NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 N 5.1721 8.1832 117.6082 52.7460 38.7174 174.2942 2 L 4.3080 8.2579 116.3937 55.9666 41.4090 174.2709 3 V 3.6201 8.9879 119.8743 65.9601 32.2298 176.8656 4 N 4.6106 8.4269 115.7449 56.7021 38.5447 176.6092 5 F 4.4985 8.2395 121.2148 62.1414 39.4954 176.6762 6 H 4.2017 8.2041 117.1018 58.6295 29.5638 177.2532 7 R 4.2675 8.6493 120.3193 58.8102 29.8406 178.6640 8 M 4.0318 8.0464 118.4627 58.5726 32.0301 178.6048 9 I 3.7923 7.5901 118.9658 63.6224 37.1724 178.6975 10 K 4.0778 7.6075 118.7256 59.5457 31.6987 179.2841 11 L 4.0866 7.6679 117.9334 57.3207 41.5309 178.7708 12 T 4.3575 7.6018 108.6821 62.8031 69.7904 176.0892 13 T 4.4068 7.8552 110.4857 60.8395 70.3322 175.7518 14 G 3.8902 8.1327 108.0625 44.9652 0.0000 173.4323 15 K 4.0801 7.7136 118.9339 55.2019 33.2770 176.6356 16 E 4.1328 8.2844 121.4331 54.9158 28.9224 176.8493 17 A 4.1322 8.2639 130.5894 54.8491 19.0187 179.4287 18 A 3.9437 8.1853 118.9901 54.6785 18.6142 178.6576 19 L 4.6533 7.7950 114.5648 55.4507 43.5037 176.9638 20 S 4.2711 7.9815 112.2991 60.0195 62.8291 174.1476 21 Y 4.5016 8.0360 117.3511 58.6293 39.3447 177.9400 22 G 3.6471 7.9698 107.9817 47.0022 0.0000 174.2368 23 F 5.1337 7.8166 114.2769 56.7603 40.5218 174.6609 24 Y 4.5986 7.4892 122.6819 57.9014 39.8836 176.9894 25 G 3.8863 7.5441 112.7742 47.4640 0.0000 174.9178 26 C 4.8953 9.0149 113.8549 57.7008 41.3553 174.6488 27 H 4.7335 8.6584 113.4808 55.6109 29.2752 173.6607 28 C 4.7073 7.8886 117.2313 56.2762 41.1019 172.1595 29 G 3.8745 9.3929 109.1096 44.2493 0.0000 173.4098 30 V 3.7158 8.4839 118.1455 62.6460 32.0998 178.0686 31 G 3.7081 8.7740 109.0340 47.7256 0.0000 172.5976 32 G 4.5232 7.6905 112.8863 45.5665 0.0000 170.9658 33 R 4.5302 7.5394 119.1739 54.8656 33.7330 176.3407 34 G 3.8836 8.4457 108.6322 46.8982 0.0000 172.2971 35 S 4.9299 8.2495 113.8597 56.3777 63.7741 171.8601 36 P 4.6450 0.0000 0.0000 62.3442 31.7981 175.8823 37 K 3.6645 8.3087 124.3045 58.8347 32.5020 176.1750 38 D 4.4941 7.3504 115.5437 51.8339 41.3738 174.6853 39 A 4.3087 8.6948 118.6552 54.8495 18.9269 179.8105 40 T 4.0744 7.9514 108.2987 64.7638 68.9960 176.2920 41 D 4.4779 8.0033 120.8979 57.3863 41.1907 178.4359 42 R 4.0141 8.1344 118.4588 59.2032 30.1026 178.4006 43 C 4.2873 8.5052 117.1277 59.9351 41.3062 175.4426 44 C 4.3484 8.2962 118.3757 60.1985 38.1172 176.5742 45 V 3.4415 7.7811 113.6397 64.3638 30.9682 178.8487 46 T 3.8301 7.6290 116.1311 66.7169 68.2044 176.2492 47 H 3.9491 8.0230 119.9465 59.1715 29.7189 177.1672 48 D 4.2384 8.2114 120.8504 57.4612 40.3221 178.0710 49 C 4.3109 8.7454 116.9986 59.3472 34.3074 175.4326 50 C 4.2182 8.1252 120.7907 59.8115 44.0660 175.0602 51 Y 4.0597 8.2225 118.7234 61.0039 37.2245 178.2927 52 K 3.8942 8.1504 119.8338 59.7091 32.2954 178.6091 53 R 4.0717 7.5703 114.3949 58.6675 29.6036 178.2741 54 L 4.1761 7.6730 121.6660 57.1717 42.8344 177.0090 55 E 4.5015 7.9542 122.1476 55.0852 28.0683 174.2972 56 K 4.5130 8.0901 130.5221 58.9292 39.5151 177.8500 57 R 3.9779 7.6728 114.7837 56.9745 29.5472 178.7480 58 G 4.1223 7.7235 105.3395 46.5569 0.0000 173.0622 59 C 4.5671 7.8461 116.0455 55.4547 41.2628 173.9223 60 G 3.8352 8.4331 112.5972 45.6920 0.0000 171.7396 61 T 3.9788 7.4346 109.7827 62.1690 71.9632 176.0999 62 K 3.7123 7.6342 120.6682 57.8851 32.4479 178.4615 63 F 5.0026 7.6404 113.1121 56.8441 39.8727 174.5669 64 L 4.4644 7.5783 124.5686 53.5941 42.4996 176.0444 65 S 4.5529 8.5160 121.2504 57.5460 64.2799 172.6019 66 Y 5.0029 7.0886 119.6999 55.2996 41.2749 174.1336 67 K 5.0010 9.6184 118.4095 54.9383 35.7629 175.8398 68 F 5.4770 8.4602 117.4026 56.1560 41.3276 172.5616 69 S 4.7375 