NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 T 4.5537 8.1749 117.3752 63.7235 70.2209 172.9327 2 T 4.6620 9.9004 122.5201 60.3235 72.5079 171.4977 3 T 5.2172 8.4570 116.2521 59.8973 72.4233 172.8503 4 L 4.9898 9.0632 123.8711 54.2931 44.4579 174.9848 5 A 5.7573 8.7772 121.8104 50.0798 22.1793 175.3614 6 F 5.0349 8.0984 116.3268 55.1111 41.8360 173.4750 7 R 5.2137 8.8128 121.1406 55.5100 31.7767 175.0421 8 F 4.9505 9.8966 119.4896 55.7417 41.2523 174.5432 9 Q 3.6909 9.0180 121.5178 59.4992 28.3462 178.1522 10 G 3.4060 5.4220 101.9612 45.5613 0.0000 172.6236 11 G 4.2577 7.1180 107.6741 44.0515 0.0000 176.5823 12 I 5.1600 8.6039 123.3519 59.1950 40.7319 173.1787 13 I 4.3156 7.8589 126.2874 59.3497 39.7444 174.8664 14 V 4.8772 8.1336 124.9734 61.1639 34.3386 174.2597 15 A 4.8458 8.9115 128.3067 50.6869 22.8433 175.0334 16 V 4.9970 8.2225 112.5299 60.4569 36.4216 174.1041 17 D 4.9776 8.1418 121.4386 52.6672 41.8596 177.0404 18 S 4.7732 8.1976 113.7358 58.6535 64.1053 173.0571 19 R 5.0070 8.9863 120.7512 55.9267 31.4880 175.1881 20 A 4.9546 9.2840 127.1861 50.3560 22.2703 175.0504 21 T 5.0668 8.5383 110.2615 60.1443 72.5768 174.2123 22 A 4.5324 9.0522 123.4137 49.3444 19.6840 177.1561 23 G 4.1770 8.7033 113.8099 46.3312 0.0000 173.4524 24 N 4.5532 8.7852 120.8119 53.7186 39.1406 174.6950 25 W 4.3260 7.8701 129.0820 56.5183 31.0384 175.2146 26 V 3.8057 7.6191 126.1225 62.1126 30.8014 175.3121 27 A 4.1280 8.6610 132.3118 54.8652 18.9030 177.2545 28 S 4.5308 7.3313 107.1314 57.8003 65.0446 174.4611 29 Q 4.7671 8.6191 122.5628 55.7612 29.6803 175.7272 30 T 4.7051 7.9134 108.6642 61.2853 68.4798 174.1831 31 V 4.1339 7.7538 121.0100 63.0207 33.0534 176.0139 32 K 4.4050 8.4709 126.3239 55.1607 32.5015 176.7334 33 K 4.3066 8.5966 123.5475 56.7998 33.3523 176.2934 34 V 4.7587 7.2996 121.0609 61.0964 33.4581 174.6843 35 I 4.3240 8.9893 129.5547 59.7531 39.1374 175.3917 36 E 4.5587 8.8205 127.8154 54.9464 28.0165 176.1189 37 I 3.8020 8.2137 125.1806 63.3141 37.5994 176.5230 38 N 4.2121 7.9622 115.7726 51.9937 38.4928 173.9955 39 P 3.7337 0.0000 0.0000 64.0393 31.5980 176.6229 40 F 5.1203 9.7565 115.3931 56.8564 42.9622 173.8542 41 L 5.1618 8.0272 118.3853 52.8063 45.0789 175.5418 42 L 5.1046 9.1707 122.9696 52.8544 45.7797 175.7643 43 G 4.9007 9.2184 108.9428 43.5761 0.0000 172.4134 44 T 4.8446 8.6948 116.2854 61.4914 70.5419 174.3212 45 M 4.7850 8.6727 121.7386 53.9430 34.7162 174.3472 46 A 4.5590 9.0836 127.6240 50.4545 22.5625 173.1870 47 G 4.0801 9.1932 107.1475 44.0400 0.0000 174.4398 48 G 3.6169 9.6073 113.4961 45.0610 0.0000 173.0661 49 A 3.9589 8.4069 126.9697 54.7193 18.2213 179.1751 50 A 3.9315 7.9459 116.5620 55.4780 18.5168 179.1430 51 D 4.5209 8.2709 116.0727 58.1082 40.9137 179.3092 52 C 4.2800 8.1531 116.4736 62.9135 28.2273 175.5945 53 Q 4.0245 8.3234 121.1915 59.4750 28.5101 178.5972 54 F 3.8797 8.9326 121.5938 61.2240 39.5694 177.3685 55 W 4.5266 8.1831 118.5429 59.7489 28.9088 178.4412 56 E 4.2912 9.0065 119.2927 59.4059 28.8078 179.3224 57 T 3.8630 7.8094 115.8323 66.2923 68.4951 176.4218 58 W 4.0521 8.2575 130.4062 60.3193 30.5912 177.6431 59 L 3.6272 8.3616 120.4354 58.0214 41.5503 178.9906 60 G 3.6811 7.9703 105.5860 48.2284 0.0000 175.7611 61 S 4.0816 7.5824 117.4178 61.3370 62.7389 176.8537 62 Q 3.7979 7.4500 120.8077 58.8668 28.4310 178.4421 63 C 4.0948 8.1469 118.1402 62.5956 28.1436 176.1134 64 R 3.8754 8.0334 120.3401 59.4439 29.7259 178.5718 65 L 3.9839 7.8628 118.8384 58.0395 41.5200 178.9767 66 H 4.1044 8.3923 118.2730 59.3623 29.2909 177.2204 67 E 4.3025 8.1406 121.4564 58.4937 29.0574 179.2504 68 L 4.0192 7.7707 118.6166 57.5979 41.7384 179.2673 69 R 4.0060 7.8476 117.4592 59.2712 30.2530 177.6417 70 E 4.3180 8.1372 115.0308 54.7913 30.1808 176.1389 71 K 3.9121 8.0063 117.7049 56.3926 30.3703 174.5280 