NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.3088 8.2649 123.5854 52.1558 20.5394 178.0377 2 F 4.3127 8.6860 113.4421 58.3065 39.3416 174.2477 3 N 4.5492 8.6658 119.9856 52.9108 40.1155 174.4741 4 G 3.9638 7.7775 112.2282 44.4534 0.0000 170.8482 5 T 5.0685 7.7208 116.1968 61.6531 70.9271 174.1420 6 W 5.2226 9.1074 125.3194 54.8993 32.9982 173.7103 7 N 5.1023 9.3712 124.3448 52.1382 40.0544 173.9507 8 V 4.3435 8.3175 127.4841 63.0268 31.5946 175.0636 9 Y 4.8949 8.3154 125.1997 57.0337 39.8724 175.7065 10 A 4.6722 7.0298 121.1642 50.6452 23.0144 175.0643 11 Q 4.6174 8.4394 119.4563 54.2963 32.3089 174.2541 12 E 4.4432 9.0655 124.5485 55.0536 32.2081 176.1105 13 N 4.2037 8.8739 121.2327 55.1570 37.6401 175.5234 14 Y 4.5296 8.1302 119.3173 59.9913 38.8983 176.3804 15 E 3.8019 8.1837 120.0064 59.5125 29.9342 178.5148 16 N 4.3981 8.1538 115.9446 56.0720 38.6395 177.1037 17 F 4.6608 8.1730 123.4464 60.7979 39.5206 177.2224 18 L 3.9041 8.1381 118.7602 57.4366 41.3636 179.6878 19 R 3.8414 7.9411 118.2269 59.3991 29.7920 178.8663 20 T 3.7382 7.5967 114.3854 66.8454 68.6239 176.4948 21 V 3.5361 7.1472 117.9172 64.3449 31.3835 176.7656 22 G 3.8811 8.0563 106.2958 45.4486 0.0000 173.6660 23 L 4.1768 7.2505 118.6485 53.5013 42.4557 175.6171 24 P 4.5487 0.0000 0.0000 62.2504 33.6549 176.9384 25 E 3.9142 8.8668 120.0621 60.1949 28.6294 179.6098 26 D 4.3605 8.0337 118.0503 57.4078 40.9323 178.6852 27 I 4.0930 7.6371 119.7559 63.9724 37.3055 178.1017 28 I 3.5893 7.7049 120.7582 64.4016 36.7316 178.2346 29 K 3.8459 8.0578 118.2546 59.6534 32.1490 179.2630 30 V 3.6991 7.3198 118.2177 65.9799 31.6077 177.7001 31 A 4.0487 8.4825 121.0954 55.2390 17.9878 179.6463 32 K 3.9001 8.2941 116.1260 59.5717 32.4940 177.9295 33 D 4.8543 7.7155 117.5344 53.0477 41.2486 175.8871 34 V 4.1848 7.5792 120.7976 61.2621 32.4492 174.6034 35 N 4.9157 8.6504 125.3754 51.1067 39.5641 173.1823 36 P 4.7982 0.0000 0.0000 62.4455 33.8539 174.8051 37 V 4.6951 8.3885 120.1670 61.3658 33.8242 174.3129 38 I 4.9059 8.9664 129.3107 59.8029 39.1542 174.0868 39 E 5.0993 9.3650 129.8421 55.0660 31.4690 174.8433 40 I 5.0320 9.1659 127.4676 59.8364 41.1088 174.3778 41 E 4.7050 9.3439 128.2185 55.0615 30.2001 174.7067 42 Q 4.0668 8.2680 126.4053 54.2902 29.2411 174.6473 43 N 4.4226 8.6236 126.7763 55.6373 40.5382 175.0965 44 G 3.7480 7.5883 111.1045 46.1006 0.0000 173.1237 45 N 4.8028 8.8264 123.5756 54.0903 40.9529 175.4415 46 E 4.8209 7.9079 119.2954 55.1282 31.9216 175.1134 47 F 5.0417 9.0352 121.3084 55.8409 44.0129 174.4986 48 V 4.3431 8.3735 120.6105 61.8568 34.4958 173.6178 49 V 4.9720 8.7207 128.8254 61.3762 34.1579 174.2935 50 T 5.1229 9.1681 122.0591 60.5127 71.0614 172.0107 51 S 5.2353 9.1806 123.8479 56.8532 64.4730 172.7511 52 K 5.2830 9.2096 126.5179 55.3108 35.2380 175.2918 53 T 4.9875 8.9172 119.0193 61.1568 73.9856 171.5442 54 P 4.4062 0.0000 0.0000 64.3157 31.4290 176.7439 55 K 3.9699 9.0558 120.4371 56.9852 29.9804 175.0478 56 Q 4.8307 8.1887 117.7683 54.7402 33.2018 173.9802 57 T 5.7742 8.3891 111.8040 60.0587 72.3520 172.4358 58 H 5.0532 8.6680 121.1120 54.9787 33.5975 172.0518 59 S 5.2750 8.2354 119.0294 57.2959 67.2754 172.7317 60 N 5.2115 8.9272 117.5190 52.3006 43.2956 173.7995 61 S 5.2898 8.4336 115.8668 57.2394 67.2063 172.9594 62 F 4.8478 7.9432 115.2391 56.9638 41.5326 172.7622 63 T 5.1184 8.5519 115.2367 61.5094 71.7863 174.3212 64 V 3.5284 9.7490 127.6252 63.8373 32.2667 175.8405 65 G 3.9128 8.9045 114.4943 45.7646 0.0000 173.9084 66 K 4.5127 7.8579 118.4201 54.6979 35.2549 175.2874 67 E 4.4272 8.9312 127.1116 57.5546 29.8903 176.4345 68 S 4.6498 8.7492 116.9701 57.3318 68.2695 173.1913 69 E 5.2028 8.6587 123.6727 54.9497 29.7493 175.5113 70 I 4.4869 8.1465 128.1268 59.7833 40.0904 176.2537 71 T 5.4630 7.8893 110.7658 60.4603 69.1255 