9.3927 113.8370 57.2824 66.9151 172.0827 70 N 5.4801 8.4539 115.8721 52.0547 40.4354 173.9436 71 S 4.5380 8.9993 114.2978 57.3407 65.9298 174.1037 72 G 3.8593 8.4033 117.9113 47.1664 0.0000 175.8187 73 S 4.4308 8.7826 119.5007 58.3314 63.7938 173.7973 74 R 4.0451 8.2585 123.9646 56.7422 30.5039 175.1936 75 I 5.0526 8.3966 127.1007 60.0731 39.6650 175.2212 76 T 4.7618 9.2986 121.5144 62.0724 72.0540 172.5753 77 C 5.2414 8.7958 122.0475 55.8556 41.8917 173.4729 78 A 4.4603 8.9684 124.5251 51.3087 19.4345 177.2896 79 K 4.2037 8.4463 118.9784 56.0988 32.7254 176.9085 80 Q 4.5081 8.1670 121.7335 53.4922 32.9974 173.9072 81 D 4.6368 8.4528 119.0660 53.2540 41.2308 177.2656 82 S 4.0606 8.4669 114.5051 61.8567 62.7809 177.0580 83 C 4.1791 8.1241 119.9863 59.7421 36.0353 176.3118 84 R 3.8967 7.8991 119.2410 59.8127 29.6377 178.5943 85 S 4.0687 8.6177 115.4777 62.0141 62.7874 176.2859 86 Q 4.0956 8.7575 120.4117 58.0510 28.7078 178.2113 87 L 3.7514 8.0162 123.7925 58.2169 42.0887 177.7272 88 C 3.0841 7.4562 118.3261 59.4022 37.6513 175.4814 89 E 3.7252 7.9144 120.0483 59.4161 28.8104 178.6167 90 C 4.2429 8.1594 116.8173 60.0642 41.4029 175.8053 91 D 3.9650 7.8040 120.3246 56.5086 40.4677 178.6269 92 K 3.7359 8.1163 120.4814 59.5425 32.1618 178.6062 93 A 3.8695 7.7145 120.1771 54.9726 18.1515 179.3628 94 A 3.3354 7.3972 118.9664 55.2130 18.3336 179.8617 95 A 3.8804 7.9509 119.0670 55.2047 18.2615 180.1715 96 T 3.7891 7.7527 114.5634 67.0064 68.6652 176.3835 97 C 4.2354 8.2165 120.5728 59.6049 43.3543 175.6063 98 F 4.3238 8.1523 119.0422 60.4316 38.7265 177.1981 99 A 4.2023 7.8633 120.3453 55.0360 17.9607 179.9674 100 R 3.9501 8.0972 116.0994 59.1986 30.4159 178.0218 101 N 4.8668 8.0774 114.8573 53.3904 38.8676 177.1075 102 K 4.1076 8.0203 125.2066 59.6884 31.9320 178.8388 103 T 4.0381 7.9578 108.1577 64.2302 68.9839 175.1647 104 T 4.2805 7.8832 117.3139 64.1093 69.1075 174.5732 105 Y 3.9496 7.5570 122.9945 57.9088 39.2462 175.1742 106 N 4.6491 8.4003 124.5856 51.5655 41.4131 174.9781 107 K 3.8134 8.5608 126.3039 59.0790 32.6337 179.1085 108 K 3.6889 7.4634 119.7212 59.6827 32.0671 177.2633 109 Y 4.3408 7.1891 115.2252 59.5690 38.3905 177.2798 110 Q 3.8922 7.4001 121.3804 58.9480 28.9714 177.9230 111 Y 4.9344 7.5599 111.8564 57.6217 38.3619 174.5451 112 Y 4.0793 8.2152 122.3447 57.6506 38.7768 176.0648 113 S 3.9684 8.1459 122.7151 58.7348 62.4247 174.4209 114 N 4.6143 8.6029 123.6003 54.2048 38.7718 176.8322 115 K 3.9908 7.3919 117.6612 58.7654 32.1492 177.2141 116 H 4.8292 7.8191 114.9506 55.5431 28.8545 173.6725 117 C 4.7117 7.9486 118.2733 55.3669 36.2888 173.4297 118 R 4.1868 8.3566 126.3403 56.6895 30.9008 174.7894 119 G 4.1937 8.9753 109.9172 44.8074 0.0000 172.6863 120 S 4.4470 8.6763 116.3651 58.2350 62.6206 173.4744 121 T 5.0476 8.1819 122.5714 62.1445 68.4648 172.9535 122 P 4.1282 0.0000 0.0000 63.2780 31.9241 173.3678 123 R 3.7593 7.7465 125.5000 55.6918 31.0632 175.1562 124 C 4.5621 8.6225 116.0802 55.5246 42.8862 173.6077 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 N 8.18 5.17 0.00 3.19 3.23 0.00 0.00 6.15 5.79 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 2 L 8.26 4.31 0.00 1.91 1.90 0.88 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 3 V 8.99 3.62 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 0.86 0.00 0.00 0.98 0.00 0.00 4 N 8.43 4.61 0.00 2.90 2.97 0.00 0.00 6.68 8.13 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 5 F 8.24 4.50 0.00 3.39 3.25 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 6 H 8.20 4.20 0.00 3.18 3.57 0.00 5.63 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 R 8.65 4.27 0.00 2.14 2.13 0.00 3.43 0.00 0.00 3.26 