NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 P 4.3922 0.0000 0.0000 62.2504 33.4179 177.0484 2 R 3.9195 8.0244 119.4964 56.7076 30.2081 174.2544 3 R 4.4215 7.7959 110.7116 57.6394 32.0595 176.4283 4 R 4.1580 7.6430 123.5783 54.0642 28.1479 176.1143 5 V 3.9785 7.6624 116.3621 61.2939 33.2472 175.8756 6 I 4.2959 7.6903 115.9069 60.1619 40.0713 173.2860 7 G 4.1291 8.8849 106.3431 44.8001 0.0000 172.9963 8 Q 4.6878 8.6493 113.4724 55.0919 31.0905 174.8984 9 R 4.0853 8.6977 118.4464 56.3281 30.0207 175.6198 10 K 4.7127 8.3062 117.6083 54.5120 35.4674 175.4476 11 I 4.6130 7.2681 110.1005 58.4214 40.1668 175.5837 12 L 4.0331 8.4168 121.4012 54.4814 41.9316 175.6991 13 P 4.5841 0.0000 0.0000 61.7745 32.6097 175.0486 14 D 4.4338 8.9360 118.6936 53.7869 40.9792 174.9866 15 P 4.2603 0.0000 0.0000 65.1763 31.0726 176.7802 16 K 4.5547 9.9175 117.9214 55.9236 32.7274 175.6215 17 F 4.4391 8.4556 113.7200 58.8575 43.5736 175.6972 18 G 4.0531 8.6862 106.4433 45.0408 0.0000 173.2340 19 S 4.5584 7.8395 114.5017 57.2581 63.8109 174.5906 20 E 3.9211 8.8020 126.6955 59.5806 29.3701 179.1372 21 L 3.9089 7.9320 118.5260 58.0036 41.5854 179.2330 22 L 3.6306 7.3255 118.3719 58.1164 41.9377 178.5915 23 A 3.9699 8.0299 120.0520 55.3780 18.1270 179.2601 24 K 3.7913 8.2608 116.9392 59.7823 32.1798 179.1418 25 F 4.3361 8.3235 120.5533 61.4956 39.2682 177.5552 26 V 3.3808 8.0879 112.2571 64.3121 31.0905 178.0477 27 N 4.4255 8.0192 115.1251 56.7202 38.5497 176.8009 28 I 3.7217 7.5938 119.6346 64.4862 37.2719 177.4926 29 L 4.0761 7.3580 119.2735 55.9906 42.3277 176.4197 30 M 4.0092 7.6283 119.1458 55.9775 32.9164 175.0710 31 V 4.2110 8.2036 117.8635 61.8158 33.5403 172.3698 32 D 4.4155 9.8759 118.7425 54.8477 38.5275 173.8358 33 G 3.7966 7.9882 104.1268 47.0145 0.0000 175.5425 34 K 4.3523 8.1163 121.3919 54.4836 31.8532 177.6049 35 K 3.8622 8.4355 124.3006 59.4994 32.0631 177.9294 36 S 4.1140 8.0935 115.1312 62.3010 62.7968 177.0392 37 T 3.9241 7.8468 111.2328 64.5829 68.8483 175.9858 38 A 3.9040 7.7527 123.5218 55.1109 18.2928 179.3670 39 E 3.5154 8.3166 115.6640 59.6522 29.1627 179.3319 40 S 4.2207 7.7728 115.2319 61.5975 62.3663 176.7928 41 I 3.9211 7.7798 122.3250 63.8128 36.8471 178.7112 42 V 3.5843 7.6147 119.2650 66.2752 31.5576 177.7645 43 Y 4.4080 7.8613 116.8527 61.2018 37.6037 178.5762 44 S 4.1924 7.9981 112.6613 61.3381 62.4262 176.1417 45 A 4.0340 7.8170 122.4956 54.9676 18.2467 179.1045 46 L 4.0858 8.3259 118.0370 56.9937 42.0523 178.5260 47 E 4.1118 8.0180 119.3578 59.5901 29.9232 178.1041 48 T 3.8700 8.1253 110.0335 64.6946 68.6649 175.9218 49 L 3.9010 8.3544 122.9748 57.8972 42.2073 178.3963 50 A 4.0091 7.8864 120.6759 55.7326 18.0587 179.4913 51 Q 3.9268 8.1595 116.4320 59.2247 29.3475 178.0051 52 R 4.0731 8.1245 118.1509 58.1652 30.2683 177.3728 53 S 4.5817 8.3078 113.3055 58.0963 64.1111 176.9182 54 G 4.0405 8.1711 110.2465 46.3333 0.0000 174.9585 55 K 4.2447 7.9060 119.8800 57.6652 29.5324 178.1258 56 S 3.5383 7.9658 115.6232 58.7351 62.9790 169.2684 57 E 4.5685 8.4445 113.6618 57.4575 31.9206 178.0878 58 L 4.0952 8.2099 118.2605 58.0578 41.6652 178.6868 59 E 4.4236 8.0480 114.0954 56.8241 30.1407 177.7135 60 A 3.9908 7.8801 123.1445 55.2557 18.3644 179.6635 61 F 3.8729 8.1721 118.7968 61.3450 39.4740 176.4368 62 E 4.0315 7.7218 116.8047 59.8932 29.6316 178.6905 63 V 3.6408 8.1643 117.6534 66.3155 31.7514 177.8397 64 A 4.0712 7.6439 119.6006 54.8446 18.0663 178.8499 65 L 3.9708 7.7487 118.0285 56.8181 42.0066 177.7900 66 E 4.1522 8.1790 118.0894 58.0515 29.7098 177.5989 67 N 4.5298 7.4575 114.7001 56.4331 38.9175 177.1597 68 V 3.9396 8.0187 118.0548 65.4695 31.9348 176.0729 69 R 3.5217 6.9537 117.2561 54.7580 29.6751 173.7886 70 P 4.9876 0.0000 0.0000 62.1861 33.1976 175.0967 71 T 4.6285 8.3373 111.4945 64.2596 71.8618 