NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4254 8.3001 118.1955 52.9483 31.8474 175.2262 2 A 5.3867 6.9065 135.0000 53.1628 21.5159 177.0777 3 K 4.4127 7.2881 122.5667 55.4354 33.7027 171.4512 4 E 4.7305 8.1804 124.1023 54.1699 28.2651 174.4928 5 F 5.2957 8.0550 124.9934 56.2858 43.0789 174.1646 6 G 3.8534 8.5537 108.5674 45.6079 0.0000 174.0603 7 R 4.1433 7.2020 120.0056 54.5846 31.3268 174.9427 8 P 4.5561 0.0000 0.0000 64.1990 31.1371 177.6221 9 Q 4.1225 7.8216 120.5988 59.1629 29.2260 176.9016 10 R 4.7040 7.9879 120.4439 58.9822 30.0514 178.5442 11 V 3.6061 7.8491 117.8372 65.1062 31.1403 177.8812 12 A 3.9872 7.6872 119.7559 55.2674 18.0749 179.2818 13 Q 3.9823 8.3639 116.8808 58.7120 28.8717 178.2707 14 E 3.8789 8.5425 119.3653 60.2148 29.6140 179.6544 15 M 4.0794 8.3420 117.9647 58.5433 32.2631 178.0858 16 Q 3.9297 8.3522 120.3707 58.8600 29.2112 178.3193 17 K 4.0200 8.8237 120.5253 59.7484 32.8305 178.9558 18 E 3.9613 8.2459 120.8217 58.9756 29.5361 178.8422 19 I 3.8571 8.5247 113.5374 63.8954 37.6623 178.0372 20 A 4.0219 8.3451 122.9797 54.7055 18.0556 179.3395 21 L 3.9072 8.0993 118.9635 58.5027 42.4907 179.2972 22 I 3.6460 8.0094 119.4684 63.7120 36.7942 177.7121 23 L 4.4483 8.0872 120.4426 56.5028 42.1880 177.3633 24 Q 4.6293 7.6888 115.1653 55.9179 29.9520 176.1026 25 R 4.4795 8.4738 118.5318 57.7780 31.6387 178.0974 26 E 3.8052 7.9731 115.8162 58.6929 29.8623 177.0073 27 I 4.1473 7.0281 119.7546 60.2966 39.0830 176.2235 28 K 4.4308 8.2123 120.7678 55.6015 31.2298 176.1755 29 D 4.5570 8.0279 126.1836 57.0892 41.7874 176.5031 30 P 4.3638 0.0000 0.0000 65.0522 31.7438 177.9877 31 R 4.1393 7.9565 116.5794 57.6498 30.3595 176.8671 32 L 4.5451 7.2276 117.0432 53.6308 41.9486 176.5452 33 G 4.1186 7.6462 105.3269 46.0765 0.0000 173.7111 34 M 4.7976 7.7685 116.7439 53.8324 36.4415 174.1893 35 M 4.7557 8.6999 120.2949 53.4984 33.7262 175.8363 36 T 4.4421 8.1996 116.1475 61.1866 71.0733 173.4148 37 T 4.5578 8.2328 117.5900 61.9606 73.4291 173.5115 38 V 4.7285 8.0127 122.0579 59.5957 31.3388 174.5792 39 S 4.5731 7.8535 120.9372 57.4163 63.2580 173.8332 40 G 4.4488 7.7020 102.4735 45.4348 0.0000 173.6075 41 V 4.8996 8.4201 122.7514 60.5162 34.6155 173.3655 42 E 4.6970 9.3891 123.4857 55.1037 33.9877 174.2181 43 M 4.8358 8.7234 123.1862 53.7431 35.3820 174.9500 44 S 4.2982 8.4453 120.4715 56.6749 63.3533 174.5466 45 R 4.3498 8.2726 125.8949 56.1165 30.8125 178.1313 46 D 4.4600 7.8543 117.6973 56.8254 40.4227 176.1842 47 L 4.6121 7.4364 116.7290 53.2392 47.2536 176.1168 48 A 5.5386 7.2311 135.0000 52.2135 20.1300 175.3861 49 Y 5.2846 7.4651 120.5003 55.4142 42.3073 175.7990 50 A 5.0313 8.9415 123.6849 50.4727 23.9404 175.1348 51 K 4.7962 9.3623 118.5521 55.2484 36.2541 176.0723 52 V 4.6856 8.8316 125.4553 60.0094 34.2535 174.1121 53 Y 5.3743 8.7688 123.9021 56.1101 41.7896 174.6535 54 V 4.4579 9.5068 125.3692 61.6826 35.3248 173.2300 55 T 5.4531 8.3576 122.7906 59.7645 69.5299 173.0484 56 F 5.1628 8.9963 125.5786 55.4457 43.7515 174.9394 57 L 4.6628 8.3422 118.5779 55.0875 42.0908 177.7069 58 N 4.3657 8.3604 117.3703 55.8426 38.9391 176.4279 59 D 4.1135 8.4354 117.5228 57.3094 41.4435 178.5366 60 K 3.8872 7.9910 117.6930 59.0843 32.3186 177.1189 61 D 4.8427 8.9352 119.5607 51.7471 44.1281 176.4816 62 E 3.9654 8.8024 125.0224 58.6374 29.7685 178.0816 63 D 4.3087 8.0102 117.8225 57.1857 41.4222 177.5730 64 A 4.1357 7.8101 120.6802 54.2210 18.6745 179.8214 65 V 3.5114 7.9429 118.6647 64.6643 31.7078 178.6253 66 K 3.8204 8.1115 120.1502 59.0137 31.9459 178.6681 67 A 3.9991 7.8709 119.7164 55.2904 18.6292 179.1400 68 G 3.7555 8.0023 104.1518 48.3943 0.0000 175.2101 69 I 3.2503 7.7000 121.2016 63.4265 37.9089 178.1422 70 K 3.8759 7.9517 118.8671 59.3323 31.8158 179.1600 71 A 3.9912 8.1594 121.5480 54.9067 18.1042 179.3904 72 L 4.0214 7.5202 117.3304 57.7799 42.4994 178.7778 73 Q 4.1910 8.1902 119.1742 58.8358 28.5262 178.1843 74 E 4.0628 8.0938 117.2776 58.9600 29.8608 177.9803 75 A 4.7338 7.9288 119.9414 52.8790 18.6252 178.5462 76 S 4.0152 8.1763 113.7026 