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.99 0.00 8 M 8.05 4.03 0.00 1.99 2.13 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 2.26 0.00 9 I 7.59 3.79 1.69 0.00 0.00 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.07 0.81 0.00 0.00 10 K 7.61 4.08 0.00 2.01 1.86 0.00 1.70 0.00 0.00 1.82 0.00 0.00 2.93 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.42 1.63 7.81 11 L 7.67 4.09 0.00 1.82 1.78 1.07 1.62 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 12 T 7.60 4.36 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 1.27 0.00 0.00 13 T 7.86 4.41 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 1.26 0.00 0.00 14 G 8.13 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 0.00 0.00 0.00 15 K 7.71 4.08 0.00 1.70 1.48 0.00 1.12 0.00 0.00 0.65 0.00 0.00 2.38 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.18 1.20 7.81 16 E 8.28 4.13 0.00 2.01 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 2.38 2.40 0.00 17 A 8.26 4.13 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 18 A 8.19 3.94 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 19 L 7.79 4.65 0.00 1.69 1.79 1.37 1.01 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 20 S 7.98 4.27 0.00 3.86 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 Y 8.04 4.50 0.00 2.96 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 G 7.97 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 23 F 7.82 5.13 0.00 3.28 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 24 Y 7.49 4.60 0.00 3.08 2.87 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 25 G 7.54 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 0.00 0.00 0.00 26 C 9.01 4.90 0.00 2.98 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 27 H 8.66 4.73 0.00 3.29 3.36 0.00 5.64 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 C 7.89 4.71 0.00 3.42 3.33 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 0.00 29 G 9.39 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 0.00 0.00 0.00 30 V 8.48 3.72 2.15 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 0.81 0.00 0.00 1.00 0.00 0.00 31 G 8.77 3.71 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 0.00 0.00 0.00 32 G 7.69 4.52 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 0.00 0.00 0.00 0.00 33 R 7.54 4.53 0.00 1.71 1.74 0.00 3.45 0.00 0.00 3.27 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.63 0.00 34 G 8.45 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 35 S 8.25 4.93 0.00 4.00 3.79 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 36 P 0.00 4.65 0.00 2.18 2.05 0.00 3.81 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.94 0.00 37 K 8.31 3.66 0.00 1.33 0.74 0.00 0.78 0.00 0.00 1.23 0.00 0.00 2.86 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.09 0.60 7.81 38 D 7.35 4.49 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 39 A 8.69 4.31 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.95 4.07 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 1.31 0.00 0.00 41 D 8.00 4.48 0.00 3.18 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 42 R 8.13 4.01 0.00 1.99 1.96 0.00 3.33 0.00 0.00 3.16 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.82 0.00 43 C 8.51 4.29 0.00 3.29 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 44 C 8.30 4.35 0.00 3.31 3.42 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 45 V 7.78 3.44 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 0.75 0.00 0.00 0.87 0.00 0.00 46 T 7.63 3.83 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 1.14 0.00 0.00 47 H 8.02 3.95 0.00 3.06 3.23 0.00 5.58 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 D 8.21 4.24 0.00 2.86 2.68 