NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 S 4.4010 8.1933 115.2905 58.3303 64.4025 174.8633 2 N 4.5553 7.9365 116.5022 52.9486 37.6518 174.4473 3 I 3.9643 8.3781 120.6884 62.8307 39.6477 175.4356 4 I 4.2288 7.0449 120.2011 60.8976 38.8228 174.1759 5 K 4.1433 8.8347 125.2451 58.4841 32.0529 178.1382 6 Q 3.7955 7.6857 118.0027 58.4283 28.7186 177.5333 7 L 4.1029 7.0828 119.6075 58.3200 42.4736 177.5410 8 E 3.9866 8.2076 118.9620 58.1898 29.3642 178.4660 9 Q 3.4480 9.2183 119.0784 59.8646 28.4443 179.0239 10 E 4.0599 7.5995 119.1004 58.2110 29.6674 176.9609 11 Q 4.5272 8.6244 115.4021 55.5220 30.8578 175.5535 12 M 3.9354 7.7102 119.2043 54.8219 32.4578 176.1172 13 K 4.4508 8.4108 122.3018 56.1249 34.4092 176.3508 14 Q 4.5345 8.3509 117.9242 55.9074 29.3517 176.3184 15 D 4.3616 8.0267 119.4304 56.8558 41.5432 177.1909 16 V 3.4701 7.7674 112.1494 61.4021 32.0572 173.9792 17 P 4.6370 0.0000 0.0000 61.5580 33.3996 175.2437 18 S 4.1693 8.4325 112.1129 59.3303 62.7637 174.5250 19 F 5.3252 8.4399 127.2271 56.7918 42.2019 173.5381 20 R 4.6526 8.4120 125.9749 53.7297 33.0531 173.0873 21 P 4.6426 0.0000 0.0000 59.9332 29.2102 176.4998 22 G 5.0135 7.6265 127.0700 47.6007 0.0000 169.7525 23 D 4.6820 7.0612 121.0829 54.7625 41.6933 177.3073 24 T 4.0595 9.2759 116.8672 65.7170 69.2188 175.3508 25 V 3.1868 7.7804 116.8570 61.2948 31.2106 171.8243 26 E 4.8744 8.1197 121.0748 54.9701 31.7053 173.7783 27 V 4.1601 8.5028 127.1256 62.1163 33.3166 174.5709 28 K 4.9467 8.9186 126.7803 54.8782 34.5626 175.4536 29 V 5.3982 8.5923 118.6137 58.0344 35.3256 175.3840 30 W 5.6915 9.0893 124.2634 56.7701 28.8510 176.5674 31 V 3.8089 8.8049 126.2719 62.8789 31.5960 179.0391 32 V 3.6110 8.0285 121.1050 60.9801 32.2249 173.5648 33 E 3.5941 7.8289 120.9025 56.9780 32.0645 173.7417 34 G 3.6852 8.9381 107.4748 46.1181 0.0000 174.4234 35 S 4.1961 9.1867 116.2585 61.1903 64.0371 175.0003 36 K 4.2136 7.6749 118.1992 56.6547 33.5217 175.8622 37 K 4.5595 7.4789 117.8006 57.1903 34.0952 173.3735 38 R 4.7543 7.6718 126.4139 55.4933 33.2643 174.7611 39 L 5.2882 8.5361 118.2887 53.2581 45.0983 175.6959 40 Q 4.6527 9.7935 126.8453 54.4246 30.9362 175.3393 41 A 4.8402 8.6347 128.0261 50.8253 19.9255 176.6977 42 F 4.7079 7.8190 114.0917 57.8452 39.7730 173.7683 43 E 4.3276 8.3547 119.6747 55.8465 30.3982 176.7972 44 G 4.2763 8.9334 112.5322 45.1064 0.0000 175.8636 45 V 4.6760 8.3749 126.4221 61.8218 33.8796 170.6421 46 V 4.0036 8.4314 128.3115 63.2148 31.6950 175.5824 47 I 4.4190 8.1638 115.4741 60.4213 39.5107 174.6584 48 A 4.4136 7.4727 121.2819 51.1557 21.8796 175.1726 49 I 4.7320 7.9836 119.5147 59.6287 42.5676 173.5484 50 R 3.9051 7.8862 113.5662 56.5392 29.0810 177.3418 51 N 4.2806 10.2380 106.6681 53.1458 34.1416 174.5519 52 R 4.6385 8.5093 117.3543 55.4661 33.3707 176.7914 53 G 4.0237 8.1974 107.7250 45.9507 0.0000 176.4097 54 L 3.7571 8.6294 123.6755 57.6096 41.9798 176.6601 55 H 4.8791 7.3627 115.8948 54.6811 29.5510 174.6079 56 S 4.6175 8.1136 117.6238 57.8272 66.5790 174.0935 57 A 5.8861 8.2408 124.2951 49.9468 22.3994 176.2970 58 F 4.6307 9.0978 115.4467 59.7962 40.6415 175.9098 59 T 3.2871 8.0122 122.3498 63.4570 64.8712 170.2065 60 V 4.7687 8.6348 124.7116 60.9083 35.0388 173.8231 61 R 5.0061 8.5884 125.2640 54.9487 31.3373 174.5515 62 K 4.0671 8.8108 123.4796 57.0795 33.7170 176.3218 63 I 3.2929 7.4463 115.4867 62.3641 33.7507 173.8806 64 S 4.2608 7.5259 117.6774 57.6398 63.4074 171.7929 65 N 4.0545 8.6708 119.2272 55.8351 38.3010 174.5983 66 G 3.9540 8.8014 119.8651 43.1707 0.0000 172.7955 67 E 4.6528 8.3126 118.2101 53.7334 33.9249 175.9653 68 G 3.9768 8.5859 107.9855 46.4816 0.0000 173.8231 69 V 4.8340 8.2119 112.3186 59.6382 36.4745 174.0513 70 E 5.8651 8.7339 121.1490 53.7989 33.2247 175.7461 71 R 4.0571 8.3019 122.5422 54.9633 33.2420 