NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3878 8.1627 120.3471 55.6252 33.3126 174.3315 2 S 4.4022 8.1175 119.2011 55.6861 62.6674 170.1278 3 S 4.6333 8.2715 121.8002 59.0360 70.0800 175.9559 4 E 4.0169 8.3105 121.2905 59.1712 29.8000 177.4181 5 T 4.4445 7.5717 108.0276 60.6912 70.4248 173.5087 6 V 5.2240 7.9848 113.6478 58.3734 35.6565 175.7859 7 T 4.2587 8.6196 111.9158 61.0272 69.8551 175.7068 8 L 3.9777 8.6015 122.1838 58.1847 41.4328 179.0147 9 Y 4.1564 8.3061 119.4973 60.9073 38.7016 178.0676 10 E 3.9047 8.3300 118.9754 59.5853 29.4351 179.2178 11 A 4.0309 8.1467 119.7622 54.8309 18.5238 178.8687 12 I 4.1375 7.5563 108.8230 60.7686 38.2477 176.5661 13 G 4.0204 7.8999 109.3467 44.8106 0.0000 175.9563 14 G 2.4546 8.0538 108.3997 45.7348 0.0000 176.0565 15 D 4.3609 8.5177 118.2489 57.5893 41.4179 178.1271 16 A 4.0631 8.0669 120.5735 55.6481 18.1961 179.6545 17 T 3.8734 7.6956 113.6595 66.7022 68.6414 177.2254 18 V 3.7125 7.8464 120.2565 65.8631 31.5505 178.0871 19 R 3.9426 8.6669 118.2024 59.4953 29.8922 178.9178 20 A 4.0151 7.8624 119.8563 54.7800 18.3913 179.2905 21 L 3.8239 8.3519 119.3157 58.8869 42.1268 179.5459 22 T 4.1547 8.2778 115.7432 66.4377 68.4179 176.8481 23 R 4.1201 8.1219 120.7796 59.6757 30.1025 178.6621 24 R 4.0976 8.3430 118.6886 59.1007 29.9964 178.0968 25 F 4.0927 8.3258 120.6190 61.7651 39.3958 176.8845 26 Y 3.7121 7.8223 115.8507 60.4654 37.6831 177.8114 27 E 3.9054 8.1965 120.4341 59.4651 29.7455 178.8400 28 L 3.9360 8.0183 119.0661 58.1146 41.4208 179.3527 29 M 3.7871 7.4065 117.2246 58.2836 32.1720 177.2781 30 D 4.5053 8.0042 117.1811 55.7351 41.5602 176.6530 31 T 4.4348 7.3768 106.8620 61.6871 71.0714 174.3707 32 L 4.2567 8.0129 123.7684 53.3354 42.2105 176.1428 33 P 4.2985 0.0000 0.0000 65.3740 31.4935 178.0904 34 E 4.0631 8.2075 114.1108 57.9055 29.8552 177.5667 35 A 4.7125 7.7678 121.0737 51.9610 19.2671 177.8971 36 A 3.9380 7.6938 124.1988 56.1382 18.1396 180.8711 37 R 3.8422 7.9734 114.9322 59.6716 30.5026 178.3577 38 C 4.3155 8.5101 118.4122 62.4879 31.6279 175.5258 39 R 3.9777 8.4638 120.5623 59.3603 29.4313 178.3129 40 A 4.0730 8.0981 120.1513 54.4761 18.4259 178.6620 41 I 4.1257 7.2171 107.8093 61.0202 38.5582 175.8688 42 H 4.5955 7.2794 117.5169 54.1063 29.7124 173.3943 43 P 4.3593 0.0000 0.0000 62.5765 31.7589 176.7742 44 A 3.9934 8.6579 124.0286 54.5751 18.4913 177.3241 45 D 4.7262 7.8049 115.2695 52.8633 41.8656 176.5535 46 L 4.1837 8.3549 126.2498 55.7490 41.7811 178.9328 47 S 4.1701 8.8226 117.4588 61.7428 62.9551 176.8338 48 G 3.6537 7.9811 107.7045 47.6324 0.0000 175.8992 49 S 4.1724 7.8742 117.0198 61.3372 62.8415 176.1030 50 E 3.8937 7.8698 121.7179 59.1498 29.4042 178.4551 51 A 4.1781 7.9820 120.8048 55.4760 18.4539 179.8449 52 K 4.2562 8.1835 116.5188 59.7060 32.1941 179.5106 53 F 4.8636 8.8127 121.0839 61.5162 39.3185 176.4934 54 Y 4.1929 8.7332 119.4697 60.9975 38.6848 177.9659 55 D 4.1555 8.4833 119.7336 57.4022 40.8829 178.0964 56 Y 3.9325 8.8139 120.4292 60.8270 38.8169 178.2989 57 L 3.9525 8.5487 120.1766 57.7204 41.7127 179.3234 58 T 3.9457 7.9806 116.1814 66.6899 68.4299 176.6974 59 G 3.3299 7.6669 106.5651 48.0692 0.0000 174.7822 60 Y 3.9026 7.4227 121.4419 60.0675 38.8164 177.5697 61 L 4.3526 7.8808 117.4506 54.4524 41.8769 177.8998 62 G 3.9488 7.7984 107.5274 44.9608 0.0000 174.6295 63 G 2.6831 6.9079 108.6590 43.2121 0.0000 171.4955 64 P 4.1164 0.0000 0.0000 62.4532 32.0653 176.1628 65 P 4.5466 0.0000 0.0000 62.8342 28.0104 177.9162 66 V 3.6166 7.3768 119.5014 66.5777 32.0189 176.2586 67 Y 4.0244 7.9334 119.0446 60.6762 38.8813 177.7711 68 V 3.9280 7.9341 120.0599 65.4857 31.4897 176.9907 69 E 3.8758 7.8207 117.9071 59.4440 29.3805 178.7592 70 K 4.0437 7.4360 116.7681 58.7009 32.5853 178.0872 71 H 4.7226 7.9261 112.9185 56.3202 