NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3417 8.3049 118.1811 54.7532 32.5698 174.1541 2 E 3.9393 8.6073 119.6240 55.7240 29.7157 176.0127 3 H 4.6568 8.6970 122.4166 54.0889 28.6866 172.9595 4 V 4.3157 7.8758 121.3990 60.5398 34.3936 174.7769 5 A 4.4927 8.4022 129.9747 50.7068 19.7857 176.1333 6 F 3.2162 8.4884 124.8954 59.1766 39.7926 175.2427 7 G 3.5041 7.5843 114.8517 45.8477 0.0000 173.6405 8 S 4.1356 7.2391 114.9647 58.0114 63.3692 174.3385 9 E 4.0602 8.8474 124.9335 58.9274 29.7937 177.6949 10 D 5.0074 7.6247 118.1547 53.8645 41.8541 178.2643 11 I 3.6327 7.7059 121.1688 63.8443 37.8313 176.1486 12 E 4.0878 8.0610 117.4823 59.0924 29.7926 178.4269 13 N 4.5365 8.0609 117.3103 56.4071 38.6606 177.3813 14 T 3.8843 7.6908 116.6639 66.5501 68.4873 176.2368 15 L 4.2794 7.9059 118.1782 55.5336 41.3572 178.5321 16 A 4.3812 7.7060 122.6459 53.7971 18.6444 178.5661 17 K 4.3545 7.6994 113.1831 57.0271 33.4088 176.3321 18 M 4.6947 7.3501 118.8876 53.8071 32.8507 176.6254 19 D 4.7695 8.4593 124.0524 53.1254 43.0657 176.7474 20 D 4.5654 8.8137 120.3606 57.1529 38.6479 179.2137 21 G 3.6475 7.9863 105.4139 47.6728 0.0000 175.2780 22 Q 4.1363 7.9237 120.0893 58.6338 28.8949 178.3358 23 L 3.9576 8.0917 120.0294 57.9970 41.4778 178.7486 24 D 4.7769 7.7452 114.8413 55.3412 40.8726 176.9192 25 G 3.9802 8.0795 109.0696 45.0384 0.0000 173.5383 26 L 4.1907 7.2267 118.8490 53.5417 42.2846 177.2046 27 A 4.1804 7.9463 123.4508 53.5645 18.7971 177.0999 28 F 5.0944 6.5992 109.4119 54.4241 41.7499 174.8460 29 G 4.3124 9.5330 107.1851 46.0102 0.0000 172.6786 30 A 5.5608 9.3698 124.8516 50.3008 22.7832 174.9653 31 I 4.8823 9.0060 123.5837 59.4258 40.9531 174.3066 32 Q 4.5344 8.7474 127.6835 54.2151 30.9707 174.2194 33 L 5.2697 8.8981 126.4463 52.9124 45.4435 176.0797 34 D 5.0877 8.1082 121.8522 51.5832 41.3425 177.4635 35 G 3.8474 8.9916 106.7556 48.1057 0.0000 174.0481 36 D 4.7059 8.5126 117.7681 54.4302 41.7118 177.2122 37 G 4.1834 8.8615 108.5330 45.4561 0.0000 173.0470 38 N 4.9303 9.1882 117.9032 52.7272 39.3139 174.3544 39 I 4.3332 8.4776 123.6828 61.4259 37.6141 176.3568 40 L 4.4628 9.0343 127.4476 55.5978 43.8845 177.0372 41 Q 4.6941 7.6919 115.3550 54.6385 33.6949 174.3918 42 Y 4.8904 8.4661 122.4401 57.2192 41.0758 173.7338 43 N 4.9965 8.6638 125.1881 51.6982 39.7862 176.2567 44 A 4.0068 9.4067 121.1044 55.5374 18.2160 179.8296 45 A 3.9507 7.9737 118.5862 55.3108 18.5214 179.4124 46 Q 4.0096 8.3513 117.7338 59.3761 29.1363 178.6887 47 G 3.8791 8.1136 106.4493 47.8973 0.0000 175.4388 48 D 4.4751 8.0706 120.4970 57.1510 40.8435 178.4722 49 I 4.0377 7.4753 119.9710 63.7029 37.4206 177.5174 50 T 4.5571 8.1897 108.0720 61.2215 69.7319 175.8668 51 G 4.0439 8.2693 109.8135 45.4116 0.0000 174.2557 52 R 3.9532 7.4596 118.6772 55.9727 30.6761 175.9360 53 D 4.5702 8.5006 121.5403 52.9913 41.4167 174.7038 54 P 4.1298 0.0000 0.0000 66.0677 30.8862 178.6626 55 K 3.9691 7.9384 116.3511 59.4889 31.6792 179.2796 56 Q 3.7471 8.1167 117.5625 57.8728 29.1301 177.8183 57 V 4.0399 7.1974 112.2797 60.5206 32.1880 175.9310 58 I 3.9862 6.5668 120.6259 62.3412 37.2963 175.3753 59 G 4.0665 8.9442 114.1431 45.6881 0.0000 174.2440 60 K 4.1950 7.7445 118.3138 55.6503 33.0891 175.2586 61 N 5.0368 8.7591 119.4415 52.3340 39.7098 175.3828 62 F 3.9483 8.8710 128.7693 61.3709 39.4800 177.2091 63 F 3.8164 7.6755 116.8906 59.3321 39.1855 176.8013 64 K 4.0635 8.0461 120.7452 58.6413 32.5247 177.0773 65 D 4.5370 7.9851 116.4001 56.1623 41.7637 178.1478 66 V 3.7608 7.5656 116.1594 64.5956 32.5469 175.9640 67 A 4.3060 7.7004 121.6299 49.3306 18.4081 174.7232 68 P 4.1808 0.0000 0.0000 64.3171 31.9844 179.2123 69 C 4.2508 7.5602 113.1088 60.2823 30.0842 