NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.5361 8.3049 120.3306 55.3014 32.1802 174.4635 2 L 4.5694 7.9860 118.5454 53.4793 44.1028 176.3714 3 R 4.2034 7.7813 118.0204 57.7312 31.9348 175.6402 4 P 4.5969 0.0000 0.0000 62.0281 33.8780 175.3533 5 K 4.1415 8.4463 113.9088 57.0387 32.2785 174.3126 6 A 3.6974 7.7357 125.8415 51.7683 19.1016 176.7822 7 L 3.9669 8.4094 122.0492 56.2200 41.9033 177.8961 8 T 4.3334 8.3354 112.5268 63.2125 70.4191 175.9137 9 Q 3.8831 8.2113 120.8499 60.0492 28.5946 178.8533 10 V 3.6792 7.5590 118.7928 65.4851 31.6925 178.0469 11 L 3.9866 7.8167 119.1599 57.1965 41.9908 178.1264 12 S 4.2892 7.6117 113.2127 60.5886 63.8353 175.5571 13 Q 3.8352 7.7623 119.8444 57.0131 29.5086 176.2218 14 A 3.8019 8.0014 119.1212 51.8037 16.3662 174.8322 15 N 5.1298 7.7421 122.9224 54.6482 45.7800 177.1467 16 T 4.0043 8.2800 106.8550 64.5093 69.9956 175.6436 17 G 3.7255 8.3462 108.2688 46.7990 0.0000 174.6635 18 G 4.0774 8.4312 107.3328 43.5396 0.0000 172.6547 19 V 4.3950 7.5123 118.9321 61.4998 35.1669 173.6969 20 Q 4.8038 8.4162 115.1930 56.0027 31.4639 175.7528 21 S 5.0634 7.9280 111.9472 56.5828 66.6719 172.4969 22 T 4.9944 8.6034 112.4913 59.8994 72.1665 172.3327 23 L 4.9359 9.2173 127.5838 53.1807 45.1462 174.6880 24 L 4.9469 8.6287 126.2466 52.8848 44.8339 175.3759 25 L 5.4664 8.4281 123.8191 52.6908 43.6972 175.9794 26 N 4.7764 8.6757 121.5264 52.1569 40.8529 174.7523 27 N 4.0819 9.1518 115.8770 53.8136 37.9934 173.9941 28 E 3.5259 8.3284 113.4009 54.4983 27.5158 174.2008 29 G 4.6178 7.6914 119.3462 46.7089 0.0000 171.1399 30 S 4.1169 7.2547 117.0415 57.8500 63.5773 172.3344 31 L 4.7967 8.4801 128.3926 53.3534 44.1229 175.2702 32 L 4.7694 8.8829 126.9305 52.9541 44.4410 175.8156 33 A 5.0477 8.4469 124.2620 50.3462 23.3151 174.6129 34 Y 4.3211 8.8653 119.4630 57.0260 41.2398 174.0248 35 S 4.9278 8.3013 121.2512 57.9663 65.5472 174.4634 36 G 3.9660 8.2740 105.6410 45.9605 0.0000 172.8459 37 Y 3.7457 8.7362 117.8190 56.1549 37.9196 168.8840 38 G 3.1954 6.5419 108.4705 44.6282 0.0000 173.5507 39 D 4.4080 7.7428 127.7282 53.7263 42.2774 177.2420 40 T 4.2546 7.8689 114.7886 64.0673 69.6268 174.8925 41 D 4.4426 7.9907 120.1478 53.2958 42.5026 176.3608 42 A 3.8915 8.1340 120.0965 52.9699 16.1336 178.9054 43 R 3.7555 8.1320 118.8952 58.8928 30.8564 176.8262 44 V 3.4853 7.2759 117.3035 65.1068 30.0783 174.1143 45 T 3.8673 8.2174 110.3460 64.9125 69.2865 175.4570 46 A 4.0516 7.8517 123.8315 54.5177 18.6347 179.0458 47 A 3.9686 7.9142 117.3485 55.2594 18.6378 179.5994 48 I 3.7456 8.4526 116.9316 63.5964 37.8283 178.0224 49 A 3.9500 7.7824 121.8313 55.2836 18.3268 179.4055 50 S 4.1149 8.0542 110.9089 61.7639 62.5163 176.0355 51 N 4.5046 8.2365 118.6005 55.8207 38.1417 177.4599 52 I 3.7116 7.9115 122.0420 64.1310 37.0328 178.1273 53 W 4.1825 7.8772 127.4522 60.7791 30.8750 177.5928 54 A 3.9061 8.0903 120.2285 54.6053 17.9576 179.0256 55 A 3.8801 8.1189 118.2634 55.7561 18.5809 179.3922 56 Y 3.8578 7.8665 117.1394 60.1589 38.2039 177.2498 57 D 4.3141 7.7514 120.8993 56.6327 40.9784 178.5170 58 R 3.7729 7.4774 116.0407 59.0751 30.5691 177.9283 59 N 4.4220 7.8827 115.6814 56.2743 39.0724 175.2427 60 G 2.4195 7.7254 108.5349 44.7196 0.0000 172.8892 61 N 4.2765 5.7700 109.7505 52.2330 43.1945 173.2120 62 Q 5.0112 8.7072 123.1744 53.4283 31.3936 174.4990 63 A 5.0793 7.6796 125.4102 50.6886 21.5454 174.2054 64 F 4.6522 8.1638 113.6947 56.9616 44.8099 173.9113 65 N 5.0271 8.2981 127.1219 52.7856 40.6134 172.4688 66 E 4.8333 9.1514 124.8735 57.1522 37.4300 176.4047 67 D 4.4808 8.3001 115.3039 54.8286 39.7755 174.6708 68 S 4.7214 7.5139 107.7568 58.1726 65.1518 175.0274 