173.7502 72 S 4.1077 8.0748 117.6271 60.4531 62.4372 173.5122 73 M 3.3879 8.9837 127.1252 55.7709 29.8513 177.2444 74 D 4.5815 7.7929 115.0714 52.2185 43.3337 177.5112 75 G 3.9313 8.3092 107.1930 45.6278 0.0000 173.1908 76 K 4.2232 7.5411 121.1182 56.6807 33.8576 175.6865 77 K 5.6051 8.3546 120.5172 55.0789 35.8115 175.8569 78 I 4.3455 8.0426 116.5907 59.6870 41.0758 173.5242 79 K 4.5000 8.6012 122.7228 56.4446 32.3573 176.8232 80 V 4.5781 9.6892 126.3080 61.3074 34.6051 174.0554 81 T 4.6976 8.6405 121.4742 60.6391 69.0561 173.3863 82 V 4.7006 8.1162 128.7086 61.6345 34.2543 174.3027 83 Q 4.8913 8.2920 121.6154 55.4495 32.0008 172.9609 84 L 5.1366 8.6657 122.5817 52.9118 44.0182 175.9233 85 E 4.6567 8.8152 120.8707 56.0863 30.6818 177.4303 86 G 3.8255 8.5243 111.0262 44.9090 0.0000 174.1975 87 G 4.0767 8.3169 101.9004 45.1808 0.0000 173.2632 88 K 5.0366 7.9576 121.8315 54.5602 35.1285 174.4138 89 L 4.6984 8.8815 130.7536 54.0705 43.8331 175.5181 90 I 4.8823 8.6830 126.1874 60.0492 40.7041 174.2394 91 C 4.9667 8.5778 125.4316 57.8043 30.6646 172.9303 92 K 4.7784 8.2199 119.8906 56.9740 35.2760 174.1968 93 S 4.9521 8.8305 117.3893 57.9169 65.3466 173.9514 94 D 4.5428 8.7174 119.4090 57.4239 40.7297 177.4224 95 K 4.6557 8.1333 114.1937 56.9573 37.3649 175.1511 96 F 5.6475 8.1596 124.0107 56.9490 42.5970 173.8638 97 S 4.6468 7.2263 116.0550 57.7474 66.7762 173.5035 98 H 4.7718 8.6537 122.0735 55.4324 32.8308 171.8604 99 I 4.8340 8.2167 127.1170 59.5961 39.9116 174.8638 100 Q 4.6000 9.2098 127.2302 54.5834 31.7906 173.5079 101 E 5.3780 9.4435 126.6817 53.9914 32.3374 175.4919 102 V 4.7766 8.1952 122.1011 61.3186 34.8459 174.5549 103 N 4.8229 9.1519 124.9882 52.0375 41.4776 175.1695 104 G 3.8064 8.2156 115.7918 47.2813 0.0000 172.9727 105 D 4.6907 8.7955 125.4692 54.0559 41.0201 174.6490 106 E 5.5097 8.3206 120.2093 54.8674 32.3595 174.7362 107 M 5.1317 9.2136 122.8705 53.7940 36.0746 174.1734 108 V 4.8962 9.1553 124.2942 61.1609 35.3080 174.0576 109 E 5.0716 9.0085 125.4328 54.6456 33.9851 175.1130 110 K 4.7760 8.6410 121.8829 54.7450 34.8266 174.6358 111 I 4.3511 8.4955 126.4547 60.1527 39.2763 175.1734 112 T 5.2891 8.6637 122.1161 62.0870 73.3723 173.2882 113 I 4.8501 8.6384 125.2164 59.5402 41.0770 175.2402 114 G 3.7319 8.8817 118.3172 47.3849 0.0000 174.3281 115 S 4.4795 8.8034 120.8529 58.0754 63.1756 173.1342 116 S 4.6849 8.2151 117.7292 57.3664 63.3076 172.7627 117 T 5.1284 8.5899 124.1681 61.7011 70.6866 173.4640 118 L 4.6821 9.2109 129.3595 53.5567 44.5319 175.0080 119 T 4.8959 8.1799 123.2566 62.1523 70.5875 173.3881 120 R 4.7122 8.5691 126.8587 54.3155 32.4233 175.6415 121 K 4.9270 8.5797 124.2553 54.6470 34.6591 175.6564 122 S 5.2154 8.8832 117.7733 56.9812 67.3553 172.5113 123 K 5.3442 9.3135 121.6500 54.4285 34.9938 175.2415 124 R 3.5766 8.9527 128.9192 57.0551 30.5666 176.5596 125 V 3.5265 8.3196 125.2841 63.4578 33.0698 172.1632 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 A 8.26 4.31 1.07 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 2 F 8.69 4.31 0.00 3.52 3.37 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 3 N 8.67 4.55 0.00 2.71 2.79 0.00 0.00 6.99 7.98 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 4 G 7.78 3.96 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 0.00 0.00 0.00 5 T 7.72 5.07 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 1.24 0.00 0.00 6 W 9.11 5.22 0.00 3.40 3.17 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 7 N 9.37 5.10 0.00 2.81 2.80 0.00 0.00 6.48 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 8 V 8.32 4.34 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 0.67 0.00 0.00 0.97 0.00 0.00 9 Y 8.32 4.89 0.00 3.03 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 10 A 7.03 4.67 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 