62.0044 62.1532 176.1381 77 G 3.7356 8.0732 109.0658 47.6513 0.0000 175.0628 78 F 4.1958 7.9444 119.9317 60.4646 39.0964 177.6188 79 I 3.7983 8.0309 113.2726 63.8108 37.4276 178.3491 80 R 3.8357 8.0743 120.6013 59.2972 30.0081 178.5298 81 S 4.1203 8.1907 113.1921 61.1711 62.3911 175.7956 82 L 4.0557 8.4954 123.5358 58.0312 41.6595 178.8316 83 L 4.0791 8.1679 119.4340 57.4304 41.6621 179.1667 84 G 3.9649 8.2088 105.4486 48.3105 0.0000 175.6324 85 K 4.0294 8.2675 120.5739 58.9604 31.9062 179.3854 86 A 4.1189 8.2707 120.5231 54.4574 18.2621 178.0804 87 M 4.3423 8.2647 115.3829 55.8004 32.6355 178.0730 88 R 3.5760 7.1425 113.5797 57.3528 27.2585 175.8722 89 L 5.0246 8.1623 129.8130 54.0257 44.1091 175.6470 90 R 4.6916 8.6992 107.8396 57.8620 34.5205 176.3645 91 I 3.4001 8.4124 111.0734 63.5283 37.9465 176.6998 92 V 3.1696 7.3654 118.7164 63.1778 29.1497 171.5378 93 P 4.5463 0.0000 0.0000 62.4151 33.2982 177.3713 94 E 4.2595 8.6313 121.2466 56.6297 26.7423 176.9313 95 L 4.7424 7.6833 122.0866 54.8667 41.6056 176.7896 96 T 4.1257 9.0802 120.6841 61.6161 69.1974 172.5595 97 F 5.0427 8.5676 127.2461 56.5214 41.1196 174.1255 98 F 3.9400 8.9684 126.7633 56.4148 40.2885 174.9027 99 Y 5.3783 7.7612 122.4514 57.1367 38.7807 175.1172 100 D 4.8738 9.6704 126.9109 53.0541 41.2509 175.4329 101 N 5.4653 8.6340 122.0826 50.6538 41.7266 174.9720 102 S 4.6236 8.5938 114.9518 59.0019 63.1655 174.6591 103 L 5.1682 7.7699 119.8400 54.8216 42.0733 176.4672 104 V 4.5477 7.5703 113.7916 63.1061 33.3215 174.6203 105 E 4.6302 8.1454 115.3384 56.9129 35.8229 177.0817 106 G 4.5059 8.4250 104.7331 44.6089 0.0000 173.3021 107 M 4.7560 7.4551 117.5460 55.0053 33.0595 175.9181 108 R 4.1851 8.0376 123.4939 56.3631 30.5857 176.1131 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 4.43 0.00 2.13 2.19 0.00 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.61 0.00 2 A 6.91 5.39 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 3 K 7.29 4.41 0.00 1.76 1.70 0.00 1.76 0.00 0.00 1.80 0.00 0.00 3.26 0.00 0.00 3.27 0.00 0.00 0.00 0.00 1.45 1.42 7.81 4 E 8.18 4.73 0.00 1.96 1.85 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 2.28 2.30 0.00 5 F 8.05 5.30 0.00 2.89 2.75 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 6 G 8.55 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 7 R 7.20 4.14 0.00 1.69 1.82 0.00 2.88 0.00 0.00 2.69 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.54 0.00 8 P 0.00 4.56 0.00 2.24 2.25 0.00 3.63 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.98 0.00 9 Q 7.82 4.12 0.00 2.23 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.93 0.00 0.00 0.00 0.00 0.00 2.45 2.50 0.00 10 R 7.99 4.70 0.00 2.09 1.89 0.00 3.40 0.00 0.00 3.34 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.89 0.00 11 V 7.85 3.61 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 0.79 0.00 0.00 0.93 0.00 0.00 12 A 7.69 3.99 1.42 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 0.00 0.00 13 Q 8.36 3.98 0.00 2.30 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.64 6.62 0.00 0.00 0.00 0.00 0.00 2.61 2.63 0.00 14 E 8.54 3.88 0.00 1.99 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 0.00 2.36 2.52 0.00 15 M 8.34 4.08 0.00 2.14 2.29 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.60 0.00 16 Q 8.35 3.93 0.00 2.36 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.59 0.00 0.00 0.00 0.00 0.00 2.38 2.53 0.00 17 K 8.82 4.02 0.00 1.99 2.06 0.00 1.37 0.00 0.00 1.74 0.00 0.00 2.90 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.60 1.45 7.81 18 E 8.25 3.96 0.00 2.31 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 0.00 2.32 2.38 0.00 19 I 8.52 3.86 1.97 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 1.68 1.08 0.96 0.00 0.00 20 A 8.35 4.02 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 21 L 8.10 3.91 0.00 1.81 1.92 0.93 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 22 I 8.01 3.65 1.93 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 1.43 0.93 0.95 0.00 0.00 23 L 8.09 4.45 0.00 1.93 1.93 0.87 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 