174.7614 72 V 4.7172 7.6831 111.6030 59.8899 35.9570 175.3878 73 E 4.6680 9.0228 120.5109 55.5974 33.0091 173.7726 74 V 4.7670 8.3987 111.1967 60.0687 35.6028 174.9610 75 K 4.4376 8.9397 126.9107 54.2080 33.3380 175.7309 76 S 4.2732 8.6273 122.7392 59.0592 63.5271 174.0116 77 R 4.3113 8.5796 121.8755 57.3413 31.8784 177.0695 78 R 3.6872 7.8342 112.0587 57.5422 26.7975 175.2975 79 V 3.7480 7.7383 119.2681 62.7351 32.7323 176.2719 80 G 3.7837 7.3112 115.9050 44.0559 0.0000 173.0000 81 G 3.9923 8.6982 111.5647 45.8193 0.0000 171.5473 82 S 4.8913 7.7513 115.4034 56.7505 66.2795 175.5143 83 T 3.8736 8.8607 120.0799 65.8217 69.0587 174.6980 84 Y 3.4450 7.8610 118.5821 58.4552 34.9913 173.5736 85 Q 4.1159 7.2551 123.1429 55.5622 29.8017 175.9899 86 V 4.1029 8.0695 128.0894 61.3152 33.1881 173.4659 87 P 5.1091 0.0000 0.0000 62.7387 32.3587 175.5241 88 V 4.5996 8.6284 120.7789 60.0764 35.6374 174.1000 89 E 4.7741 8.6604 121.2595 54.9038 30.0989 176.7052 90 V 3.8296 7.9473 125.5385 61.4985 32.2913 176.8216 91 R 4.1530 8.5543 123.1311 55.6481 31.1207 174.8972 92 P 5.0973 0.0000 0.0000 60.0374 28.3286 174.9769 93 V 4.3578 6.9730 119.8409 61.0458 36.3876 174.9612 94 R 3.8065 8.0544 119.3688 60.9689 30.1306 178.8679 95 R 3.2747 7.9527 115.7570 57.8794 30.3748 177.0979 96 N 4.1716 8.1605 115.8126 56.2184 37.2755 176.8619 97 A 3.9596 7.2654 121.2604 54.6799 18.3932 179.4588 98 L 3.3371 7.9078 117.4007 57.6957 41.6084 179.2934 99 A 3.7730 7.4577 120.5429 55.6490 18.1237 179.4903 100 M 4.0610 8.0959 116.9467 58.8115 32.0536 179.1433 101 R 3.9235 7.9872 118.6458 59.0282 30.1941 178.5629 102 W 4.4980 8.3142 119.3291 59.6761 28.9738 178.3674 103 I 3.7591 8.1818 120.0484 64.2754 36.5684 178.2995 104 V 3.5903 8.3641 119.0352 66.3982 31.2466 177.9975 105 E 3.9710 8.3632 117.0055 58.7259 29.5618 178.4855 106 A 4.1261 7.9751 120.9515 55.1516 18.6565 179.2127 107 A 3.9167 8.2800 119.3909 55.4158 18.1429 179.5434 108 R 3.8746 7.9541 116.3386 59.4334 30.0934 177.8562 109 K 4.3993 7.8116 115.4354 55.4735 32.4742 176.8518 110 R 4.2054 7.5923 120.6002 56.0071 31.2586 176.9579 111 G 4.1648 8.2935 111.5293 44.4859 0.0000 172.8564 112 D 4.9955 7.4018 124.2659 54.6626 41.4893 176.1278 113 K 4.2972 8.3542 122.6535 57.9921 35.0192 176.9445 114 S 4.3216 8.2542 114.5904 58.4943 65.1861 173.8271 115 M 4.2399 8.7082 126.4441 58.4791 31.8623 178.6230 116 A 3.9711 8.1331 121.1398 55.0442 18.5450 179.4464 117 L 3.9230 7.8742 116.9079 58.0925 41.5848 179.5251 118 R 4.0712 8.1393 116.8056 60.2500 30.3916 177.9730 119 L 3.8537 8.5525 119.3789 57.2355 41.6951 178.6872 120 A 3.9788 8.5669 119.7440 55.6791 18.4151 179.6554 121 N 4.3307 8.6226 114.9502 56.0298 38.4724 177.7683 122 E 3.9631 8.7436 120.7240 59.3542 29.6902 178.2925 123 L 3.8104 8.0497 119.6924 58.9370 41.5505 179.0264 124 S 4.1095 8.5750 112.8492 61.1542 61.8832 175.7056 125 D 4.3642 7.7846 120.2917 57.1505 40.9143 177.9984 126 A 4.0355 8.1933 121.1694 54.6606 18.2714 179.1059 127 A 4.0832 7.8293 119.0499 54.1750 18.5833 177.8235 128 E 4.4033 7.3822 113.9684 61.0345 29.9759 178.7818 129 N 3.9219 8.5192 114.2162 55.2149 34.9384 174.2022 130 K 4.4318 8.2855 120.8501 57.1984 35.7595 177.9524 131 G 3.9540 7.7522 107.6958 44.5820 0.0000 174.1152 132 T 3.9358 8.3443 115.4677 66.6237 68.4603 176.2773 133 A 3.9957 8.0567 122.1197 55.7416 18.2764 179.8442 134 V 3.6095 7.8424 109.7721 64.5184 31.3708 178.6497 135 K 3.8517 7.3499 117.3092 59.2556 32.2299 178.3832 136 K 3.6183 7.8729 119.9473 59.1055 31.7345 178.8301 137 R 3.8901 7.4469 119.0812 59.1819 30.3173 179.6521 138 E 4.5376 8.1020 118.3680 55.5720 29.1752 177.1059 139 D 4.7395 7.5651 117.9301 55.0492 47.3800 178.5601 140 V 3.5530 7.9566 118.4698 66.1285 31.1716 177.7131 141 H 4.3034 8.2734 115.3997 58.2427 28.5459 177.8045 142 R 4.0487 7.7245 119.1525 