NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.5696 8.1633 118.3427 54.6765 33.2488 174.9363 2 K 4.2888 8.6455 121.7500 55.4181 33.1268 176.6746 3 F 3.9087 9.4881 125.0793 61.6838 40.0298 177.0172 4 L 4.0427 8.2030 119.6093 58.9589 41.6782 179.1670 5 T 4.0431 8.0210 115.5255 66.8412 68.1342 176.4801 6 T 3.9214 7.4013 112.0607 63.6586 68.5871 175.1936 7 N 4.5615 7.8586 118.1461 54.6134 39.1248 174.7894 8 F 4.5780 8.2434 115.9852 57.3027 40.8690 174.2939 9 L 4.5964 8.1638 121.8621 52.9448 42.4461 175.8521 10 K 4.8908 8.2328 122.2159 54.2685 35.4660 175.3335 11 C 3.9267 8.4011 120.2655 60.2374 31.6418 174.0897 12 S 4.3308 8.7073 120.4502 58.9990 63.4928 174.4430 13 V 3.7873 7.6648 122.8421 62.4305 31.7684 176.4810 14 K 3.9053 8.8918 127.3382 59.4706 32.1728 179.0826 15 A 4.0823 7.9863 120.4204 55.0526 18.5151 178.0256 16 C 4.3813 8.2271 112.9542 61.4322 28.6747 175.3855 17 D 4.5026 7.7860 119.9274 57.5415 40.4149 177.8030 18 T 4.2057 7.7428 106.0062 62.1932 69.5451 174.5501 19 S 4.4671 7.8841 118.1435 57.7161 63.0401 173.8108 20 N 4.5693 8.7364 123.4613 55.2465 38.5723 175.3743 21 D 4.8303 8.0681 117.6861 54.0462 41.1968 176.7333 22 N 4.6777 8.0284 116.4403 53.3911 37.9771 174.2790 23 F 4.8229 7.4310 118.7322 56.7824 42.1640 171.6261 24 P 3.7321 0.0000 0.0000 61.5191 32.2155 175.4398 25 L 4.2204 8.0385 118.3689 54.6148 42.8828 176.9212 26 Q 4.5042 8.8201 122.9452 55.0381 29.7030 174.0664 27 Y 4.3761 9.5944 126.1861 57.4736 39.7043 175.1594 28 D 4.5492 9.1521 124.8759 52.8112 39.8994 176.9166 29 G 3.8789 8.7645 116.0952 47.3902 0.0000 174.0823 30 S 3.9038 8.1113 113.9983 60.5297 63.1173 175.1299 31 K 4.4403 7.9824 118.6731 56.9932 33.3917 176.7039 32 C 4.7056 7.6271 118.3425 59.3085 28.8125 173.2509 33 Q 4.5188 9.3188 124.4896 54.7075 29.8949 174.9317 34 L 5.2029 8.5342 123.9681 53.4227 43.9753 176.3688 35 V 4.5900 8.9007 114.8237 59.8110 36.2773 174.3159 36 Q 4.9480 8.6999 122.3457 54.6302 30.0562 174.9304 37 D 4.7597 9.3238 125.0712 52.8269 41.8099 176.1870 38 E 4.3228 8.7466 123.9404 56.6740 29.9810 177.9496 39 S 4.3253 7.9163 113.6050 59.5850 63.6029 174.4853 40 I 3.9500 7.1129 123.2673 60.8324 37.0395 175.2837 41 E 4.1884 8.6640 127.0906 55.4035 30.2551 175.7558 42 F 4.0823 8.7423 128.5116 57.9785 39.9396 174.5104 43 N 4.5332 8.0823 125.5465 50.2881 41.1492 172.4339 44 P 3.7708 0.0000 0.0000 65.7012 31.3262 178.1248 45 E 3.8480 8.0247 117.7356 59.0843 29.5033 178.9054 46 F 4.2271 8.3996 120.5838 61.3291 39.4257 176.8983 47 L 3.8067 8.2023 120.3503 58.0322 41.8103 178.9054 48 L 3.8197 8.2003 119.4162 57.6888 41.2777 179.1574 49 N 4.2878 7.7579 115.3987 56.3062 38.7996 177.2280 50 I 3.7476 7.4960 120.9916 64.4697 37.3882 178.6499 51 V 3.7599 8.0987 119.4108 66.1663 31.0872 177.5103 52 D 4.4845 8.0068 116.9550 57.0284 41.0829 177.6529 53 R 4.2486 7.8802 118.2110 57.4940 30.6209 177.2012 54 V 3.9682 6.9198 110.3427 61.0328 32.3699 176.0410 55 D 4.6013 9.2390 123.3593 53.0753 41.4397 177.0511 56 W 4.1904 8.8648 135.0000 60.2929 30.9282 175.6208 57 P 4.1405 0.0000 0.0000 65.7891 30.7346 178.4063 58 A 3.7758 8.5093 119.5813 54.6617 18.1239 179.7382 59 V 3.4327 7.5209 116.9324 66.2353 31.5003 178.3243 60 L 3.7020 7.4746 118.5526 57.8606 41.3743 179.7112 61 T 3.7530 7.7800 115.6115 66.6778 68.4471 177.0428 62 V 3.7034 7.7125 119.9087 65.7446 31.4398 177.6995 63 A 3.9997 8.4128 120.5875 55.2582 18.2168 