30.5181 176.3816 72 G 3.8114 8.7182 109.6373 45.0609 0.0000 172.3193 73 H 4.3468 8.7984 118.4327 55.6430 29.3098 173.1328 74 P 4.6483 0.0000 0.0000 66.0636 31.7851 177.4720 75 M 3.2903 8.2776 115.4524 55.8972 29.8157 178.7977 76 L 3.9907 7.8972 119.6710 57.9376 41.9025 178.9328 77 R 3.8050 7.8935 117.0049 59.4298 30.2879 177.9545 78 R 4.0244 7.9371 117.8437 59.7016 29.9288 178.6080 79 R 4.0149 7.8794 116.4454 59.2426 30.3326 178.1303 80 H 4.4067 8.6099 115.3488 57.1962 28.7419 177.0778 81 F 4.4691 7.6923 123.0423 60.3291 39.1758 176.2927 82 V 3.6539 7.8622 109.8644 62.7179 31.8546 175.6676 83 A 4.5373 7.4872 122.8288 49.4051 20.6577 175.0145 84 P 4.2712 0.0000 0.0000 62.0032 31.0156 176.1710 85 I 4.1438 8.0968 126.0560 59.6510 37.8585 175.5745 86 G 4.5842 8.7669 114.7052 42.4071 0.0000 170.1326 87 P 4.1405 0.0000 0.0000 65.5804 31.1624 178.6997 88 A 3.9749 7.8359 118.9454 55.2400 18.4468 179.3778 89 E 3.9533 8.0744 116.6764 59.3827 29.5934 179.3127 90 R 3.7255 7.9601 118.6460 59.7803 30.1328 178.4738 91 D 4.5082 8.4579 118.8031 57.1717 40.7615 178.6285 92 E 4.1257 8.4020 119.4503 58.6668 29.3602 179.0214 93 W 4.1111 8.3866 128.6920 60.6329 30.8294 178.0909 94 L 4.6081 8.4639 119.0203 57.7171 41.1651 179.0605 95 L 4.0639 8.5831 120.8519 58.7369 41.9539 179.0670 96 C 4.1751 8.0365 116.0107 62.6902 28.0464 175.9002 97 F 3.9457 8.7476 122.6386 61.0269 38.8354 177.1111 98 R 3.7733 8.5625 118.4816 59.5658 29.9310 178.5421 99 R 3.7795 7.9274 117.9786 59.2296 29.7135 178.2572 100 A 3.9291 8.2988 121.0280 55.2684 18.2620 179.5294 101 M 3.8474 7.7563 117.0452 58.7173 31.8536 178.6722 102 D 4.2762 7.8915 117.6085 57.3965 41.0549 178.3668 103 E 4.2223 7.9858 117.4866 57.7279 29.7633 177.2955 104 T 4.4194 7.3272 105.0937 60.6921 70.4404 173.7985 105 I 4.3291 7.7268 123.1205 59.2349 38.4392 174.8823 106 E 3.9137 8.7927 127.4580 58.7949 29.9800 177.0745 107 N 4.4851 8.0572 118.0153 52.9181 39.6712 174.9763 108 A 4.0061 8.6200 130.9802 55.2183 18.5488 178.9246 109 K 3.9618 8.1411 117.6460 59.5924 32.3636 178.9675 110 L 4.0639 8.2107 119.2987 57.7318 41.5192 179.6317 111 R 4.0112 8.1082 118.1620 59.2211 29.5105 178.7169 112 E 4.0970 8.4004 119.0977 59.4130 29.4454 178.7944 113 I 3.8329 7.7821 118.7950 64.6151 37.0001 178.1669 114 I 4.1440 8.0022 120.5291 63.8606 36.9954 178.2836 115 W 4.4090 8.6614 129.0679 60.4803 30.6750 177.6340 116 A 3.8792 7.8382 119.6096 55.0839 17.8713 178.0165 117 P 4.2219 0.0000 0.0000 65.4183 31.3746 179.1624 118 V 3.3940 7.4646 116.8209 65.8025 31.5229 177.7504 119 E 3.5053 7.8496 119.4694 58.9497 29.3348 178.7939 120 R 3.8347 7.7770 118.1485 59.3886 30.2482 178.9458 121 L 3.8594 7.7700 118.2514 57.6566 41.3286 179.4747 122 A 3.4104 7.5908 119.7433 55.0383 18.0130 179.4274 123 F 3.9085 8.1574 116.0881 60.7977 38.7351 177.3675 124 H 4.2619 8.0845 116.7603 58.9110 29.6861 176.6600 125 M 4.0436 7.3967 119.2052 56.0222 32.1829 176.6125 126 Q 3.9163 6.9809 119.9909 56.4009 29.3348 175.4792 127 N 5.0696 9.1526 120.3418 52.1361 38.4877 173.3603 128 Q 4.4286 7.4947 119.1485 55.9353 32.3429 174.3679 129 E 4.1345 8.9033 122.7084 56.7908 28.9578 174.3785 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 8.16 4.39 0.00 2.08 1.99 0.00 0.00 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.48 0.00 2 S 8.12 4.40 0.00 4.05 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 3 S 8.27 4.63 0.00 3.80 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 4 E 8.31 4.02 0.00 1.95 1.95 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 2.29 2.36 0.00 5 T 7.57 4.44 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 6 V 7.98 5.22 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 0.89 0.00 0.00 0.94 0.00 0.00 7 T 8.62 4.26 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 1.23 0.00 0.00 8 L 8.60 