174.1828 70 T 4.0792 7.5137 110.1793 61.9558 68.7627 174.1964 71 D 5.0407 7.5456 123.1221 52.9467 39.7172 174.5835 72 S 4.7047 8.0609 115.9302 56.1438 65.2902 174.1298 73 P 4.2281 0.0000 0.0000 65.7507 31.2374 178.5766 74 E 3.9643 8.2783 116.1116 58.0451 29.2673 175.6326 75 F 4.4842 7.4370 118.1155 58.9621 42.6869 175.8239 76 Y 4.3510 9.0309 120.7011 60.7538 38.8858 179.0366 77 G 3.5821 8.3427 108.2034 47.2197 0.0000 175.8516 78 K 3.9861 7.9558 120.5896 58.7940 32.0043 179.0547 79 F 4.1381 8.3124 121.2896 61.2605 39.4332 177.2079 80 K 3.4893 8.1864 118.7028 59.8648 32.0099 178.6067 81 E 3.8581 7.9095 119.9457 58.8410 29.5695 178.9300 82 G 3.8144 7.7385 105.7481 46.9056 0.0000 175.6281 83 V 3.7665 7.1685 121.0301 64.9777 31.4907 177.7371 84 A 4.0485 7.6026 119.0459 54.8844 18.2458 179.1940 85 S 4.3701 8.2378 112.9650 58.8943 63.1676 175.6576 86 G 4.0422 9.5269 109.4154 45.2905 0.0000 172.7919 87 N 5.0735 7.6582 115.5708 51.1826 40.3753 173.1082 88 L 4.7334 8.4280 121.8939 54.2912 45.8524 173.6537 89 N 5.3382 8.8092 125.4568 53.6202 40.4279 172.8400 90 T 4.8622 9.1210 120.3891 60.8343 71.6515 171.9467 91 M 5.4336 8.6565 126.4447 53.9541 35.1296 173.9328 92 F 5.0716 8.9293 119.9032 56.1102 41.8577 172.9621 93 E 5.1218 8.9259 119.0193 56.0152 31.2874 174.6822 94 Y 4.9935 8.7951 121.6848 57.2663 43.2646 173.1232 95 T 5.0691 7.9166 119.0906 61.7799 71.1485 173.6959 96 F 5.1527 9.3331 126.6147 56.2490 40.3917 176.2997 97 D 4.8878 8.6785 121.6684 53.1840 40.3682 174.3226 98 Y 4.4196 8.2492 121.2153 57.9896 38.5014 174.5518 99 Q 3.4151 8.7466 126.1463 56.3433 26.1990 173.0979 100 M 4.7441 7.5253 112.4291 54.1248 33.9038 174.1781 101 T 3.9686 8.2689 116.7017 62.7009 69.1054 172.6086 102 P 4.5236 0.0000 0.0000 63.8349 32.0971 175.6782 103 T 4.5866 9.0557 121.8467 61.4124 71.2334 173.2661 104 K 4.6852 8.5806 128.1414 56.0505 33.7856 175.8509 105 V 4.5325 8.5824 119.4112 59.4844 36.8074 174.0092 106 K 4.8205 8.9053 124.7568 55.1271 33.8930 175.1942 107 V 4.9422 9.0351 128.1689 61.2893 34.2732 173.5187 108 H 5.3458 9.6480 127.7363 54.7810 32.5138 171.8866 109 M 5.1118 9.0709 126.2261 53.7134 34.3478 175.2010 110 K 5.2121 8.9365 123.5759 54.6825 36.3741 174.9327 111 K 4.4458 8.9554 128.8421 56.8054 32.7481 176.3697 112 A 4.5892 8.2174 129.0309 51.5134 19.0908 177.7800 113 L 3.9631 8.7836 120.5779 58.0665 42.2052 177.2496 114 S 4.4881 7.8164 112.2099 57.0475 64.4730 173.9416 115 G 3.6699 7.9249 109.8782 46.5943 0.0000 173.9428 116 D 4.7823 8.1820 117.3186 53.9529 39.8890 176.8810 117 S 5.0067 7.3165 114.7216 56.8525 67.0758 174.2695 118 Y 4.9177 9.0185 118.2182 56.2408 42.4254 174.3350 119 W 4.9850 9.1721 123.0630 55.3525 31.7302 175.6796 120 V 4.5609 8.4211 122.7671 61.3136 33.8559 174.0544 121 F 5.7826 9.2398 127.3920 55.9049 42.0288 175.1170 122 V 5.2905 9.2942 122.0173 61.3401 35.1336 174.0840 123 K 4.8957 8.5574 125.1540 54.9970 36.2581 175.9355 124 R 4.4279 8.4839 120.1983 56.3333 31.0901 177.2621 125 V 3.9317 7.7007 113.2371 61.6521 32.2990 175.7456 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 4.34 0.00 2.06 2.24 0.00 0.00 0.00 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.29 0.00 2 E 8.61 3.94 0.00 1.97 1.84 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 2.25 2.54 0.00 3 H 8.70 4.66 0.00 3.12 3.26 0.00 5.84 0.00 0.00 0.00 0.00 6.