179.4428 64 A 4.0054 7.9331 119.0593 55.4530 18.2619 179.4757 65 E 3.9851 8.1754 117.0629 59.3538 29.3089 178.7231 66 L 4.6343 7.7150 115.9434 54.3073 41.8895 177.3715 67 G 3.7805 8.0574 106.9864 45.3330 0.0000 173.0134 68 N 4.7101 8.2526 118.6645 52.0716 39.1530 174.0013 69 N 4.8912 8.7272 122.5201 53.1556 39.3285 174.9461 70 A 4.6273 8.4271 119.2041 51.8490 19.3583 177.6965 71 L 4.6004 7.5477 117.3835 53.5776 42.6679 175.0483 72 P 4.5925 0.0000 0.0000 61.8433 32.0577 175.7876 73 P 4.5452 0.0000 0.0000 65.0230 31.5616 176.3199 74 T 4.5334 7.0604 116.2791 60.7988 70.6273 173.9449 75 K 2.0000 7.8782 126.4966 55.1899 32.4215 174.5927 76 P 3.8736 0.0000 0.0000 62.8364 31.7393 175.6385 77 S 4.6002 7.7860 116.3711 56.4848 65.0921 173.3008 78 F 4.9048 8.1232 119.7233 54.7970 42.6808 172.7235 79 P 4.6088 0.0000 0.0000 62.5561 31.8776 176.7134 80 S 4.3395 8.4518 113.6905 60.2159 63.2062 174.5385 81 S 4.7261 7.9353 114.0293 55.8362 65.6320 174.3841 82 I 3.7114 8.3594 125.1267 64.1562 38.0064 178.0819 83 Q 4.0560 7.7786 118.2133 58.8158 28.5476 177.3776 84 E 4.3161 7.8066 114.6144 56.7223 29.9997 176.8235 85 L 4.3195 7.6110 120.6478 54.7879 42.3098 177.8057 86 T 4.3828 8.8219 114.2783 60.9019 71.3733 175.7230 87 D 4.3999 8.5429 120.6134 57.6828 40.7588 178.8997 88 D 4.3773 8.0503 118.9002 57.3244 40.8673 178.1667 89 D 4.5989 8.5312 119.8319 57.9813 40.8604 178.9490 90 M 4.2076 8.3629 118.7801 58.2756 31.9233 178.7446 91 A 3.9790 8.2820 121.0802 55.0684 18.4789 179.7060 92 I 3.7329 7.9165 118.3056 64.6123 37.1689 178.4678 93 L 4.1081 8.4778 120.1503 58.1210 41.4878 179.3996 94 N 3.9633 8.5248 116.5615 56.4028 38.4266 177.2006 95 D 4.3856 8.2474 120.1774 57.4291 40.8873 178.9161 96 L 4.1322 8.4061 119.7423 57.7714 41.6038 178.9831 97 H 4.2589 8.7619 118.7417 59.6726 29.3495 177.4707 98 T 3.8674 7.9576 117.5100 66.4415 68.0430 176.4555 99 L 3.7446 7.7715 120.9287 58.2465 42.5323 178.6512 100 L 4.4744 8.4805 119.1922 56.8109 41.5313 178.6058 101 L 4.4582 7.7934 116.9076 56.3449 43.4599 178.4215 102 Q 4.4372 7.8891 116.3158 56.5297 28.9860 175.1351 103 T 4.9065 7.2431 117.2378 62.4073 70.0564 174.1816 104 S 5.2584 9.2094 122.8209 56.6501 67.1363 173.5616 105 I 4.5986 8.5940 124.1886 60.7386 37.4425 176.5825 106 A 4.2186 9.1957 130.9940 54.3271 19.8913 176.7796 107 E 5.0517 7.8043 114.7266 54.5654 33.6604 175.2542 108 G 4.2768 8.2833 110.6617 47.0298 0.0000 170.6555 109 E 5.2791 8.0607 119.1270 55.1071 33.3480 174.5012 110 M 5.0967 8.7582 122.4719 53.7733 35.0602 173.6169 111 K 5.1238 8.5658 119.2674 54.9847 36.7705 174.5629 112 C 4.6268 8.7468 122.4412 59.1951 31.8760 174.9732 113 R 3.9015 8.7778 125.5291 58.8604 30.2143 177.5841 114 N 4.5121 8.2710 116.0483 55.6567 39.1374 175.0964 115 C 4.6397 7.9008 108.6267 56.9315 31.1119 174.7279 116 G 3.8222 8.4979 108.6942 45.4861 0.0000 173.1510 117 H 3.8300 7.9314 120.2732 56.7524 30.7617 173.7115 118 I 4.3802 7.7893 126.4103 60.3226 38.2037 174.8752 119 Y 4.6583 8.8248 124.8871 56.5626 41.0999 174.2790 120 Y 5.3750 9.3018 117.5192 56.4309 42.8041 174.6342 121 I 5.0883 8.9091 122.6407 59.5042 40.3365 174.5417 122 K 5.5109 8.8881 128.0326 54.0753 35.2528 175.8915 123 N 4.2252 10.0504 125.2916 54.4365 36.7219 175.4587 124 G 4.1924 8.6611 104.9192 46.2597 0.0000 173.8187 125 I 4.4384 7.7858 122.0712 58.5232 38.7967 173.6723 126 P 5.0021 0.0000 0.0000 62.7362 32.0287 175.3453 