3.98 0.00 1.90 1.83 0.91 0.72 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 9 Y 8.31 4.16 0.00 3.07 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 10 E 8.33 3.90 0.00 2.28 2.01 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 2.39 2.46 0.00 11 A 8.15 4.03 1.38 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 0.00 0.00 0.00 12 I 7.56 4.14 1.85 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.58 0.93 0.00 0.00 13 G 7.90 4.02 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 0.00 14 G 8.05 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.52 4.36 0.00 2.96 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 16 A 8.07 4.06 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 17 T 7.70 3.87 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 18 V 7.85 3.71 2.27 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 1.22 0.00 0.00 1.10 0.00 0.00 19 R 8.67 3.94 0.00 2.11 1.95 0.00 3.13 0.00 0.00 2.98 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 2.03 0.00 20 A 7.86 4.02 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 21 L 8.35 3.82 0.00 1.75 1.89 0.52 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 22 T 8.28 4.15 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 1.83 0.00 0.00 23 R 8.12 4.12 0.00 2.08 2.15 0.00 3.16 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.72 0.00 24 R 8.34 4.10 0.00 2.03 1.95 0.00 3.33 0.00 0.00 3.09 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.66 0.00 25 F 8.33 4.09 0.00 3.08 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 26 Y 7.82 3.71 0.00 3.10 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 0.00 27 E 8.20 3.91 0.00 2.23 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 0.00 2.29 2.36 0.00 28 L 8.02 3.94 0.00 1.71 1.62 0.89 1.05 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 29 M 7.41 3.79 0.00 1.82 1.45 0.00 0.00 0.00 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.38 0.00 30 D 8.00 4.51 0.00 2.85 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 31 T 7.38 4.43 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 1.23 0.00 0.00 32 L 8.01 4.26 0.00 1.74 1.75 0.89 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 33 P 0.00 4.30 0.00 2.17 2.09 0.00 3.58 0.00 0.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.06 0.00 34 E 8.21 4.06 0.00 2.08 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 2.27 2.25 0.00 35 A 7.77 4.71 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 36 A 7.69 3.94 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 37 R 7.97 3.84 0.00 2.18 2.15 0.00 3.27 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.75 0.00 38 C 8.51 4.32 0.00 3.20 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 39 R 8.46 3.98 0.00 2.14 2.06 0.00 3.21 0.00 0.00 3.27 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.69 0.00 40 A 8.10 4.07 1.38 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 0.00 0.00 0.00 41 I 7.22 4.13 1.84 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 0.79 0.90 0.00 0.00 42 H 7.28 4.60 0.00 3.37 3.34 0.00 5.86 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 P 0.00 4.36 0.00 2.25 2.00 0.00 3.77 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.09 0.00 44 A 8.66 3.99 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 45 D 7.80 4.73 0.00 2.63 2.58 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 46 L 8.35 4.18 0.00 1.68 1.49 0.99 0.97 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 47 S 8.82 4.17 0.00 3.84 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 48 G 7.98 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 49 S 7.87 4.17 0.00 3.64 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 50 E 7.87 3.89 0.00 1.69 2.01 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 2.38 2.59 0.00 