174.3500 72 V 4.4015 8.1157 121.2663 60.2070 31.9957 175.7301 73 F 4.2211 8.4543 125.5941 56.1481 40.2762 177.5549 74 Q 4.8719 8.7697 121.8800 56.8684 27.6444 182.1289 75 T 2.6908 6.9311 109.5025 64.0250 69.9276 172.9037 76 H 4.2916 7.6973 117.5703 56.8816 29.2046 175.1960 77 S 4.5861 8.1335 116.0108 55.9832 63.5877 173.1088 78 P 3.8540 0.0000 0.0000 65.8317 31.4126 178.7060 79 V 3.3258 7.6757 111.0009 64.1596 31.6793 178.5212 80 V 3.1539 7.9922 119.0877 62.7050 31.1855 176.5821 81 D 4.0822 7.5064 117.4196 54.0969 41.8059 172.9460 82 S 4.6480 6.5260 107.5132 56.5859 67.1676 172.7071 83 I 4.7644 8.1318 126.0396 58.7176 39.7371 176.5538 84 S 4.7461 8.9893 128.0880 57.9370 64.0184 174.9186 85 V 4.3924 8.9442 121.4575 62.8531 38.0382 175.3743 86 K 3.6962 7.9661 118.6339 56.5478 32.2401 173.8465 87 R 3.9662 8.4481 125.2109 57.4796 30.5953 176.3407 88 R 5.0546 8.4100 121.0816 54.6725 32.1301 175.6929 89 G 3.9635 8.0977 105.2668 44.9492 0.0000 171.1360 90 A 4.7702 8.3783 122.6049 50.4447 21.0139 176.6308 91 V 4.1105 8.0578 119.9670 63.1760 34.3130 175.7004 92 R 3.7331 7.9595 116.2476 56.1414 27.7957 174.3481 93 K 4.2101 7.3404 115.0053 56.2933 35.4092 173.9696 94 A 4.3479 8.7893 125.2144 53.5629 19.6260 177.8967 95 K 4.4727 7.7741 113.1186 54.6992 35.4716 177.3042 96 L 4.6853 8.8734 125.9019 53.8972 40.6246 177.1098 97 Y 4.4245 7.3752 117.6588 60.1208 38.9129 177.6434 98 Y 4.4661 8.2576 114.8126 57.6795 37.6289 176.1164 99 L 4.2375 6.9208 118.9798 55.2333 42.6482 177.3511 100 R 3.6315 7.4971 117.2151 59.4259 30.4283 176.5602 101 E 4.3683 7.8085 126.5613 56.0675 29.4670 175.3321 102 R 4.6594 8.4317 121.7849 57.6951 37.7400 175.6731 103 T 3.4966 7.8458 115.3467 62.1709 67.8632 171.6922 104 G 4.1401 8.4145 111.7414 46.6852 0.0000 173.9597 105 K 4.1484 8.7178 123.3294 57.3761 30.9109 177.3390 106 A 4.2810 7.7976 118.3043 53.3874 19.2924 177.7482 107 A 4.2766 7.9784 117.4501 52.9839 19.3488 177.9708 108 R 3.8723 7.8621 114.3672 56.8926 30.5186 175.6186 109 I 4.6322 8.0178 114.6465 58.8967 40.7968 174.9180 110 K 4.3942 8.4357 124.6583 55.9962 34.2578 174.5934 111 E 4.5388 8.3703 121.0781 55.7945 30.9143 175.4753 112 R 3.6968 9.0461 123.6225 55.0306 29.5891 173.1584 113 L 3.5416 8.6540 123.2604 54.5527 44.0589 173.3711 114 N 4.5448 8.7421 121.5762 53.5513 38.6547 174.9308 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 S 8.19 4.40 0.00 3.87 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 2 N 7.94 4.56 0.00 2.81 2.84 0.00 0.00 6.79 6.57 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 3 I 8.38 3.96 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.65 0.94 0.00 0.00 4 I 7.04 4.23 2.05 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 1.19 0.71 0.96 0.00 0.00 5 K 8.83 4.14 0.00 2.02 1.89 0.00 1.65 0.00 0.00 1.56 0.00 0.00 2.82 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.31 1.50 7.81 6 Q 7.69 3.80 0.00 2.12 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.64 0.00 0.00 0.00 0.00 0.00 2.42 2.35 0.00 7 L 7.08 4.10 0.00 1.81 1.66 0.92 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 8 E 8.21 3.99 0.00 2.16 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 2.31 2.29 0.00 9 Q 9.22 3.45 0.00 2.21 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.78 0.00 0.00 0.00 0.00 0.00 2.58 2.38 0.00 10 E 7.60 4.06 0.00 2.37 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 2.31 2.35 0.00 11 Q 8.62 4.53 0.00 1.99 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.60 0.00 0.00 0.00 0.00 0.00 2.25 2.26 0.00 12 M 7.71 3.94 0.00 1.91 2.02 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.17 0.00 13 K 8.41 4.45 0.00 1.85 1.80 0.00 1.58 0.00 0.00 1.71 0.00 0.00 2.92 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.47 1.46 7.81 14 Q 8.35 4.53 0.00 2.03 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 