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 V 7.88 4.32 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 0.85 0.00 0.00 0.89 0.00 0.00 5 A 8.40 4.49 1.25 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 6 F 8.49 3.22 0.00 2.37 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 7 G 7.58 3.50 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 S 7.24 4.14 0.00 3.81 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 E 8.85 4.06 0.00 1.87 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 2.39 0.00 10 D 7.62 5.01 0.00 2.69 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 I 7.71 3.63 1.72 0.00 0.00 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.01 0.80 0.00 0.00 12 E 8.06 4.09 0.00 2.36 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 2.33 2.42 0.00 13 N 8.06 4.54 0.00 2.96 2.91 0.00 0.00 7.18 7.05 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 14 T 7.69 3.88 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 1.18 0.00 0.00 15 L 7.91 4.28 0.00 1.54 1.34 0.74 0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 16 A 7.71 4.38 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 17 K 7.70 4.35 0.00 1.85 1.95 0.00 1.60 0.00 0.00 1.71 0.00 0.00 2.96 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.60 1.40 7.81 18 M 7.35 4.69 0.00 2.09 2.09 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.45 0.00 19 D 8.46 4.77 0.00 2.74 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 20 D 8.81 4.57 0.00 2.93 3.15 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 21 G 7.99 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 0.00 0.00 0.00 22 Q 7.92 4.14 0.00 2.30 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.79 0.00 0.00 0.00 0.00 0.00 2.63 2.44 0.00 23 L 8.09 3.96 0.00 1.93 1.78 1.22 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 24 D 7.75 4.78 0.00 2.90 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 25 G 8.08 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 L 7.23 4.19 0.00 1.35 0.53 0.62 0.52 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 27 A 7.95 4.18 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 28 F 6.60 5.09 0.00 3.29 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 29 G 9.53 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 9.37 5.56 1.47 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 0.00 0.00 0.00 0.00 0.00 0.00 31 I 9.01 4.88 1.57 0.00 0.00 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.64 0.49 0.74 0.00 0.00 32 Q 8.75 4.53 0.00 1.37 1.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.72 0.00 0.00 0.00 0.00 0.00 1.78 1.16 0.00 33 L 8.90 5.27 0.00 1.61 1.53 0.26 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 34 D 8.11 5.09 0.00 2.88 2.85 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 35 G 8.99 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 D 8.51 4.71 0.00 2.88 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 37 G 8.86 4.18 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 0.00 38 N 9.19 4.93 0.00 3.01 2.75 0.00 0.00 7.05 7.94 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 39 I 8.48 4.33 2.01 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.89 1.01 0.00 0.00 40 L 9.03 4.46 0.00 1.42 1.63 0.82 0.83 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 41 Q 7.69 4.69 0.00 1.95 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.77 0.00 0.00 0.00 0.00 0.00 2.31 2.30 0.00 42 Y 8.47 4.89 0.00 2.93 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 43 N 8.66 5.00 0.00 3.00 2.98 0.00 0.00 6.49 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 44 A 9.41 4.01 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 45 A 7.97 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 46 Q 8.35 4.01 0.00 2.08 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.84 0.00 0.00 0.00 0.00 0.00 1.44 2.06 0.00 47 G 8.11 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 48 D 8.07 4.48 0.00 2.88 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 49 I 7.48 4.04 2.11 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.64 