51 A 7.98 4.18 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.18 4.26 0.00 2.19 2.18 0.00 1.71 0.00 0.00 1.55 0.00 0.00 3.16 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.52 1.71 7.81 53 F 8.81 4.86 0.00 3.57 3.52 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 54 Y 8.73 4.19 0.00 3.24 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 55 D 8.48 4.16 0.00 3.23 2.99 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 0.00 0.00 0.00 56 Y 8.81 3.93 0.00 2.83 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 57 L 8.55 3.95 0.00 1.61 1.67 0.39 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 58 T 7.98 3.95 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 0.97 0.00 0.00 59 G 7.67 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 0.00 0.00 0.00 60 Y 7.42 3.90 0.00 2.17 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 61 L 7.88 4.35 0.00 1.97 1.81 1.09 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 62 G 7.80 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 0.00 0.00 0.00 63 G 6.91 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 0.00 0.00 0.00 64 P 0.00 4.12 0.00 2.09 2.00 0.00 3.06 0.00 0.00 3.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.89 0.00 65 P 0.00 4.55 0.00 2.26 2.22 0.00 3.62 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.97 0.00 66 V 7.38 3.62 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 1.08 0.00 0.00 0.95 0.00 0.00 67 Y 7.93 4.02 0.00 3.33 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 68 V 7.93 3.93 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 1.16 0.00 0.00 1.17 0.00 0.00 69 E 7.82 3.88 0.00 2.19 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 0.00 2.30 2.36 0.00 70 K 7.44 4.04 0.00 1.06 1.43 0.00 1.80 0.00 0.00 1.64 0.00 0.00 3.07 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.35 1.56 7.81 71 H 7.93 4.72 0.00 2.42 3.08 0.00 5.71 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 G 8.72 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 73 H 8.80 4.35 0.00 3.24 3.34 0.00 5.73 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 P 0.00 4.65 0.00 2.19 2.26 0.00 4.02 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.42 0.00 75 M 8.28 3.29 0.00 2.17 2.14 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 2.65 2.70 0.00 76 L 7.90 3.99 0.00 1.58 1.60 0.42 0.54 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 77 R 7.89 3.81 0.00 1.74 1.93 0.00 3.12 0.00 0.00 3.01 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.64 0.00 78 R 7.94 4.02 0.00 1.87 2.01 0.00 3.21 0.00 0.00 3.34 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.74 0.00 79 R 7.88 4.01 0.00 1.95 1.96 0.00 3.60 0.00 0.00 3.34 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.90 0.00 80 H 8.61 4.41 0.00 3.24 3.27 0.00 5.82 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 F 7.69 4.47 0.00 3.08 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 82 V 7.86 3.65 2.05 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 0.77 0.00 0.00 0.93 0.00 0.00 83 A 7.49 4.54 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 84 P 0.00 4.27 0.00 2.12 2.01 0.00 3.66 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.91 0.00 85 I 8.10 4.14 1.78 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.76 0.78 0.00 0.00 86 G 8.77 4.58 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 87 P 0.00 4.14 0.00 2.14 2.09 0.00 3.57 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.14 0.00 88 A 7.84 3.97 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 89 E 8.07 3.95 0.00 2.04 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 0.00 2.50 2.59 0.00 90 R 7.96 3.73 0.00 1.65 1.97 0.00 2.21 0.00 0.00 2.72 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 1.32 0.00 91 D 8.46 4.51 0.00 2.73 