127 N 4.9384 8.7343 116.7591 52.6898 37.6503 174.4092 128 L 4.7005 7.5418 119.3198 53.1788 44.6829 175.6574 129 L 4.0255 8.4124 127.3129 54.9842 42.4512 176.4665 130 L 4.2227 8.3922 126.8654 53.5773 42.2312 175.2072 131 P 4.4527 0.0000 0.0000 61.9401 31.9291 175.6125 132 P 4.3610 0.0000 0.0000 65.1382 31.6983 175.6322 133 H 4.7057 7.5260 113.3077 54.3393 31.3166 172.8352 134 L 3.9555 7.9460 120.8816 52.8491 42.3203 176.5093 135 V 4.5225 7.6910 121.8963 60.6578 34.2074 174.1249 136 H 4.5251 8.8115 117.7627 56.1097 28.9262 174.4345 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 8.16 4.57 0.00 2.29 2.31 0.00 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.64 0.00 2 K 8.65 4.29 0.00 1.98 2.04 0.00 1.76 0.00 0.00 1.98 0.00 0.00 2.95 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.70 1.54 7.81 3 F 9.49 3.91 0.00 3.07 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 4 L 8.20 4.04 0.00 2.08 1.78 1.18 0.67 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 5 T 8.02 4.04 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 1.26 0.00 0.00 6 T 7.40 3.92 3.52 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 0.49 0.00 0.00 7 N 7.86 4.56 0.00 2.59 2.49 0.00 0.00 6.95 6.55 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 8 F 8.24 4.58 0.00 3.01 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 9 L 8.16 4.60 0.00 1.75 1.65 0.96 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 10 K 8.23 4.89 0.00 2.03 1.80 0.00 1.78 0.00 0.00 1.56 0.00 0.00 2.94 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.25 1.36 7.81 11 C 8.40 3.93 0.00 3.05 2.95 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 12 S 8.71 4.33 0.00 4.02 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 13 V 7.66 3.79 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 1.03 0.00 0.00 0.94 0.00 0.00 14 K 8.89 3.91 0.00 1.91 1.86 0.00 1.63 0.00 0.00 1.83 0.00 0.00 2.99 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.54 1.52 7.81 15 A 7.99 4.08 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 16 C 8.23 4.38 0.00 3.23 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 17 D 7.79 4.50 0.00 2.80 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 18 T 7.74 4.21 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 19 S 7.88 4.47 0.00 3.85 3.94 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 20 N 8.74 4.57 0.00 2.77 2.88 0.00 0.00 6.92 8.06 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 21 D 8.07 4.83 0.00 2.66 2.66 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 22 N 8.03 4.68 0.00 2.95 3.24 0.00 0.00 5.61 8.12 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 23 F 7.43 4.82 0.00 2.97 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 24 P 0.00 3.73 0.00 1.94 1.16 0.00 3.49 0.00 0.00 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.50 0.00 25 L 8.04 4.22 0.00 1.08 1.37 0.64 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 26 Q 8.82 4.50 0.00 2.02 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.99 0.00 0.00 0.00 0.00 0.00 2.25 2.48 0.00 27 Y 9.59 4.38 0.00 3.05 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 28 D 9.15 4.55 0.00 2.66 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 29 G 8.76 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 30 S 8.11 3.90 0.00 4.05 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 K 7.98 4.44 0.00 1.84 