11 Q 8.44 4.62 0.00 1.73 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.68 6.66 0.00 0.00 0.00 0.00 0.00 1.94 2.31 0.00 12 E 9.07 4.44 0.00 1.85 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 0.00 2.22 2.16 0.00 13 N 8.87 4.20 0.00 3.00 3.04 0.00 0.00 6.86 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 14 Y 8.13 4.53 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 15 E 8.18 3.80 0.00 2.09 1.94 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 2.36 2.36 0.00 16 N 8.15 4.40 0.00 3.01 2.88 0.00 0.00 6.66 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 17 F 8.17 4.66 0.00 3.34 3.40 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.14 3.90 0.00 1.77 1.56 0.38 0.75 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 19 R 7.94 3.84 0.00 1.78 1.92 0.00 3.28 0.00 0.00 3.22 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.88 0.00 20 T 7.60 3.74 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 1.09 0.00 0.00 21 V 7.15 3.54 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 0.78 0.00 0.00 0.47 0.00 0.00 22 G 8.06 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 23 L 7.25 4.18 0.00 1.73 1.56 0.89 1.05 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 24 P 0.00 4.55 0.00 2.24 2.14 0.00 3.69 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.02 0.00 25 E 8.87 3.91 0.00 1.98 2.06 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 2.39 2.36 0.00 26 D 8.03 4.36 0.00 2.75 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 27 I 7.64 4.09 1.96 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 1.63 0.57 0.89 0.00 0.00 28 I 7.70 3.59 1.99 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 1.44 0.65 0.82 0.00 0.00 29 K 8.06 3.85 0.00 1.83 1.89 0.00 1.70 0.00 0.00 1.63 0.00 0.00 2.98 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.47 1.71 7.81 30 V 7.32 3.70 2.21 0.00 0.00 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 0.00 0.00 0.99 0.00 0.00 31 A 8.48 4.05 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 32 K 8.29 3.90 0.00 1.88 1.93 0.00 1.61 0.00 0.00 1.69 0.00 0.00 3.05 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.72 1.52 7.81 33 D 7.72 4.85 0.00 2.69 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 34 V 7.58 4.18 2.18 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 0.83 0.00 0.00 1.03 0.00 0.00 35 N 8.65 4.92 0.00 2.77 2.94 0.00 0.00 7.19 8.02 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 36 P 0.00 4.80 0.00 2.15 2.22 0.00 3.58 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.93 0.00 37 V 8.39 4.70 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 1.01 0.00 0.00 0.98 0.00 0.00 38 I 8.97 4.91 2.01 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 1.17 0.92 1.00 0.00 0.00 39 E 9.36 5.10 0.00 2.14 1.88 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 2.31 2.47 0.00 40 I 9.17 5.03 2.38 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.94 1.21 0.00 0.00 41 E 9.34 4.71 0.00 1.88 1.88 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 2.26 2.26 0.00 42 Q 8.27 4.07 0.00 1.79 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.59 7.08 0.00 0.00 0.00 0.00 0.00 1.96 1.32 0.00 43 N 8.62 4.42 0.00 2.64 2.71 0.00 0.00 7.04 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 44 G 7.59 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 45 N 8.83 4.80 0.00 2.70 2.94 0.00 0.00 6.76 7.66 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 46 E 7.91 4.82 0.00 1.83 1.80 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 2.34 2.31 0.00 47 F 9.04 5.04 0.00 1.51 2.18 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 48 V 8.37 4.34 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 1.00 0.00 0.00 0.88 0.00 0.00 49 V 8.72 4.97 2.29 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 