69 L 4.4438 7.7820 118.1806 55.2655 43.5969 175.5599 70 K 4.5380 7.6968 118.7976 54.7704 30.2301 175.3144 71 F 4.7635 8.1143 122.5999 57.6259 40.6153 175.0777 72 I 3.4505 8.1197 126.9588 58.9888 40.5900 174.6407 73 L 4.5194 5.6200 123.7235 53.3441 45.5826 175.1187 74 M 4.7980 8.2201 120.3286 54.9314 36.3707 172.4609 75 D 5.1422 8.5694 120.5352 52.1222 42.6059 174.0779 76 C 4.5970 8.5707 116.4082 59.9792 33.8540 173.6213 77 M 4.4199 7.8236 115.7600 55.4195 35.5202 173.6324 78 E 3.5381 10.0588 122.8193 57.8521 26.5931 175.0514 79 G 4.0371 9.7960 110.6212 44.5811 0.0000 169.6309 80 R 4.8499 8.3310 116.4706 55.2402 35.5719 174.3212 81 V 4.9487 8.9814 119.3959 60.0966 34.5576 174.8583 82 A 4.5099 9.0975 125.4555 50.5913 20.6858 175.6960 83 I 4.6263 7.8936 123.5407 60.9261 39.9164 175.5954 84 T 4.8074 8.2339 118.8430 61.3445 71.2489 171.9821 85 R 4.8995 9.4072 130.9477 54.8539 31.7643 175.5573 86 V 4.4621 8.9651 125.2984 61.2954 34.5774 174.3505 87 A 3.8666 10.1894 124.4694 53.6091 16.4295 177.3256 88 N 4.1635 8.3325 114.0357 55.1720 38.7061 172.9229 89 L 4.7623 8.1296 118.5674 53.2026 45.6925 174.6641 90 L 5.1197 8.4664 127.5715 53.2606 44.7281 174.4443 91 L 4.9364 8.9273 128.3496 53.4902 44.2447 174.5121 92 C 5.8552 9.1976 126.6382 57.2083 35.2360 172.3007 93 M 4.9970 8.2048 119.1358 54.4186 34.3685 172.6022 94 Y 5.2381 8.6918 122.8131 56.9451 40.2645 174.1797 95 A 4.6239 9.2941 127.5979 51.1376 23.0760 176.0047 96 K 4.2856 8.6499 118.4075 56.8622 34.5287 176.1773 97 E 4.5516 7.9558 117.6161 57.5457 31.6720 177.5317 98 T 3.9544 8.0439 114.0699 66.5817 68.9306 175.0937 99 V 4.0857 7.1310 121.2529 61.6998 30.2078 178.0152 100 G 4.1725 7.7083 115.1867 44.7868 0.0000 169.7221 101 F 4.6472 8.0821 120.2088 58.6761 43.9981 176.3451 102 G 3.7464 8.1255 108.0903 48.3197 0.0000 175.1084 103 M 3.8357 8.0553 120.1162 58.1151 31.9261 177.9585 104 L 3.8688 7.6901 119.7764 58.0664 42.1160 178.2563 105 K 3.2629 7.3087 118.2968 59.5380 31.9053 178.8569 106 A 3.9713 7.6814 120.2117 55.0992 18.3208 179.4082 107 K 3.7412 7.8244 118.0273 59.3715 31.9491 178.9709 108 A 3.9390 7.8276 120.4657 55.2074 18.8388 178.7332 109 Q 4.0741 7.8544 117.4978 59.6096 28.8311 178.9234 110 A 4.1930 8.1435 121.4764 55.0987 17.3596 179.0403 111 L 3.5571 8.1663 119.2865 58.3932 41.6733 179.5929 112 V 3.7210 7.3985 116.7183 65.6318 31.7453 176.8061 113 Q 4.1761 8.0194 117.6094 58.7746 29.2739 176.2611 114 Y 3.8575 9.0934 116.2769 60.5847 37.5893 176.8972 115 L 3.7372 6.8061 115.2854 57.5192 42.7959 180.9890 116 E 4.6098 7.6926 127.3824 55.6368 32.1853 175.6372 117 E 4.6449 8.4383 110.8378 54.5749 29.6066 172.0776 118 P 4.9249 0.0000 0.0000 61.8090 34.4040 174.2491 119 L 3.8937 8.5051 120.1525 56.6907 40.2618 176.9532 120 T 4.0061 7.7964 107.4862 64.7556 68.5308 173.9901 121 Q 4.1598 7.7284 121.0137 57.1488 29.1699 176.8505 122 V 3.3012 8.4935 123.8034 61.8442 30.5521 172.4740 123 A 4.1906 8.1884 123.9619 52.2805 25.0392 174.7992 124 A 3.5901 7.9773 121.8055 51.9988 16.0695 177.3342 125 S 4.3222 8.4202 113.6976 59.3331 63.1825 174.7741 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 4.54 0.00 2.01 2.12 0.00 0.00 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.65 0.00 2 L 7.99 4.57 0.00 1.67 1.64 0.93 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 3 R 7.78 4.20 0.00 1.75 1.85 0.00 3.26 0.00 0.00 3.22 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.47 0.00 4 P 0.00 4.60 0.00 2.17 2.07 0.00 3.75 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.94 0.00 5 K 8.45 4.14 0.00 1.86 1.91 0.00 1.62 0.00 0.00 1.70 0.00 0.00 3.07 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.39 1.49 7.81 