1.96 0.00 1.84 0.00 0.00 1.85 0.00 0.00 3.03 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.44 1.43 7.81 32 C 7.63 4.71 0.00 2.86 2.96 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 33 Q 9.32 4.52 0.00 1.99 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.57 6.78 0.00 0.00 0.00 0.00 0.00 2.35 2.51 0.00 34 L 8.53 5.20 0.00 1.53 1.60 0.93 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 35 V 8.90 4.59 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 0.75 0.00 0.00 1.01 0.00 0.00 36 Q 8.70 4.95 0.00 1.93 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.59 7.00 0.00 0.00 0.00 0.00 0.00 2.29 2.28 0.00 37 D 9.32 4.76 0.00 2.68 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 E 8.75 4.32 0.00 2.02 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 2.31 2.31 0.00 39 S 7.92 4.33 0.00 3.95 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 40 I 7.11 3.95 1.94 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 1.24 0.58 1.03 0.00 0.00 41 E 8.66 4.19 0.00 1.95 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.34 0.00 42 F 8.74 4.08 0.00 2.74 2.91 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 0.00 0.00 0.00 43 N 8.08 4.53 0.00 2.64 2.63 0.00 0.00 6.94 7.71 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 44 P 0.00 3.77 0.00 2.13 2.08 0.00 3.46 0.00 0.00 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.95 0.00 45 E 8.02 3.85 0.00 2.17 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 0.00 2.36 2.31 0.00 46 F 8.40 4.23 0.00 3.00 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 47 L 8.20 3.81 0.00 1.77 1.61 0.98 0.80 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 48 L 8.20 3.82 0.00 1.77 1.60 0.80 -0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 49 N 7.76 4.29 0.00 2.81 2.82 0.00 0.00 7.09 7.46 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 50 I 7.50 3.75 1.84 0.00 0.00 0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.37 0.92 0.00 0.00 51 V 8.10 3.76 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 1.15 0.00 0.00 1.06 0.00 0.00 52 D 8.01 4.48 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 53 R 7.88 4.25 0.00 2.06 2.21 0.00 3.26 0.00 0.00 3.31 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.78 0.00 54 V 6.92 3.97 2.28 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 0.98 0.00 0.00 1.35 0.00 0.00 55 D 9.24 4.60 0.00 2.50 2.57 0.00 0.00 0.00 0.00 0.00 0.00 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 W 8.86 4.19 0.00 3.49 3.13 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 57 P 0.00 4.14 0.00 2.30 2.10 0.00 3.91 0.00 0.00 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.26 0.00 58 A 8.51 3.78 1.08 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 59 V 7.52 3.43 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 0.69 0.00 0.00 0.98 0.00 0.00 60 L 7.47 3.70 0.00 1.69 1.55 0.99 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 61 T 7.78 3.75 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 1.17 0.00 0.00 62 V 7.71 3.70 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 0.34 0.00 0.00 0.77 0.00 0.00 63 A 8.41 4.00 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 64 A 7.93 4.01 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 65 E 8.18 3.99 0.00 2.28 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 2.37 2.49 0.00 66 L 7.71 4.63 0.00 1.68 1.72 