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 92 E 8.40 4.13 0.00 2.17 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 0.00 2.48 2.45 0.00 93 W 8.39 4.11 0.00 3.61 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 94 L 8.46 4.61 0.00 2.23 2.26 1.02 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 95 L 8.58 4.06 0.00 1.91 1.97 0.95 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 96 C 8.04 4.18 0.00 2.78 2.69 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 0.00 0.00 0.00 0.00 97 F 8.75 3.95 0.00 2.35 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 98 R 8.56 3.77 0.00 1.97 1.97 0.00 2.21 0.00 0.00 2.81 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.80 0.00 99 R 7.93 3.78 0.00 1.93 1.88 0.00 3.12 0.00 0.00 3.14 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.60 0.00 100 A 8.30 3.93 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 0.00 101 M 7.76 3.85 0.00 1.99 2.12 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.20 0.00 102 D 7.89 4.28 0.00 2.69 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 0.00 103 E 7.99 4.22 0.00 2.01 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 2.30 2.26 0.00 104 T 7.33 4.42 4.21 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 1.25 0.00 0.00 105 I 7.73 4.33 1.94 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 1.16 0.64 0.91 0.00 0.00 106 E 8.79 3.91 0.00 1.90 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 2.28 0.00 107 N 8.06 4.49 0.00 2.79 2.70 0.00 0.00 7.08 8.09 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 0.00 108 A 8.62 4.01 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 0.00 109 K 8.14 3.96 0.00 1.89 1.96 0.00 1.76 0.00 0.00 1.83 0.00 0.00 3.06 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.52 1.62 7.81 110 L 8.21 4.06 0.00 1.93 1.73 0.94 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 111 R 8.11 4.01 0.00 2.04 2.00 0.00 3.07 0.00 0.00 3.34 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.81 0.00 112 E 8.40 4.10 0.00 2.11 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 2.40 2.44 0.00 113 I 7.78 3.83 2.06 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 1.56 0.70 0.96 0.00 0.00 114 I 8.00 4.14 2.12 0.00 0.00 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 1.60 1.21 1.29 0.00 0.00 115 W 8.66 4.41 0.00 3.63 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 0.00 116 A 7.84 3.88 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 0.00 117 P 0.00 4.22 0.00 2.32 2.18 0.00 3.85 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.17 0.00 118 V 7.46 3.39 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 0.66 0.00 0.00 0.90 0.00 0.00 119 E 7.85 3.51 0.00 1.16 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 2.20 2.37 0.00 120 R 7.78 3.83 0.00 2.02 1.89 0.00 3.13 0.00 0.00 3.12 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.70 0.00 121 L 7.77 3.86 0.00 1.63 1.43 0.78 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 122 A 7.59 3.41 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 0.00 123 F 8.16 3.91 0.00 3.06 3.08 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 0.00 124 H 8.08 4.26 0.00 3.22 3.41 0.00 5.94 0.00 0.00 0.00 0.00 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 M 7.40 4.04 0.00 1.65 1.77 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 1.89 2.49 0.00 126 Q 6.98 3.92 0.00 1.83 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.99 0.00 0.00 0.00 0.00 0.00 2.30 2.31 0.00 127 N 9.15 5.07 0.00 2.98 3.04 0.00 0.00 6.02 7.67 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 0.00 128 Q 7.49 4.43 0.00 2.04 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 5.76 0.00 0.00 0.00 0.00 0.00 2.28 2.31 0.00 129 E 8.90 4.13 0.00 2.14 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 2.16 2.26 0.00