6 A 7.74 3.70 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 7 L 8.41 3.97 0.00 1.61 1.48 0.94 1.01 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 8 T 8.34 4.33 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 9 Q 8.21 3.88 0.00 2.07 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.08 6.93 0.00 0.00 0.00 0.00 0.00 2.45 2.37 0.00 10 V 7.56 3.68 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 1.05 0.00 0.00 0.93 0.00 0.00 11 L 7.82 3.99 0.00 1.85 1.67 0.96 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 12 S 7.61 4.29 0.00 3.96 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 13 Q 7.76 3.84 0.00 2.05 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.51 0.00 0.00 0.00 0.00 0.00 2.31 2.52 0.00 14 A 8.00 3.80 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 15 N 7.74 5.13 0.00 2.79 2.77 0.00 0.00 7.44 7.54 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 16 T 8.28 4.00 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 1.19 0.00 0.00 17 G 8.35 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 0.00 0.00 0.00 18 G 8.43 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 19 V 7.51 4.40 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 1.15 0.00 0.00 0.90 0.00 0.00 20 Q 8.42 4.80 0.00 1.34 1.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.12 6.49 0.00 0.00 0.00 0.00 0.00 2.14 2.03 0.00 21 S 7.93 5.06 0.00 4.02 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 22 T 8.60 4.99 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 1.22 0.00 0.00 23 L 9.22 4.94 0.00 1.71 1.52 0.86 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 24 L 8.63 4.95 0.00 1.61 1.52 0.99 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 25 L 8.43 5.47 0.00 1.51 1.59 0.87 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 26 N 8.68 4.78 0.00 2.68 2.69 0.00 0.00 6.76 6.90 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 27 N 9.15 4.08 0.00 2.77 2.78 0.00 0.00 7.04 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 28 E 8.33 3.53 0.00 1.92 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.88 0.00 29 G 7.69 4.62 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 S 7.25 4.12 0.00 3.89 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 L 8.48 4.80 0.00 1.57 1.46 0.84 0.85 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 32 L 8.88 4.77 0.00 1.62 1.51 0.89 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 33 A 8.45 5.05 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 Y 8.87 4.32 0.00 3.05 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 S 8.30 4.93 0.00 4.10 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 36 G 8.27 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 0.00 0.00 0.00 37 Y 8.74 3.75 0.00 2.99 3.06 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 38 G 6.54 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 0.00 0.00 0.00 39 D 7.74 4.41 0.00 2.79 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 40 T 7.87 4.25 4.39 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 1.33 0.00 0.00 41 D 7.99 4.44 0.00 2.46 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 42 A 8.13 3.89 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 43 R 8.13 3.76 0.00 1.80 1.99 0.00 3.15 0.00 0.00 3.08 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.43 0.00 44 V 7.28 3.49 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 0.89 0.00 0.00 0.95 0.00 0.00 45 T 8.22 3.87 4.07 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 0.00 0.00 0.00 1.22 0.00 0.00 46 A 7.85 4.05 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 47 A 7.91 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 