59.3529 30.4952 177.9776 143 M 4.1119 8.1579 117.8336 57.9604 32.4364 176.4473 144 A 4.5744 7.6439 120.9904 51.8707 19.7515 177.4526 145 E 3.8451 8.8768 116.8781 56.8404 28.5630 173.3246 146 A 4.5838 7.4870 116.9843 54.8613 21.2642 177.9220 147 N 4.8028 8.1773 108.7367 54.0566 38.2646 177.1902 148 K 4.0366 7.8443 120.2347 58.5071 32.2548 177.3697 149 A 4.2347 8.0909 119.5162 53.8852 18.4691 177.4211 150 F 4.5182 8.3591 114.2189 56.8776 39.1673 175.9710 151 A 4.2344 8.2309 129.6299 52.9184 18.0266 178.1914 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 P 0.00 4.39 0.00 2.19 2.24 0.00 3.73 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.96 0.00 2 R 8.02 3.92 0.00 1.88 1.99 0.00 3.18 0.00 0.00 3.25 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.68 0.00 3 R 7.80 4.42 0.00 1.90 1.94 0.00 3.08 0.00 0.00 3.15 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.57 0.00 4 R 7.64 4.16 0.00 1.77 1.91 0.00 3.30 0.00 0.00 3.22 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.71 0.00 5 V 7.66 3.98 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 0.84 0.00 0.00 0.93 0.00 0.00 6 I 7.69 4.30 1.87 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 1.35 0.45 0.91 0.00 0.00 7 G 8.88 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 8 Q 8.65 4.69 0.00 2.15 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.95 0.00 0.00 0.00 0.00 0.00 2.07 2.07 0.00 9 R 8.70 4.09 0.00 1.94 1.98 0.00 2.97 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 1.59 1.66 0.00 10 K 8.31 4.71 0.00 1.72 1.88 0.00 1.68 0.00 0.00 1.76 0.00 0.00 3.03 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.32 1.54 7.81 11 I 7.27 4.61 1.87 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 1.30 0.68 0.91 0.00 0.00 12 L 8.42 4.03 0.00 1.67 1.68 0.93 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 13 P 0.00 4.58 0.00 2.18 2.14 0.00 3.79 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 2.01 1.96 0.00 14 D 8.94 4.43 0.00 2.83 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 15 P 0.00 4.26 0.00 2.32 2.27 0.00 3.89 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 2.24 2.18 0.00 16 K 9.92 4.55 0.00 1.41 1.64 0.00 1.43 0.00 0.00 0.61 0.00 0.00 2.79 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.04 1.14 7.81 17 F 8.46 4.44 0.00 3.18 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 18 G 8.69 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 19 S 7.84 4.56 0.00 3.87 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 E 8.80 3.92 0.00 2.04 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 2.40 2.40 0.00 21 L 7.93 3.91 0.00 1.57 1.53 0.97 0.52 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 22 L 7.33 3.63 0.00 1.43 1.61 0.39 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 23 A 8.03 3.97 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 24 K 8.26 3.79 0.00 2.06 1.93 0.00 1.68 0.00 0.00 1.58 0.00 0.00 2.96 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.66 7.81 25 F 8.32 4.34 0.00 3.14 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 26 V 8.09 3.38 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 0.74 0.00 0.00 0.94 0.00 0.00 27 N 8.02 4.43 0.00 2.85 2.86 0.00 0.00 7.08 8.04 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 28 I 7.59 3.72 1.93 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 1.68 0.81 0.86 0.00 0.00 29 L 7.36 4.08 0.00 1.17 1.46 0.72 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 30 M 7.63 4.01 0.00 1.93 2.05 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.51 0.00 31 V 8.20 4.21 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 0.67 0.00 0.00 0.91 0.00 0.00 32 D 9.88 4.42 0.00 2.78 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 33 G 7.99 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 34 K 8.12 4.35 0.00 