1.01 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 67 G 8.06 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 68 N 8.25 4.71 0.00 2.52 2.69 0.00 0.00 6.89 7.34 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 69 N 8.73 4.89 0.00 2.70 2.75 0.00 0.00 7.00 7.35 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 70 A 8.43 4.63 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 71 L 7.55 4.60 0.00 1.64 1.76 0.67 1.11 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 72 P 0.00 4.59 0.00 2.38 2.22 0.00 4.05 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.00 0.00 73 P 0.00 4.55 0.00 2.27 2.30 0.00 3.77 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 2.03 2.03 0.00 74 T 7.06 4.53 4.16 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 1.07 0.00 0.00 75 K 7.88 2.00 0.00 1.04 1.31 0.00 1.69 0.00 0.00 1.80 0.00 0.00 3.19 0.00 0.00 2.95 0.00 0.00 0.00 0.00 0.90 0.74 7.81 76 P 0.00 3.87 0.00 1.74 1.56 0.00 2.86 0.00 0.00 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.88 0.00 77 S 7.79 4.60 0.00 3.82 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 F 8.12 4.90 0.00 3.00 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 79 P 0.00 4.61 0.00 2.21 2.11 0.00 4.01 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 2.06 2.19 0.00 80 S 8.45 4.34 0.00 3.90 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 S 7.94 4.73 0.00 3.81 3.84 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 82 I 8.36 3.71 1.84 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.17 0.90 0.00 0.00 83 Q 7.78 4.06 0.00 2.08 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.51 6.66 0.00 0.00 0.00 0.00 0.00 2.40 2.35 0.00 84 E 7.81 4.32 0.00 1.96 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 2.33 2.29 0.00 85 L 7.61 4.32 0.00 1.78 1.67 0.89 0.89 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 86 T 8.82 4.38 4.27 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 1.23 0.00 0.00 87 D 8.54 4.40 0.00 2.72 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 88 D 8.05 4.38 0.00 2.70 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 89 D 8.53 4.60 0.00 3.06 3.02 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 90 M 8.36 4.21 0.00 2.08 2.28 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 2.69 2.77 0.00 91 A 8.28 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 92 I 7.92 3.73 2.26 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 1.57 0.80 1.09 0.00 0.00 93 L 8.48 4.11 0.00 2.01 2.06 0.70 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 94 N 8.52 3.96 0.00 2.76 2.67 0.00 0.00 7.07 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 D 8.25 4.39 0.00 2.91 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 96 L 8.41 4.13 0.00 1.98 1.88 1.16 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 97 H 8.76 4.26 0.00 3.70 3.67 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 98 T 7.96 3.87 4.38 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 1.19 0.00 0.00 99 L 7.77 3.74 0.00 1.48 1.61 0.15 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 100 L 8.48 4.47 0.00 1.86 1.84 1.10 0.84 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 0.00 101 L 7.79 4.46 0.00 1.66 1.72 1.13 0.89 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 0.00 102 Q 7.89 4.44 0.00 2.24 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.95 0.00 0.00 0.00 