48 I 8.45 3.75 2.04 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 1.45 1.58 1.00 0.00 0.00 49 A 7.78 3.95 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 S 8.05 4.11 0.00 3.92 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 51 N 8.24 4.50 0.00 3.09 2.87 0.00 0.00 7.03 6.89 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 52 I 7.91 3.71 2.12 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 1.37 1.50 0.95 0.00 0.00 53 W 7.88 4.18 0.00 3.31 3.14 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 54 A 8.09 3.91 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 55 A 8.12 3.88 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 56 Y 7.87 3.86 0.00 3.02 3.06 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 57 D 7.75 4.31 0.00 2.65 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 0.00 0.00 0.00 58 R 7.48 3.77 0.00 1.69 1.87 0.00 3.25 0.00 0.00 3.02 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.66 0.00 59 N 7.88 4.42 0.00 2.73 2.74 0.00 0.00 7.23 7.80 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 60 G 7.73 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 0.00 0.00 0.00 61 N 5.77 4.28 0.00 2.63 2.57 0.00 0.00 6.90 6.64 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 62 Q 8.71 5.01 0.00 1.80 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.30 0.00 0.00 0.00 0.00 0.00 1.55 1.81 0.00 63 A 7.68 5.08 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 64 F 8.16 4.65 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 65 N 8.30 5.03 0.00 2.75 2.78 0.00 0.00 6.81 7.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 E 9.15 4.83 0.00 2.13 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 2.37 2.34 0.00 67 D 8.30 4.48 0.00 2.91 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 68 S 7.51 4.72 0.00 3.93 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 69 L 7.78 4.44 0.00 1.60 1.64 0.97 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 70 K 7.70 4.54 0.00 2.06 2.01 0.00 1.85 0.00 0.00 1.74 0.00 0.00 3.25 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.85 1.58 7.81 71 F 8.11 4.76 0.00 2.98 3.05 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 72 I 8.12 3.45 1.59 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.45 0.39 0.00 0.00 73 L 5.62 4.52 0.00 0.78 1.14 -0.14 -0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 74 M 8.22 4.80 0.00 1.98 1.79 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.67 0.00 75 D 8.57 5.14 0.00 2.66 2.62 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 0.00 0.00 0.00 0.00 76 C 8.57 4.60 0.00 2.77 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 77 M 7.82 4.42 0.00 1.94 1.82 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 2.48 2.46 0.00 78 E 10.06 3.54 0.00 2.11 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.30 0.00 79 G 9.80 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 80 R 8.33 4.85 0.00 1.76 2.00 0.00 3.15 0.00 0.00 3.29 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.66 0.00 81 V 8.98 4.95 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 0.69 0.00 0.00 0.95 0.00 0.00 82 A 9.10 4.51 1.20 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 0.00 0.00 83 I 7.89 4.63 1.58 0.00 0.00 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.43 0.88 0.00 0.00 84 T 8.23 4.81 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 1.31 0.00 0.00 85 R 9.41 4.90 0.00 2.02 1.86 0.00 2.63 0.00 0.00 2.88 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.43 0.00 86 V 8.97 4.46 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 0.86 0.00 0.00 1.02 0.00 0.00 87 A 10.19 3.87 