24 Q 7.69 4.63 0.00 2.16 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.51 0.00 0.00 0.00 0.00 0.00 2.29 2.36 0.00 25 R 8.47 4.48 0.00 1.97 1.93 0.00 3.14 0.00 0.00 3.23 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.61 0.00 26 E 7.97 3.81 0.00 2.09 2.17 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 2.28 2.43 0.00 27 I 7.03 4.15 2.10 0.00 0.00 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 1.53 1.05 1.07 0.00 0.00 28 K 8.21 4.43 0.00 1.93 1.94 0.00 1.53 0.00 0.00 1.75 0.00 0.00 2.86 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.45 1.34 7.81 29 D 8.03 4.56 0.00 2.77 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 30 P 0.00 4.36 0.00 2.27 2.30 0.00 3.69 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.00 0.00 31 R 7.96 4.14 0.00 1.83 2.02 0.00 3.15 0.00 0.00 3.21 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.55 0.00 32 L 7.23 4.55 0.00 1.93 1.70 0.98 0.99 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 33 G 7.65 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 34 M 7.77 4.80 0.00 2.07 2.06 0.00 0.00 0.00 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.75 2.51 0.00 35 M 8.70 4.76 0.00 1.95 1.95 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.46 0.00 36 T 8.20 4.44 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 1.45 0.00 0.00 37 T 8.23 4.56 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 1.13 0.00 0.00 38 V 8.01 4.73 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 1.12 0.00 0.00 0.88 0.00 0.00 39 S 7.85 4.57 0.00 3.67 3.60 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 0.00 0.00 0.00 40 G 7.70 4.45 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 41 V 8.42 4.90 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 0.66 0.00 0.00 0.96 0.00 0.00 42 E 9.39 4.70 0.00 2.11 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 0.00 2.24 2.44 0.00 43 M 8.72 4.84 0.00 1.78 1.91 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.56 0.00 44 S 8.45 4.30 0.00 2.93 2.63 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 45 R 8.27 4.35 0.00 1.87 1.87 0.00 3.20 0.00 0.00 3.25 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.60 0.00 46 D 7.85 4.46 0.00 2.67 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 47 L 7.44 4.61 0.00 1.94 1.77 1.02 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 0.00 0.00 0.00 0.00 0.00 0.00 48 A 7.23 5.54 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 49 Y 7.47 5.28 0.00 3.06 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 50 A 8.94 5.03 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 51 K 9.36 4.80 0.00 1.66 1.77 0.00 1.74 0.00 0.00 1.77 0.00 0.00 2.98 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.47 1.47 7.81 52 V 8.83 4.69 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 1.03 0.00 0.00 0.97 0.00 0.00 53 Y 8.77 5.37 0.00 2.96 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 54 V 9.51 4.46 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 0.58 0.00 0.00 0.26 0.00 0.00 55 T 8.36 5.45 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 1.00 0.00 0.00 56 F 9.00 5.16 0.00 2.99 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 57 L 8.34 4.66 0.00 1.74 1.64 0.94 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 58 N 8.36 4.37 0.00 2.84 2.85 0.00 0.00 6.62 8.07 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 59 D 8.44 4.11 0.00 2.80 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 60 K 7.99 3.89 0.00 1.98 1.92 0.00 1.70 0.00 0.00 1.71 0.00 0.00 3.05 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.50 1.48 7.81 61 D 8.94 4.84 0.00 2.64 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 62 E 8.80 3.97 0.00 2.03 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 2.38 2.37 0.00 63 D 8.01 4.31 0.00 2.82 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 64 A 7.81 4.14 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 65 V 7.94 3.51 2.43 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 0.83 0.00 0.00 0.93 0.00 0.00 66 K 8.11 3.82 