1.02 0.00 0.00 50 T 8.19 4.56 4.42 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 1.50 0.00 0.00 51 G 8.27 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 52 R 7.46 3.95 0.00 1.84 1.71 0.00 3.24 0.00 0.00 3.24 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.55 0.00 53 D 8.50 4.57 0.00 2.70 2.53 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 54 P 0.00 4.13 0.00 2.27 2.57 0.00 3.70 0.00 0.00 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.45 0.00 55 K 7.94 3.97 0.00 1.98 1.85 0.00 1.57 0.00 0.00 1.66 0.00 0.00 3.09 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.46 1.53 7.81 56 Q 8.12 3.75 0.00 2.07 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.77 0.00 0.00 0.00 0.00 0.00 2.36 2.54 0.00 57 V 7.20 4.04 1.73 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 0.68 0.00 0.00 0.12 0.00 0.00 58 I 6.57 3.99 1.85 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.75 0.99 0.00 0.00 59 G 8.94 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 0.00 0.00 0.00 0.00 60 K 7.74 4.19 0.00 1.94 1.69 0.00 1.60 0.00 0.00 1.53 0.00 0.00 2.89 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.42 1.32 7.81 61 N 8.76 5.04 0.00 2.74 2.66 0.00 0.00 7.22 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 62 F 8.87 3.95 0.00 2.71 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 0.00 0.00 0.00 0.00 63 F 7.68 3.82 0.00 2.65 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 K 8.05 4.06 0.00 1.72 1.76 0.00 1.79 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.37 1.36 7.81 65 D 7.99 4.54 0.00 2.74 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 V 7.57 3.76 1.90 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 0.74 0.00 0.00 0.90 0.00 0.00 67 A 7.70 4.31 0.02 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 0.00 0.00 68 P 0.00 4.18 0.00 1.83 1.95 0.00 3.01 0.00 0.00 3.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.66 0.82 0.00 69 C 7.56 4.25 0.00 3.20 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 70 T 7.51 4.08 2.80 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 0.08 0.00 0.00 71 D 7.55 5.04 0.00 2.58 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 72 S 8.06 4.70 0.00 4.03 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 73 P 0.00 4.23 0.00 2.22 2.08 0.00 3.71 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.12 0.00 74 E 8.28 3.96 0.00 2.24 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 0.00 2.41 2.40 0.00 75 F 7.44 4.48 0.00 2.73 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 76 Y 9.03 4.35 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 77 G 8.34 3.58 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 0.00 0.00 0.00 78 K 7.96 3.99 0.00 1.93 1.84 0.00 1.21 0.00 0.00 1.49 0.00 0.00 2.67 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.42 1.52 7.81 79 F 8.31 4.14 0.00 3.30 3.28 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 80 K 8.19 3.49 0.00 1.72 1.64 0.00 1.13 0.00 0.00 1.27 0.00 0.00 2.76 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.07 1.43 7.81 81 E 7.91 3.86 0.00 2.08 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.40 0.00 82 G 7.74 3.81 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 0.00 0.00 0.00 83 V 7.17 3.77 1.52 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 0.74 0.00 0.00 -0.59 0.00 0.00 84 A 7.60 4.05 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 85 S 8.24 4.37 0.00 3.94 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 86 G 9.53 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 87 N 7.66 5.07 0.00 2.95 2.90 0.00 0.00 5.58 6.67 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 88 L 8.43 4.73 0.00 1.82 1.70 0.96 