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 88 N 8.33 4.16 0.00 2.96 2.87 0.00 0.00 6.69 8.69 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 89 L 8.13 4.76 0.00 1.70 1.54 0.99 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 90 L 8.47 5.12 0.00 1.68 1.40 0.92 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 91 L 8.93 4.94 0.00 1.72 1.51 0.94 0.57 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 92 C 9.20 5.86 0.00 2.95 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 93 M 8.20 5.00 0.00 2.10 2.11 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.71 0.00 94 Y 8.69 5.24 0.00 3.08 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 95 A 9.29 4.62 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 96 K 8.65 4.29 0.00 1.68 1.78 0.00 1.75 0.00 0.00 1.64 0.00 0.00 2.74 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.33 1.42 7.81 97 E 7.96 4.55 0.00 1.97 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 2.28 2.24 0.00 98 T 8.04 3.95 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 1.22 0.00 0.00 99 V 7.13 4.09 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 0.85 0.00 0.00 0.98 0.00 0.00 100 G 7.71 4.17 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 0.00 101 F 8.08 4.65 0.00 3.06 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 0.00 102 G 8.13 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 0.00 0.00 0.00 103 M 8.06 3.84 0.00 2.06 2.06 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 2.63 2.55 0.00 104 L 7.69 3.87 0.00 1.64 1.16 1.02 0.90 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 0.00 105 K 7.31 3.26 0.00 1.66 1.59 0.00 1.74 0.00 0.00 1.70 0.00 0.00 2.88 0.00 0.00 2.97 0.00 0.00 0.00 0.00 0.30 1.10 7.81 106 A 7.68 3.97 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 0.00 107 K 7.82 3.74 0.00 1.99 1.79 0.00 1.57 0.00 0.00 1.60 0.00 0.00 2.93 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.37 1.35 7.81 108 A 7.83 3.94 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 0.00 109 Q 7.85 4.07 0.00 2.11 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.80 0.00 0.00 0.00 0.00 0.00 2.40 2.52 0.00 110 A 8.14 4.19 0.97 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 0.00 0.00 111 L 8.17 3.56 0.00 1.92 1.77 0.93 0.83 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 0.00 112 V 7.40 3.72 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 0.97 0.00 0.00 1.01 0.00 0.00 113 Q 8.02 4.18 0.00 2.13 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.65 0.00 0.00 0.00 0.00 0.00 2.30 2.33 0.00 114 Y 9.09 3.86 0.00 2.95 3.05 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 0.00 115 L 6.81 3.74 0.00 1.92 1.64 0.99 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 116 E 7.69 4.61 0.00 1.93 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 2.22 2.28 0.00 117 E 8.44 4.64 0.00 1.88 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.24 0.00 118 P 0.00 4.92 0.00 2.19 2.04 0.00 4.02 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.95 0.00 119 L 8.51 3.89 0.00 1.87 1.82 0.96 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 0.00 0.00 0.00 0.00 0.00 0.00 120 T 7.80 4.01 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 121 Q 7.73 4.16 0.00 2.09 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.62 0.00 0.00 0.00 0.00 0.00 2.39 2.29 0.00 122 V 8.49 3.30 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 0.66 0.00 0.00 0.93 0.00 0.00 123 A 8.19 4.19 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 0.00 124 A 7.98 3.59 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 0.00 125 S 8.42 4.32 0.00 4.02 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