72 E 4.5888 7.6234 115.1218 54.7165 32.6754 173.9174 73 R 4.5225 8.6373 125.3094 55.8779 30.4374 175.9835 74 I 3.8302 9.1322 126.4472 60.7537 38.8181 176.1933 75 S 4.4169 8.2972 121.5184 57.7316 65.2422 175.3748 76 V 3.5422 8.3663 123.0165 66.4237 31.2938 178.1574 77 A 3.9944 8.0689 119.5630 55.1640 18.1715 179.3969 78 A 3.8728 7.9184 118.8132 55.1566 18.4100 179.5166 79 A 3.9332 8.3240 120.0549 55.5538 18.4803 180.1048 80 S 4.1456 8.5127 112.9548 61.3211 63.0223 176.3821 81 K 4.1043 7.8929 122.4975 58.5802 31.8345 179.0004 82 I 3.7539 7.7113 120.5687 64.2122 37.0648 177.9128 83 L 4.1916 7.8189 120.9445 58.3701 42.0042 178.4232 84 S 4.1008 8.0971 113.0096 61.9764 62.0007 176.1263 85 N 4.3755 8.4900 117.7184 56.0879 38.6359 176.8129 86 L 4.0201 8.2713 122.1893 58.2201 42.1203 179.2695 87 V 3.4400 8.0649 119.3142 65.2238 31.1784 177.6562 88 Y 3.9972 8.2612 119.7828 60.0213 38.3493 177.7467 89 Q 3.9827 7.9466 118.1166 57.8693 28.8447 176.9550 90 Y 4.5100 7.5048 116.6395 56.1547 38.3094 175.0834 91 K 3.8637 6.8981 122.2610 58.1621 32.4511 177.0665 92 G 3.9381 8.9459 114.4558 45.3702 0.0000 174.1651 93 A 4.0424 7.8594 122.0827 53.6088 18.5634 178.0740 94 G 4.0354 8.4848 101.2202 45.2205 0.0000 174.2885 95 L 4.1758 7.6843 119.5592 55.1777 42.2700 177.1069 96 S 4.5949 9.2794 116.5612 57.5028 64.7931 172.3268 97 M 5.1799 8.4899 123.4426 53.8573 33.9472 174.3682 98 G 4.1635 9.7689 109.7812 44.8246 0.0000 171.5520 99 T 4.8568 8.5750 119.2582 60.5189 71.5555 172.4371 100 M 4.8502 9.0027 123.7729 53.4671 35.5041 174.9061 101 I 4.8933 8.5170 123.7781 59.9379 39.3384 174.6418 102 C 4.8988 9.0686 125.5262 57.9359 31.2718 173.8662 103 G 4.4866 8.4289 109.0437 45.5456 0.0000 172.0512 104 Y 4.7720 8.5786 120.3131 55.9647 40.0831 175.0900 105 T 4.2096 8.3926 114.5611 61.3578 69.1904 175.0415 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 T 8.17 4.55 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 1.22 0.00 0.00 2 T 9.90 4.66 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 1.22 0.00 0.00 3 T 8.46 5.22 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 1.23 0.00 0.00 4 L 9.06 4.99 0.00 1.72 1.79 1.03 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 5 A 8.78 5.76 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 F 8.10 5.03 0.00 3.08 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 7 R 8.81 5.21 0.00 1.93 1.95 0.00 3.20 0.00 0.00 3.28 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.63 0.00 8 F 9.90 4.95 0.00 3.33 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 9 Q 9.02 3.69 0.00 1.96 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.31 0.00 0.00 0.00 0.00 0.00 2.23 2.28 0.00 10 G 5.42 3.41 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 0.00 11 G 7.12 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 0.00 0.00 0.00 0.00 12 I 8.60 5.16 1.90 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 1.36 0.72 0.90 0.00 0.00 13 I 7.86 4.32 0.56 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.19 0.27 0.64 0.00 0.00 14 V 8.13 4.88 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 0.78 0.00 0.00 0.88 0.00 0.00 15 A 8.91 4.85 1.21 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 0.00 0.00 0.00 0.00 0.00 0.00 16 V 8.22 5.00 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 0.74 0.00 0.00 0.93 0.00 0.00 17 D 8.14 4.98 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 18 S 8.20 4.77 0.00 4.06 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 19 R 8.99 5.01 0.00 1.75 1.94 0.00 3.16 0.00 0.00 3.16 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.62 0.00 20 A 9.28 4.95 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 21 T 8.54 5.07 4.44 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 1.18 0.00 0.00 22 A 9.05 4.53 1.40 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 