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 1.40 0.00 0.00 48 I 7.98 3.74 1.83 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.40 0.53 0.67 0.00 0.00 49 G 7.77 3.63 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 0.00 0.00 0.00 50 Y 7.97 4.21 0.00 2.58 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 51 F 8.28 4.97 0.00 2.94 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 52 K 8.33 3.92 0.00 1.76 1.80 0.00 1.70 0.00 0.00 1.71 0.00 0.00 2.85 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.50 1.42 7.81 53 R 7.99 3.99 0.00 1.83 2.00 0.00 3.31 0.00 0.00 3.25 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.68 0.00 54 L 7.94 4.22 0.00 2.05 1.80 1.10 0.82 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 55 G 7.60 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 56 D 8.36 4.65 0.00 2.78 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 57 V 7.85 3.81 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 0.92 0.00 0.00 0.68 0.00 0.00 58 S 7.99 4.31 0.00 4.03 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 59 Q 8.50 4.18 0.00 2.14 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 5.83 0.00 0.00 0.00 0.00 0.00 2.38 2.38 0.00 60 G 8.54 3.78 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 0.00 0.00 0.00 61 M 9.06 3.88 0.00 1.96 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 2.59 2.61 0.00 62 A 7.69 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 63 N 8.33 4.56 0.00 2.83 2.95 0.00 0.00 7.02 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 64 D 8.73 4.38 0.00 2.74 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 65 K 8.02 4.02 0.00 1.84 1.92 0.00 1.77 0.00 0.00 1.81 0.00 0.00 2.93 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.57 1.53 7.81 66 L 7.90 4.01 0.00 1.83 1.86 0.96 0.96 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 R 8.42 3.99 0.00 2.16 2.05 0.00 3.16 0.00 0.00 3.40 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.66 0.00 68 G 8.48 3.67 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 0.00 0.00 0.00 69 H 8.49 4.25 0.00 3.36 3.54 0.00 5.79 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 70 S 8.47 4.06 0.00 4.04 3.82 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 0.00 0.00 0.00 71 I 7.71 3.92 1.95 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.67 1.15 0.00 0.00 72 I 7.79 4.03 2.07 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 1.45 1.22 0.99 0.00 0.00 73 L 8.12 4.03 0.00 1.75 1.89 0.90 0.83 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 74 M 7.96 4.23 0.00 2.06 2.24 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 2.82 2.90 0.00 75 Y 8.03 3.88 0.00 3.23 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 76 A 7.86 3.67 1.18 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 0.00 0.00 0.00 0.00 0.00 0.00 77 L 7.39 3.38 0.00 1.48 1.21 0.99 1.17 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 78 Q 7.70 3.40 0.00 2.33 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.80 0.00 0.00 0.00 0.00 0.00 2.46 2.47 0.00 79 N 7.57 4.20 0.00 2.79 2.75 0.00 0.00 7.32 6.48 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 80 F 7.53 4.48 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 81 I 7.57 3.48 1.49 0.00 0.00 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.39 0.80 0.00 0.00 82 D 7.97 4.44 0.00 2.79 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 83 Q 7.66 4.39 0.00 2.06 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.75 0.00 0.00 0.00 0.00 0.00 2.62 2.54 0.00 84 L 7.48 3.94 0.00 1.52 1.66 0.79 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 85 D 7.88 4.54 0.00 2.65 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 86 N 8.02 4.81 0.00 2.71 2.65 0.00 0.00 7.07 7.00 0.00 0.00 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 P 0.00 4.19 0.00 2.28 2.16 0.00 3.67 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.19 0.00 88 D 8.25 4.47 0.00 2.88 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 89 D 8.13 4.36 0.00 2.80 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 90 L 7.88 3.84 0.00 1.82 1.67 0.74 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 91 V 7.67 3.27 1.45 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 0.51 0.00 0.00 0.08 0.00 0.00 92 C 7.91 4.11 0.00 3.23 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 93 V 7.92 3.61 2.33 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 1.29 0.00 0.00 1.07 0.00 0.00 94 V 7.88 3.44 1.83 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 0.80 0.00 0.00 0.29 0.00 0.00 95 E 8.08 3.94 0.00 1.94 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 2.29 2.38 0.00 96 K 8.10 4.11 0.00 1.94 2.15 0.00 1.57 0.00 0.00 1.61 0.00 0.00 3.03 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.50 1.59 7.81 97 F 8.65 4.17 0.00 3.33 3.43 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 