0.00 1.99 1.81 0.00 1.81 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.41 1.43 7.81 67 A 7.87 4.00 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 68 G 8.00 3.76 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 0.00 0.00 0.00 69 I 7.70 3.25 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 0.52 0.83 0.83 0.00 0.00 70 K 7.95 3.88 0.00 2.07 1.78 0.00 1.76 0.00 0.00 1.61 0.00 0.00 3.03 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.42 1.45 7.81 71 A 8.16 3.99 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 72 L 7.52 4.02 0.00 1.49 1.58 1.16 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 73 Q 8.19 4.19 0.00 2.23 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.51 6.65 0.00 0.00 0.00 0.00 0.00 2.47 2.17 0.00 74 E 8.09 4.06 0.00 2.17 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 0.00 2.49 2.37 0.00 75 A 7.93 4.73 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 76 S 8.18 4.02 0.00 4.08 3.82 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 77 G 8.07 3.74 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 0.00 0.00 0.00 78 F 7.94 4.20 0.00 3.05 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 79 I 8.03 3.80 1.56 0.00 0.00 -1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.54 0.82 0.00 0.00 80 R 8.07 3.84 0.00 1.88 1.93 0.00 3.09 0.00 0.00 3.09 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.64 0.00 81 S 8.19 4.12 0.00 3.94 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 82 L 8.50 4.06 0.00 1.98 1.88 1.01 0.75 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 83 L 8.17 4.08 0.00 1.96 1.71 0.99 0.87 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 84 G 8.21 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 85 K 8.27 4.03 0.00 2.06 1.88 0.00 1.69 0.00 0.00 1.66 0.00 0.00 3.00 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.46 1.46 7.81 86 A 8.27 4.12 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 87 M 8.26 4.34 0.00 1.91 2.07 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 2.56 2.48 0.00 88 R 7.14 3.58 0.00 1.90 2.26 0.00 3.11 0.00 0.00 3.15 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.72 0.00 89 L 8.16 5.02 0.00 1.56 1.46 0.96 0.91 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 90 R 8.70 4.69 0.00 1.90 1.95 0.00 3.13 0.00 0.00 3.27 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.61 0.00 91 I 8.41 3.40 1.84 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 1.28 0.57 0.89 0.00 0.00 92 V 7.37 3.17 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 0.81 0.00 0.00 0.91 0.00 0.00 93 P 0.00 4.55 0.00 2.08 1.95 0.00 3.82 0.00 0.00 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.89 0.00 94 E 8.63 4.26 0.00 2.29 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 2.32 2.28 0.00 95 L 7.68 4.74 0.00 1.86 1.67 0.94 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 96 T 9.08 4.13 4.20 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 1.07 0.00 0.00 97 F 8.57 5.04 0.00 2.98 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 98 F 8.97 3.94 0.00 2.80 2.46 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 99 Y 7.76 5.38 0.00 3.00 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 0.00 100 D 9.67 4.87 0.00 2.60 2.35 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 0.00 101 N 8.63 5.47 0.00 2.74 3.02 0.00 0.00 7.31 7.59 0.00 0.00 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 S 8.59 4.62 0.00 4.26 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 0.00 103 L 7.77 5.17 0.00 1.70 1.74 0.97 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 104 V 7.57 4.55 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 0.92 0.00 0.00 1.01 0.00 0.00 105 E 8.15 4.63 0.00 2.01 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 2.32 0.00 106 G 8.42 4.51 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 M 7.46 4.76 0.00 2.09 2.01 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.45 0.00 108 R 8.04 4.19 0.00 1.89 1.82 0.00 3.24 0.00 0.00 3.35 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.55 0.00