0.00 0.00 2.60 2.32 0.00 103 T 7.24 4.91 4.43 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 1.21 0.00 0.00 104 S 9.21 5.26 0.00 3.73 3.75 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 0.00 105 I 8.59 4.60 1.93 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 1.21 1.14 1.05 0.00 0.00 106 A 9.20 4.22 1.35 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 0.00 0.00 0.00 107 E 7.80 5.05 0.00 2.09 1.78 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 2.31 2.43 0.00 108 G 8.28 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 0.00 0.00 0.00 0.00 109 E 8.06 5.28 0.00 2.11 1.75 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 2.07 2.00 0.00 110 M 8.76 5.10 0.00 1.15 0.95 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 2.41 0.00 111 K 8.57 5.12 0.00 1.82 1.77 0.00 1.24 0.00 0.00 1.50 0.00 0.00 2.74 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.21 1.27 7.81 112 C 8.75 4.63 0.00 3.22 2.91 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 0.00 0.00 0.00 113 R 8.78 3.90 0.00 2.04 1.96 0.00 3.20 0.00 0.00 3.10 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.56 0.00 114 N 8.27 4.51 0.00 2.68 2.85 0.00 0.00 6.77 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 0.00 115 C 7.90 4.64 0.00 3.08 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 0.00 116 G 8.50 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 0.00 0.00 0.00 117 H 7.93 3.83 0.00 3.17 2.99 0.00 5.86 0.00 0.00 0.00 0.00 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 I 7.79 4.38 1.61 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 0.69 0.44 0.00 0.00 119 Y 8.82 4.66 0.00 2.81 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 0.00 120 Y 9.30 5.37 0.00 2.93 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 0.00 121 I 8.91 5.09 1.98 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 1.21 1.11 1.03 0.00 0.00 122 K 8.89 5.51 0.00 1.82 1.65 0.00 1.82 0.00 0.00 1.75 0.00 0.00 2.84 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.34 1.39 7.81 123 N 10.05 4.23 0.00 2.85 2.86 0.00 0.00 7.16 8.79 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 0.00 124 G 8.66 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 I 7.79 4.44 2.01 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 1.38 0.98 0.95 0.00 0.00 126 P 0.00 5.00 0.00 2.20 2.10 0.00 3.79 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 2.01 1.98 0.00 127 N 8.73 4.94 0.00 2.98 3.07 0.00 0.00 6.63 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 L 7.54 4.70 0.00 1.34 1.39 0.58 0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 129 L 8.41 4.03 0.00 1.62 1.56 0.93 1.00 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 0.00 130 L 8.39 4.22 0.00 1.68 1.59 0.94 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 131 P 0.00 4.45 0.00 2.38 2.15 0.00 3.70 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.96 0.00 132 P 0.00 4.36 0.00 2.18 2.21 0.00 3.81 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.95 0.00 133 H 7.53 4.71 0.00 3.26 3.18 0.00 5.54 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 0.00 134 L 7.95 3.96 0.00 0.85 0.13 0.63 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 135 V 7.69 4.52 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 0.55 0.00 0.00 0.93 0.00 0.00 136 H 8.81 4.53 0.00 3.19 3.17 0.00 5.73 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