0.99 0.00 0.00 1.13 0.00 0.00 50 T 9.17 5.12 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 1.25 0.00 0.00 51 S 9.18 5.24 0.00 4.01 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 52 K 9.21 5.28 0.00 1.73 1.70 0.00 1.72 0.00 0.00 1.68 0.00 0.00 2.85 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.40 1.43 7.81 53 T 8.92 4.99 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 1.25 0.00 0.00 54 P 0.00 4.41 0.00 2.06 2.04 0.00 3.86 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.14 0.00 55 K 9.06 3.97 0.00 1.92 1.92 0.00 1.74 0.00 0.00 1.72 0.00 0.00 3.00 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.36 1.46 7.81 56 Q 8.19 4.83 0.00 1.97 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.69 0.00 0.00 0.00 0.00 0.00 2.30 2.48 0.00 57 T 8.39 5.77 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 58 H 8.67 5.05 0.00 3.27 3.18 0.00 5.81 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 S 8.24 5.27 0.00 3.70 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 60 N 8.93 5.21 0.00 2.84 2.83 0.00 0.00 7.06 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 61 S 8.43 5.29 0.00 3.74 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 62 F 7.94 4.85 0.00 3.05 3.03 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 63 T 8.55 5.12 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 1.31 0.00 0.00 64 V 9.75 3.53 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 0.79 0.00 0.00 1.14 0.00 0.00 65 G 8.90 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 0.00 0.00 0.00 66 K 7.86 4.51 0.00 1.77 1.85 0.00 1.82 0.00 0.00 1.74 0.00 0.00 2.93 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.36 1.49 7.81 67 E 8.93 4.43 0.00 1.88 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 2.32 2.42 0.00 68 S 8.75 4.65 0.00 3.78 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 69 E 8.66 5.20 0.00 1.97 1.88 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 2.22 2.15 0.00 70 I 8.15 4.49 1.70 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 1.29 0.95 0.63 0.00 0.00 71 T 7.89 5.46 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 1.27 0.00 0.00 72 S 8.07 4.11 0.00 3.92 3.61 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 73 M 8.98 3.39 0.00 2.62 2.49 0.00 0.00 0.00 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.73 2.62 0.00 74 D 7.79 4.58 0.00 2.75 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 75 G 8.31 3.93 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 0.00 0.00 0.00 76 K 7.54 4.22 0.00 1.84 2.00 0.00 1.46 0.00 0.00 1.59 0.00 0.00 2.90 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.34 1.40 7.81 77 K 8.35 5.61 0.00 1.57 1.62 0.00 1.81 0.00 0.00 2.38 0.00 0.00 3.02 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.32 1.31 7.81 78 I 8.04 4.35 1.84 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 1.27 0.73 0.87 0.00 0.00 79 K 8.60 4.50 0.00 1.66 1.81 0.00 1.71 0.00 0.00 1.63 0.00 0.00 2.67 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.44 1.43 7.81 80 V 9.69 4.58 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 0.97 0.00 0.00 0.95 0.00 0.00 81 T 8.64 4.70 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 1.23 0.00 0.00 82 V 8.12 4.70 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 0.94 0.00 0.00 0.86 0.00 0.00 83 Q 8.29 4.89 0.00 2.06 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.54 0.00 0.00 0.00 0.00 0.00 2.42 2.27 0.00 84 L 8.67 5.14 0.00 1.64 1.74 1.26 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 85 E 8.82 4.66 0.00 1.92 1.91 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 2.41 2.37 0.00 86 G 8.52 3.83 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 0.00 0.00 0.00 87 G 8.32 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 88 K 7.96 5.04 0.00 1.84 