0.00 0.00 23 G 8.70 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 24 N 8.79 4.55 0.00 2.81 2.93 0.00 0.00 6.71 7.68 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 25 W 7.87 4.33 0.00 3.44 3.18 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 26 V 7.62 3.81 1.61 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 0.59 0.00 0.00 0.77 0.00 0.00 27 A 8.66 4.13 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 28 S 7.33 4.53 0.00 3.81 3.63 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.62 4.77 0.00 1.98 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 7.29 0.00 0.00 0.00 0.00 0.00 2.13 2.15 0.00 30 T 7.91 4.71 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 1.19 0.00 0.00 31 V 7.75 4.13 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 0.78 0.00 0.00 0.93 0.00 0.00 32 K 8.47 4.40 0.00 1.79 1.76 0.00 1.60 0.00 0.00 1.82 0.00 0.00 2.90 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.46 1.51 7.81 33 K 8.60 4.31 0.00 1.72 1.99 0.00 1.74 0.00 0.00 1.75 0.00 0.00 2.77 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.53 1.44 7.81 34 V 7.30 4.76 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 0.78 0.00 0.00 0.93 0.00 0.00 35 I 8.99 4.32 2.05 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 1.25 0.55 0.93 0.00 0.00 36 E 8.82 4.56 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 2.28 2.31 0.00 37 I 8.21 3.80 2.04 0.00 0.00 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 1.38 0.64 0.92 0.00 0.00 38 N 7.96 4.21 0.00 2.94 2.91 0.00 0.00 6.25 7.76 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 39 P 0.00 3.73 0.00 1.11 1.53 0.00 3.51 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.94 0.00 40 F 9.76 5.12 0.00 2.87 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 41 L 8.03 5.16 0.00 1.66 1.56 0.95 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 42 L 9.17 5.10 0.00 1.56 1.52 0.93 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 43 G 9.22 4.90 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 0.00 44 T 8.69 4.84 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 1.23 0.00 0.00 45 M 8.67 4.79 0.00 2.07 2.00 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 2.55 2.50 0.00 46 A 9.08 4.56 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 47 G 9.19 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 48 G 9.61 3.62 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 49 A 8.41 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 50 A 7.95 3.93 1.31 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 51 D 8.27 4.52 0.00 2.96 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 52 C 8.15 4.28 0.00 3.21 3.19 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 53 Q 8.32 4.02 0.00 2.16 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.82 0.00 0.00 0.00 0.00 0.00 2.41 2.42 0.00 54 F 8.93 3.88 0.00 3.02 2.82 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 0.00 0.00 0.00 0.00 55 W 8.18 4.53 0.00 3.75 3.36 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 56 E 9.01 4.29 0.00 2.20 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 2.46 2.60 0.00 57 T 7.81 3.86 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 1.12 0.00 0.00 58 W 8.26 4.05 0.00 3.00 3.43 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 59 L 8.36 3.63 0.00 2.17 1.97 0.97 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 60 G 7.97 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 0.00 0.00 0.00 61 S 7.58 4.08 0.00 3.74 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 62 Q 7.45 3.80 0.00 1.70 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.81 0.00 0.00 0.00 0.00 0.00 1.16 1.16 0.00 63 C 8.15 4.09 0.00 3.08 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 64 R 8.03 3.88 0.00 1.90 2.03 0.00 3.14 