0.55 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 89 N 8.81 5.34 0.00 2.79 2.74 0.00 0.00 6.89 7.70 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 90 T 9.12 4.86 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 91 M 8.66 5.43 0.00 2.02 1.81 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.57 0.00 92 F 8.93 5.07 0.00 3.12 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 93 E 8.93 5.12 0.00 1.99 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 2.40 2.35 0.00 94 Y 8.80 4.99 0.00 3.46 3.12 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 0.00 0.00 0.00 0.00 95 T 7.92 5.07 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 1.24 0.00 0.00 96 F 9.33 5.15 0.00 2.95 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 97 D 8.68 4.89 0.00 2.77 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 98 Y 8.25 4.42 0.00 2.80 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 99 Q 8.75 3.42 0.00 1.73 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.52 0.00 0.00 0.00 0.00 0.00 1.89 1.35 0.00 100 M 7.53 4.74 0.00 2.11 2.05 0.00 0.00 0.00 0.00 0.00 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.79 0.00 101 T 8.27 3.97 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 102 P 0.00 4.52 0.00 1.95 2.06 0.00 3.63 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.16 0.00 103 T 9.06 4.59 4.29 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 1.17 0.00 0.00 104 K 8.58 4.69 0.00 1.82 1.63 0.00 1.66 0.00 0.00 1.83 0.00 0.00 2.85 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.47 1.60 7.81 105 V 8.58 4.53 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.34 0.00 0.00 0.19 0.00 0.00 106 K 8.91 4.82 0.00 1.69 1.43 0.00 1.62 0.00 0.00 1.65 0.00 0.00 2.76 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.56 1.41 7.81 107 V 9.04 4.94 0.99 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 0.64 0.00 0.00 1.09 0.00 0.00 108 H 9.65 5.35 0.00 2.96 2.90 0.00 5.63 0.00 0.00 0.00 0.00 6.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 M 9.07 5.11 0.00 2.12 2.07 0.00 0.00 0.00 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.48 0.00 110 K 8.94 5.21 0.00 1.80 1.74 0.00 1.75 0.00 0.00 1.67 0.00 0.00 2.98 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.49 1.66 7.81 111 K 8.96 4.45 0.00 2.05 1.79 0.00 2.02 0.00 0.00 1.68 0.00 0.00 2.52 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.33 0.87 7.81 112 A 8.22 4.59 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 L 8.78 3.96 0.00 1.71 1.75 0.95 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 114 S 7.82 4.49 0.00 3.89 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 0.00 115 G 7.92 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 0.00 116 D 8.18 4.78 0.00 2.80 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 S 7.32 5.01 0.00 3.74 3.70 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 0.00 118 Y 9.02 4.92 0.00 3.15 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 W 9.17 4.98 0.00 3.00 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 0.00 0.00 0.00 120 V 8.42 4.56 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 1.16 0.00 0.00 0.77 0.00 0.00 121 F 9.24 5.78 0.00 2.80 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 0.00 122 V 9.29 5.29 2.50 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 1.15 0.00 0.00 1.26 0.00 0.00 123 K 8.56 4.90 0.00 1.61 1.37 0.00 1.01 0.00 0.00 0.83 0.00 0.00 2.13 0.00 0.00 2.48 0.00 0.00 0.00 0.00 0.30 0.97 7.81 124 R 8.48 4.43 0.00 1.66 1.85 0.00 3.12 0.00 0.00 3.20 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.63 0.00 125 V 7.70 3.93 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 0.57 0.00 0.00 0.89 0.00 0.00