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 49 C 8.75 4.31 0.00 3.03 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 50 C 8.13 4.22 0.00 3.07 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 51 Y 8.22 4.06 0.00 2.87 2.87 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 52 K 8.15 3.89 0.00 1.75 2.09 0.00 1.80 0.00 0.00 1.76 0.00 0.00 3.07 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.46 1.47 7.81 53 R 7.57 4.07 0.00 1.99 2.03 0.00 3.09 0.00 0.00 3.13 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.78 0.00 54 L 7.67 4.18 0.00 1.94 1.67 0.86 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 55 E 7.95 4.50 0.00 2.11 2.11 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 2.38 2.23 0.00 56 K 8.09 4.51 0.00 1.91 1.73 0.00 1.70 0.00 0.00 1.85 0.00 0.00 2.90 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.38 1.39 7.81 57 R 7.67 3.98 0.00 1.83 1.81 0.00 3.28 0.00 0.00 3.23 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.44 0.00 58 G 7.72 4.12 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 0.00 0.00 0.00 59 C 7.85 4.57 0.00 3.02 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 G 8.43 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 0.00 0.00 0.00 61 T 7.43 3.98 2.97 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 1.01 0.00 0.00 62 K 7.63 3.71 0.00 1.54 0.74 0.00 1.62 0.00 0.00 1.73 0.00 0.00 3.00 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.24 1.50 7.81 63 F 7.64 5.00 0.00 3.02 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 64 L 7.58 4.46 0.00 1.53 1.58 0.94 0.95 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 65 S 8.52 4.55 0.00 3.95 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 66 Y 7.09 5.00 0.00 3.13 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 67 K 9.62 5.00 0.00 1.79 1.73 0.00 1.60 0.00 0.00 1.73 0.00 0.00 3.40 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.35 1.42 7.81 68 F 8.46 5.48 0.00 3.29 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 69 S 9.39 4.74 0.00 3.85 3.90 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 70 N 8.45 5.48 0.00 2.98 3.00 0.00 0.00 5.68 7.64 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 71 S 9.00 4.54 0.00 3.80 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 72 G 8.40 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 S 8.78 4.43 0.00 3.99 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 74 R 8.26 4.05 0.00 1.93 2.12 0.00 3.07 0.00 0.00 3.18 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.63 0.00 75 I 8.40 5.05 1.86 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.81 0.96 0.00 0.00 76 T 9.30 4.76 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 77 C 8.80 5.24 0.00 2.85 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 78 A 8.97 4.46 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 79 K 8.45 4.20 0.00 1.77 1.77 0.00 1.76 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.44 1.41 7.81 80 Q 8.17 4.51 0.00 2.01 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 7.03 0.00 0.00 0.00 0.00 0.00 2.32 2.45 0.00 81 D 8.45 4.64 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 82 S 8.47 4.06 0.00 4.04 4.15 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 83 C 8.12 4.18 0.00 3.10 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 84 R 7.90 3.90 0.00 2.18 2.29 0.00 3.20 0.00 0.00 3.47 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.73 0.00 85 S 8.62 4.07 0.00 4.02 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 86 Q 8.76 4.10 0.00 2.18 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.83 0.00 0.00 0.00 0.00 0.00 2.32 2.43 0.00 87 L 8.02 3.75 0.00 1.67 1.66 