1.84 1.74 0.00 1.65 0.00 0.00 1.56 0.00 0.00 2.88 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.35 1.48 7.81 35 K 8.44 3.86 0.00 1.81 1.78 0.00 1.75 0.00 0.00 1.82 0.00 0.00 2.95 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.49 1.50 7.81 36 S 8.09 4.11 0.00 3.90 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 37 T 7.85 3.92 4.23 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 1.20 0.00 0.00 38 A 7.75 3.90 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 39 E 8.32 3.52 0.00 1.82 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 2.65 2.43 0.00 40 S 7.77 4.22 0.00 4.12 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 41 I 7.78 3.92 1.95 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 1.40 1.37 0.89 0.00 0.00 42 V 7.61 3.58 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 1.06 0.00 0.00 0.74 0.00 0.00 43 Y 7.86 4.41 0.00 3.08 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 S 8.00 4.19 0.00 4.06 3.91 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 45 A 7.82 4.03 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 46 L 8.33 4.09 0.00 2.08 1.79 1.06 0.58 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 47 E 8.02 4.11 0.00 2.56 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 0.00 2.33 2.41 0.00 48 T 8.13 3.87 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 1.31 0.00 0.00 49 L 8.35 3.90 0.00 1.90 1.77 0.96 1.25 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 50 A 7.89 4.01 1.65 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 0.00 0.00 51 Q 8.16 3.93 0.00 2.08 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.90 0.00 0.00 0.00 0.00 0.00 2.39 2.38 0.00 52 R 8.12 4.07 0.00 2.10 1.93 0.00 3.29 0.00 0.00 3.29 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.65 0.00 53 S 8.31 4.58 0.00 4.10 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 54 G 8.17 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 55 K 7.91 4.24 0.00 1.76 1.82 0.00 1.89 0.00 0.00 1.64 0.00 0.00 2.87 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.68 1.53 7.81 56 S 7.97 3.54 0.00 3.97 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 57 E 8.44 4.57 0.00 2.11 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 0.00 2.56 2.68 0.00 58 L 8.21 4.10 0.00 1.78 1.83 0.95 0.91 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 59 E 8.05 4.42 0.00 2.23 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 0.00 2.36 2.40 0.00 60 A 7.88 3.99 1.43 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 0.00 0.00 61 F 8.17 3.87 0.00 3.00 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 62 E 7.72 4.03 0.00 2.21 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 2.41 2.54 0.00 63 V 8.16 3.64 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 0.96 0.00 0.00 0.96 0.00 0.00 64 A 7.64 4.07 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 65 L 7.75 3.97 0.00 1.07 1.69 0.59 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 66 E 8.18 4.15 0.00 2.12 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 2.31 2.34 0.00 67 N 7.46 4.53 0.00 2.95 2.85 0.00 0.00 6.91 7.56 0.00 0.00 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 V 8.02 3.94 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 1.20 0.00 0.00 1.00 0.00 0.00 69 R 6.95 3.52 0.00 1.94 1.82 0.00 3.33 0.00 0.00 3.24 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.67 0.00 70 P 0.00 4.99 0.00 2.32 2.36 0.00 3.71 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 1.91 1.84 0.00 71 T 8.34 4.63 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 1.25 0.00 0.00 72 V 7.68 4.72 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 0.81 0.00 0.00 0.92 0.00 0.00 73 E 9.02 4.67 0.00 2.01 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 0.00 2.20 2.29 0.00 74 V 8.40 4.77 