98 A 8.47 3.76 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 99 V 7.44 3.50 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 1.01 0.00 0.00 1.03 0.00 0.00 100 N 7.99 4.36 0.00 2.60 2.71 0.00 0.00 7.03 8.16 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 0.00 101 H 7.52 4.12 0.00 3.29 3.30 0.00 5.81 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 0.00 102 I 8.03 3.74 1.99 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 1.49 0.82 0.90 0.00 0.00 103 T 7.72 3.88 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 1.19 0.00 0.00 104 R 7.64 4.18 0.00 1.90 1.98 0.00 3.13 0.00 0.00 3.09 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.75 0.00 105 K 8.03 3.85 0.00 1.98 1.95 0.00 1.72 0.00 0.00 1.73 0.00 0.00 2.98 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.40 1.58 7.81 106 I 7.69 4.12 2.02 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.52 1.00 0.00 0.00 107 S 8.45 4.50 0.00 4.09 4.06 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 0.00 108 A 8.50 4.04 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.91 3.99 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 0.00 110 E 8.06 4.08 0.00 2.12 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 0.00 2.24 2.32 0.00 111 F 8.56 4.10 0.00 3.34 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 0.00 112 G 8.44 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 0.00 113 K 7.79 4.18 0.00 1.92 1.92 0.00 1.91 0.00 0.00 1.71 0.00 0.00 3.04 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.52 1.71 7.81 114 I 7.74 3.82 1.55 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 1.36 1.11 0.76 0.00 0.00 115 N 8.27 4.49 0.00 2.95 2.89 0.00 0.00 6.71 7.29 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 0.00 116 G 8.04 3.60 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 0.00 117 P 0.00 4.21 0.00 2.20 2.19 0.00 3.71 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 2.05 2.15 0.00 118 I 7.68 3.48 1.97 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.76 0.59 0.00 0.00 119 K 8.14 3.87 0.00 1.94 2.02 0.00 1.67 0.00 0.00 1.67 0.00 0.00 2.99 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.47 1.54 7.81 120 K 8.10 3.97 0.00 1.96 1.81 0.00 1.70 0.00 0.00 1.55 0.00 0.00 2.91 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.45 1.58 7.81 121 V 7.93 3.54 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 0.89 0.00 0.00 0.88 0.00 0.00 122 L 8.18 3.98 0.00 2.03 1.93 0.56 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 0.00 123 A 8.47 4.24 1.39 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 0.00 124 S 7.99 4.01 0.00 3.98 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 0.00 125 K 7.57 4.32 0.00 2.17 1.96 0.00 1.83 0.00 0.00 1.66 0.00 0.00 2.94 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.63 1.57 7.81 126 N 7.92 4.12 0.00 2.57 2.73 0.00 0.00 6.81 7.89 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 0.00 127 F 8.24 4.36 0.00 3.10 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 0.00 128 G 8.55 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 0.00 0.00 0.00 0.00 129 D 8.92 4.53 0.00 2.75 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 0.00 130 K 8.18 3.85 0.00 1.78 1.56 0.00 1.61 0.00 0.00 1.74 0.00 0.00 2.87 0.00 0.00 2.57 0.00 0.00 0.00 0.00 1.36 1.42 7.81 131 Y 8.35 4.13 0.00 3.45 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 0.00 132 A 8.35 4.19 1.46 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 0.00 0.00 0.00 133 N 8.52 4.30 0.00 3.07 2.89 0.00 0.00 6.92 7.47 0.00 0.00 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 A 7.85 3.92 1.27 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 0.00 0.00 135 W 8.61 3.95 0.00 3.59 3.34 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 0.00 136 A 8.43 4.11 1.46 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 0.00 0.00 0.00 137 K 7.86 3.93 0.00 1.88 1.82 0.00 1.67 0.00 0.00 1.58 0.00 0.00 2.96 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.45 1.43 7.81 138 L 7.76 3.91 0.00 1.46 1.66 0.64 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 139 V 8.12 3.76 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 1.27 0.00 0.00 1.22 0.00 0.00 140 A 8.21 4.38 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 V 7.35 3.41 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 0.58 0.00 0.00 0.80 0.00 0.00 142 V 7.43 3.47 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 0.63 0.00 0.00 0.58 0.00 0.00 143 Q 8.24 3.87 0.00 2.29 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.57 0.00 0.00 0.00 0.00 0.00 2.65 2.72 0.00 144 A 7.93 4.00 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 0.00 145 A 7.91 4.18 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 0.00 146 L 7.41 4.16 0.00 1.75 1.53 0.72 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00