0.49 1.23 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 88 C 7.46 3.08 0.00 2.13 2.87 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 89 E 7.91 3.73 0.00 1.93 1.89 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 2.38 2.42 0.00 90 C 8.16 4.24 0.00 3.19 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 91 D 7.80 3.97 0.00 2.78 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 92 K 8.12 3.74 0.00 1.78 1.83 0.00 1.59 0.00 0.00 1.78 0.00 0.00 2.90 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.37 1.39 7.81 93 A 7.71 3.87 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 94 A 7.40 3.34 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 A 7.95 3.88 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 96 T 7.75 3.79 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 97 C 8.22 4.24 0.00 2.89 3.09 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 98 F 8.15 4.32 0.00 2.92 2.52 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 0.00 99 A 7.86 4.20 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 0.00 100 R 8.10 3.95 0.00 1.81 2.02 0.00 3.33 0.00 0.00 3.22 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.81 0.00 101 N 8.08 4.87 0.00 2.84 2.89 0.00 0.00 6.68 7.25 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 0.00 102 K 8.02 4.11 0.00 2.04 1.85 0.00 1.56 0.00 0.00 1.69 0.00 0.00 2.98 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.45 7.81 103 T 7.96 4.04 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 1.24 0.00 0.00 104 T 7.88 4.28 4.53 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 1.30 0.00 0.00 105 Y 7.56 3.95 0.00 3.03 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 0.00 106 N 8.40 4.65 0.00 2.79 2.41 0.00 0.00 6.89 7.04 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 0.00 107 K 8.56 3.81 0.00 1.81 1.85 0.00 1.78 0.00 0.00 1.80 0.00 0.00 2.92 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.76 1.51 7.81 108 K 7.46 3.69 0.00 1.44 1.19 0.00 1.55 0.00 0.00 1.70 0.00 0.00 2.93 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.31 1.31 7.81 109 Y 7.19 4.34 0.00 2.00 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 0.00 0.00 0.00 110 Q 7.40 3.89 0.00 1.97 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.98 6.85 0.00 0.00 0.00 0.00 0.00 1.40 2.39 0.00 111 Y 7.56 4.93 0.00 3.07 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 0.00 112 Y 8.22 4.08 0.00 2.85 3.07 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 0.00 113 S 8.15 3.97 0.00 3.66 3.24 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 0.00 114 N 8.60 4.61 0.00 2.86 2.82 0.00 0.00 7.15 7.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 K 7.39 3.99 0.00 1.50 1.76 0.00 1.58 0.00 0.00 1.61 0.00 0.00 2.94 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.41 1.33 7.81 116 H 7.82 4.83 0.00 2.95 3.33 0.00 5.66 0.00 0.00 0.00 0.00 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 C 7.95 4.71 0.00 3.03 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 0.00 118 R 8.36 4.19 0.00 1.93 1.82 0.00 3.21 0.00 0.00 3.37 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.70 0.00 119 G 8.98 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 0.00 120 S 8.68 4.45 0.00 4.03 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 0.00 121 T 8.18 5.05 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 1.28 0.00 0.00 122 P 0.00 4.13 0.00 1.99 2.01 0.00 3.83 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 2.05 0.00 123 R 7.75 3.76 0.00 1.94 2.02 0.00 3.36 0.00 0.00 3.28 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.55 0.00 124 C 8.62 4.56 0.00 3.08 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