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.69 0.00 65 L 7.86 3.98 0.00 2.01 1.67 0.90 0.99 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 66 H 8.39 4.10 0.00 3.29 3.47 0.00 5.78 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 67 E 8.14 4.30 0.00 2.21 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 0.00 2.65 2.53 0.00 68 L 7.77 4.02 0.00 1.79 1.72 0.91 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 69 R 7.85 4.01 0.00 1.98 1.87 0.00 3.29 0.00 0.00 3.21 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.69 0.00 70 E 8.14 4.32 0.00 1.78 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 2.15 2.26 0.00 71 K 8.01 3.91 0.00 1.82 1.81 0.00 1.73 0.00 0.00 1.61 0.00 0.00 2.96 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.38 1.33 7.81 72 E 7.62 4.59 0.00 1.93 1.78 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 2.26 2.24 0.00 73 R 8.64 4.52 0.00 1.71 1.76 0.00 2.32 0.00 0.00 3.35 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.66 0.00 74 I 9.13 3.83 1.79 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.71 0.94 0.00 0.00 75 S 8.30 4.42 0.00 4.07 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 76 V 8.37 3.54 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 1.10 0.00 0.00 0.96 0.00 0.00 77 A 8.07 3.99 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 78 A 7.92 3.87 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 A 8.32 3.93 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 80 S 8.51 4.15 0.00 4.05 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 0.00 81 K 7.89 4.10 0.00 1.99 1.84 0.00 1.63 0.00 0.00 1.64 0.00 0.00 2.91 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.60 1.47 7.81 82 I 7.71 3.75 2.08 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.72 0.93 0.00 0.00 83 L 7.82 4.19 0.00 1.86 1.76 1.20 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 84 S 8.10 4.10 0.00 4.05 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 85 N 8.49 4.38 0.00 2.84 2.92 0.00 0.00 7.09 7.73 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 86 L 8.27 4.02 0.00 1.87 1.87 -0.74 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 87 V 8.06 3.44 2.24 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 0.76 0.00 0.00 0.80 0.00 0.00 88 Y 8.26 4.00 0.00 3.09 3.13 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 89 Q 7.95 3.98 0.00 1.98 1.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.86 0.00 0.00 0.00 0.00 0.00 2.58 2.43 0.00 90 Y 7.50 4.51 0.00 2.95 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 91 K 6.90 3.86 0.00 1.39 1.30 0.00 1.70 0.00 0.00 1.45 0.00 0.00 3.10 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.34 1.32 7.81 92 G 8.95 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 0.00 0.00 0.00 93 A 7.86 4.04 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 94 G 8.48 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 95 L 7.68 4.18 0.00 1.60 1.58 0.50 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 96 S 9.28 4.59 0.00 3.84 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 97 M 8.49 5.18 0.00 2.09 2.04 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.57 0.00 98 G 9.77 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 99 T 8.57 4.86 4.30 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 1.27 0.00 0.00 100 M 9.00 4.85 0.00 1.98 1.93 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.50 0.00 101 I 8.52 4.89 1.90 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 1.39 0.90 0.94 0.00 0.00 102 C 9.07 4.90 0.00 2.85 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 0.00 103 G 8.43 4.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 8.58 4.77 0.00 3.00 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 0.00 105 T 8.39 4.21 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 1.21 0.00 0.00