7.12 0.00 0.00 0.00 0.00 0.00 2.26 2.24 0.00 15 D 8.03 4.36 0.00 2.59 2.65 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 16 V 7.77 3.47 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 0.77 0.00 0.00 0.92 0.00 0.00 17 P 0.00 4.64 0.00 2.07 1.98 0.00 3.48 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.80 0.00 18 S 8.43 4.17 0.00 3.85 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 19 F 8.44 5.33 0.00 2.80 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 20 R 8.41 4.65 0.00 1.92 2.04 0.00 3.18 0.00 0.00 3.22 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.54 0.00 21 P 0.00 4.64 0.00 2.21 1.98 0.00 3.93 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.91 0.00 22 G 7.63 5.01 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 0.00 0.00 0.00 23 D 7.06 4.68 0.00 2.70 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 24 T 9.28 4.06 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 1.31 0.00 0.00 25 V 7.78 3.19 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 0.92 0.00 0.00 1.11 0.00 0.00 26 E 8.12 4.87 0.00 2.03 1.82 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 2.32 2.35 0.00 27 V 8.50 4.16 1.63 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 0.05 0.00 0.00 0.92 0.00 0.00 28 K 8.92 4.95 0.00 1.91 1.74 0.00 1.68 0.00 0.00 1.67 0.00 0.00 3.00 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.38 1.41 7.81 29 V 8.59 5.40 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 0.91 0.00 0.00 1.08 0.00 0.00 30 W 9.09 5.69 0.00 3.16 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 31 V 8.80 3.81 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 1.01 0.00 0.00 1.02 0.00 0.00 32 V 8.03 3.61 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 0.70 0.00 0.00 1.00 0.00 0.00 33 E 7.83 3.59 0.00 1.98 1.77 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 2.26 2.29 0.00 34 G 8.94 3.69 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 0.00 0.00 0.00 35 S 9.19 4.20 0.00 3.86 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 36 K 7.67 4.21 0.00 1.73 1.75 0.00 1.82 0.00 0.00 1.73 0.00 0.00 3.00 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.43 1.35 7.81 37 K 7.48 4.56 0.00 1.67 1.74 0.00 1.44 0.00 0.00 1.83 0.00 0.00 2.94 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.01 0.92 7.81 38 R 7.67 4.75 0.00 1.85 1.92 0.00 2.91 0.00 0.00 3.33 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.63 0.00 39 L 8.54 5.29 0.00 1.54 1.69 0.89 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 40 Q 9.79 4.65 0.00 2.11 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.81 0.00 0.00 0.00 0.00 0.00 2.38 2.37 0.00 41 A 8.63 4.84 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 42 F 7.82 4.71 0.00 3.16 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 43 E 8.35 4.33 0.00 1.87 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 2.34 2.52 0.00 44 G 8.93 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 0.00 0.00 0.00 0.00 45 V 8.37 4.68 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 0.82 0.00 0.00 0.91 0.00 0.00 46 V 8.43 4.00 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 0.57 0.00 0.00 0.54 0.00 0.00 47 I 8.16 4.42 1.82 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 1.35 0.68 0.85 0.00 0.00 48 A 7.47 4.41 1.17 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 0.00 0.00 49 I 7.98 4.73 1.76 0.00 0.00 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.28 0.88 0.00 0.00 50 R 7.89 3.91 0.00 1.99 1.47 0.00 3.29 0.00 0.00 3.51 7.