1.68 0.00 1.73 0.00 0.00 1.75 0.00 0.00 2.76 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.40 1.44 7.81 89 L 8.88 4.70 0.00 1.23 1.09 0.41 -0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 90 I 8.68 4.88 1.81 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 1.19 1.09 0.84 0.00 0.00 91 C 8.58 4.97 0.00 2.71 2.70 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 92 K 8.22 4.78 0.00 1.69 1.53 0.00 1.72 0.00 0.00 1.84 0.00 0.00 2.86 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.31 1.32 7.81 93 S 8.83 4.95 0.00 3.99 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 94 D 8.72 4.54 0.00 2.68 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 95 K 8.13 4.66 0.00 1.82 1.99 0.00 1.25 0.00 0.00 1.65 0.00 0.00 2.88 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.34 1.46 7.81 96 F 8.16 5.65 0.00 3.10 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 97 S 7.23 4.65 0.00 3.73 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 98 H 8.65 4.77 0.00 2.81 2.90 0.00 5.57 0.00 0.00 0.00 0.00 6.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 I 8.22 4.83 1.80 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.87 0.87 0.00 0.00 100 Q 9.21 4.60 0.00 1.84 1.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.78 0.00 0.00 0.00 0.00 0.00 2.22 2.21 0.00 101 E 9.44 5.38 0.00 1.89 1.81 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 2.26 2.08 0.00 102 V 8.20 4.78 1.57 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 0.92 0.00 0.00 0.49 0.00 0.00 103 N 9.15 4.82 0.00 2.82 2.71 0.00 0.00 6.52 7.75 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 0.00 104 G 8.22 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 0.00 105 D 8.80 4.69 0.00 2.72 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 0.00 106 E 8.32 5.51 0.00 2.14 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 2.33 2.45 0.00 107 M 9.21 5.13 0.00 1.45 0.57 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.16 0.00 108 V 9.16 4.90 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 0.86 0.00 0.00 0.92 0.00 0.00 109 E 9.01 5.07 0.00 1.74 1.60 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 2.15 2.12 0.00 110 K 8.64 4.78 0.00 1.57 1.59 0.00 1.59 0.00 0.00 1.59 0.00 0.00 2.79 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.25 1.30 7.81 111 I 8.50 4.35 1.45 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.15 0.96 0.00 0.00 112 T 8.66 5.29 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 1.26 0.00 0.00 113 I 8.64 4.85 1.85 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.11 0.91 0.00 0.00 114 G 8.88 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 0.00 115 S 8.80 4.48 0.00 3.87 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 0.00 116 S 8.22 4.68 0.00 3.91 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 0.00 117 T 8.59 5.13 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 1.21 0.00 0.00 118 L 9.21 4.68 0.00 0.93 0.77 1.05 -1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 119 T 8.18 4.90 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 1.15 0.00 0.00 120 R 8.57 4.71 0.00 1.53 1.63 0.00 2.87 0.00 0.00 2.86 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 1.24 0.00 121 K 8.58 4.93 0.00 0.98 1.28 0.00 1.65 0.00 0.00 1.66 0.00 0.00 2.79 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.24 1.17 7.81 122 S 8.88 5.22 0.00 4.14 3.92 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 0.00 123 K 9.31 5.34 0.00 2.00 1.81 0.00 1.76 0.00 0.00 1.57 0.00 0.00 2.81 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.30 1.39 7.81 124 R 8.95 3.58 0.00 0.67 1.15 0.00 3.06 0.00 0.00 2.25 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.92 0.00 125 V 8.32 3.53 1.91 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 0.66 0.00 0.00 0.79 0.00 0.00