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 0.66 0.00 0.00 0.91 0.00 0.00 75 K 8.94 4.44 0.00 1.74 1.66 0.00 1.65 0.00 0.00 1.66 0.00 0.00 2.92 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.34 1.38 7.81 76 S 8.63 4.27 0.00 3.90 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 77 R 8.58 4.31 0.00 2.13 2.02 0.00 3.55 0.00 0.00 3.26 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.66 0.00 78 R 7.83 3.69 0.00 1.86 1.94 0.00 3.34 0.00 0.00 3.17 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.70 0.00 79 V 7.74 3.75 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 0.62 0.00 0.00 0.91 0.00 0.00 80 G 7.31 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 81 G 8.70 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 82 S 7.75 4.89 0.00 4.08 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 T 8.86 3.87 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 1.20 0.00 0.00 84 Y 7.86 3.45 0.00 3.03 3.30 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 85 Q 7.26 4.12 0.00 1.98 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.67 6.89 0.00 0.00 0.00 0.00 0.00 2.30 2.23 0.00 86 V 8.07 4.10 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 1.06 0.00 0.00 1.19 0.00 0.00 87 P 0.00 5.11 0.00 2.13 2.03 0.00 3.83 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.15 0.00 88 V 8.63 4.60 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 0.83 0.00 0.00 0.94 0.00 0.00 89 E 8.66 4.77 0.00 1.86 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 2.28 2.37 0.00 90 V 7.95 3.83 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 0.70 0.00 0.00 0.90 0.00 0.00 91 R 8.55 4.15 0.00 1.89 1.88 0.00 3.12 0.00 0.00 3.33 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.65 0.00 92 P 0.00 5.10 0.00 2.04 2.02 0.00 3.73 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.10 0.00 93 V 6.97 4.36 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 0.91 0.00 0.00 0.89 0.00 0.00 94 R 8.05 3.81 0.00 1.84 2.00 0.00 3.18 0.00 0.00 3.24 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.61 0.00 95 R 7.95 3.27 0.00 2.13 1.70 0.00 3.16 0.00 0.00 3.28 7.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.77 0.00 96 N 8.16 4.17 0.00 2.95 3.07 0.00 0.00 5.89 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 97 A 7.27 3.96 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 98 L 7.91 3.34 0.00 1.24 0.30 0.79 0.56 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 99 A 7.46 3.77 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 0.00 100 M 8.10 4.06 0.00 2.45 2.39 0.00 0.00 0.00 0.00 0.00 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.84 2.61 0.00 101 R 7.99 3.92 0.00 1.81 1.88 0.00 3.11 0.00 0.00 3.19 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.68 0.00 102 W 8.31 4.50 0.00 3.60 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 I 8.18 3.76 2.23 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.93 1.01 0.00 0.00 104 V 8.36 3.59 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 0.90 0.00 0.00 0.72 0.00 0.00 105 E 8.36 3.97 0.00 2.03 2.36 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 2.37 2.38 0.00 106 A 7.98 4.13 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 A 8.28 3.92 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 0.00 108 R 7.95 3.87 0.00 2.00 2.15 0.00 3.29 0.00 0.00 3.21 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.73 0.00 109 K 7.81 4.40 0.00 1.84 1.81 0.00 1.76 0.00 0.00 1.63 0.00 0.00 3.01 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.67 1.58 7.81 110 R 7.59 4.21 0.00 1.75 1.96 0.00 3.35 0.00 0.00 3.43 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.57 0.00 111 G 8.29 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 0.00 0.00 0.00 0.00 112 D 7.40 5.00 0.00 2.66 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 0.00 0.00 0.00 113 K 8.35 4.30 0.00 1.70 1.59 0.00 1.76 0.00 0.00 1.63 0.00 0.00 2.97 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.32 1.32 7.81 114 S 8.25 4.32 0.00 3.89 3.73 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 0.00 115 M 8.71 4.24 0.00 2.15 2.04 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.64 0.00 116 A 8.13 3.97 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 0.00 117 L 7.87 3.92 0.00 1.76 1.74 0.96 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 118 R 8.14 4.07 0.00 1.89 2.17 0.00 3.33 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.85 0.00 119 L 8.55 3.85 0.00 2.00 1.74 1.01 1.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 120 A 8.57 3.98 1.43 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 0.00 0.00 121 N 8.62 4.33 0.00 2.97 2.89 0.00 0.00 7.11 7.50 0.00 0.00 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 E 8.74 3.96 0.00 2.13 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 2.34 2.59 0.00 123 L 8.05 3.81 0.00 1.93 1.72 0.73 0.72 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 0.00 124 S 8.57 4.11 0.00 3.92 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 0.00 125 D 7.78 4.36 0.00 3.17 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 A 8.19 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 0.00 127 A 7.83 4.08 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 0.00 128 E 7.38 4.40 0.00 2.09 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 2.41 2.29 0.00 129 N 8.52 3.92 0.00 2.86 3.18 0.00 0.00 6.60 7.19 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 0.00 130 K 8.29 4.43 0.00 1.85 1.86 0.00 1.59 0.00 0.00 1.70 0.00 0.00 3.16 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.57 1.57 7.81 131 G 7.75 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 0.00 0.00 0.00 132 T 8.34 3.94 4.23 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 1.17 0.00 0.00 133 A 8.06 4.00 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 0.00 134 V 7.84 3.61 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 0.81 0.00 0.00 1.01 0.00 0.00 135 K 7.35 3.85 0.00 1.87 1.98 0.00 1.65 0.00 0.00 1.59 0.00 0.00 3.38 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.39 1.40 7.81 136 K 7.87 3.62 0.00 1.39 1.12 0.00 1.14 0.00 0.00 1.12 0.00 0.00 2.64 0.00 0.00 2.49 0.00 0.00 0.00 0.00 0.30 0.21 7.81 137 R 7.45 3.89 0.00 1.99 2.22 0.00 3.17 0.00 0.00 3.40 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.88 0.00 138 E 8.10 4.54 0.00 2.01 1.92 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 2.59 2.46 0.00 139 D 7.57 4.74 0.00 2.68 2.46 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 0.00 140 V 7.96 3.55 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 1.11 0.00 0.00 0.81 0.00 0.00 141 H 8.27 4.30 0.00 3.28 3.36 0.00 5.91 0.00 0.00 0.00 0.00 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 R 7.72 4.05 0.00 2.01 1.97 0.00 3.37 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 1.60 0.00 143 M 8.16 4.11 0.00 2.08 2.02 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.57 0.00 144 A 7.64 4.57 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 E 8.88 3.85 0.00 2.14 2.23 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 2.19 2.31 0.00 146 A 7.49 4.58 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 0.00 147 N 8.18 4.80 0.00 2.74 2.66 0.00 0.00 6.79 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 0.00 148 K 7.84 4.04 0.00 1.78 1.88 0.00 1.82 0.00 0.00 1.73 0.00 0.00 3.01 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.49 1.43 7.81 149 A 8.09 4.23 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 0.00 150 F 8.36 4.52 0.00 3.11 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 0.00 151 A 8.23 4.23 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