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.76 0.00 51 N 10.24 4.28 0.00 2.96 3.02 0.00 0.00 6.57 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 52 R 8.51 4.64 0.00 2.02 1.88 0.00 3.43 0.00 0.00 3.21 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.77 0.00 53 G 8.20 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 54 L 8.63 3.76 0.00 1.46 1.48 0.83 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 55 H 7.36 4.88 0.00 3.29 3.23 0.00 5.74 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 S 8.11 4.62 0.00 3.90 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 57 A 8.24 5.89 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 58 F 9.10 4.63 0.00 3.35 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 59 T 8.01 3.29 4.40 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 1.27 0.00 0.00 60 V 8.63 4.77 2.54 0.00 0.00 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 1.35 0.00 0.00 61 R 8.59 5.01 0.00 1.73 1.81 0.00 3.34 0.00 0.00 3.36 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.67 0.00 62 K 8.81 4.07 0.00 1.27 1.63 0.00 0.73 0.00 0.00 1.40 0.00 0.00 2.73 0.00 0.00 2.67 0.00 0.00 0.00 0.00 1.23 1.04 7.81 63 I 7.45 3.29 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 1.27 0.91 0.89 0.00 0.00 64 S 7.53 4.26 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 65 N 8.67 4.05 0.00 2.69 2.81 0.00 0.00 7.06 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 66 G 8.80 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 67 E 8.31 4.65 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 2.30 2.23 0.00 68 G 8.59 3.98 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 V 8.21 4.83 2.20 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 0.80 0.00 0.00 1.10 0.00 0.00 70 E 8.73 5.87 0.00 1.82 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 2.24 2.14 0.00 71 R 8.30 4.06 0.00 1.32 0.99 0.00 2.55 0.00 0.00 2.25 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.83 0.00 72 V 8.12 4.40 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 0.75 0.00 0.00 0.83 0.00 0.00 73 F 8.45 4.22 0.00 2.01 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 0.00 0.00 0.00 74 Q 8.77 4.87 0.00 2.03 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.90 5.92 0.00 0.00 0.00 0.00 0.00 2.40 2.22 0.00 75 T 6.93 2.69 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 1.15 0.00 0.00 76 H 7.70 4.29 0.00 3.33 3.27 0.00 5.70 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 S 8.13 4.59 0.00 3.77 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 78 P 0.00 3.85 0.00 1.94 1.76 0.00 3.55 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 2.02 2.01 0.00 79 V 7.68 3.33 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 0.74 0.00 0.00 0.91 0.00 0.00 80 V 7.99 3.15 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 0.54 0.00 0.00 0.65 0.00 0.00 81 D 7.51 4.08 0.00 2.48 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 82 S 6.53 4.65 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 83 I 8.13 4.76 1.97 0.00 0.00 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.55 0.93 0.00 0.00 84 S 8.99 4.75 0.00 3.89 3.66 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 85 V 8.94 4.39 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 0.63 0.00 0.00 0.95 0.00 0.00 86 K 7.97 3.70 0.00 1.85 1.88 0.00 1.66 0.00 0.00 1.65 0.00 0.00 2.84 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.40 1.48 7.81 87 R 8.45 3.97 0.00 1.81 1.81 0.00 3.30 0.00 0.00 3.39 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.57 0.00 88 R 8.41 5.05 0.00 2.03 1.89 0.00 3.08 0.00 0.00 3.23 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.59 0.00 89 G 8.10 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 90 A 8.38 4.77 1.22 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 0.00 0.00 91 V 8.06 4.11 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 0.96 0.00 0.00 0.96 0.00 0.00 92 R 7.96 3.73 0.00 1.94 1.91 0.00 3.36 0.00 0.00 3.14 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.63 0.00 93 K 7.34 4.21 0.00 1.84 1.66 0.00 1.65 0.00 0.00 1.57 0.00 0.00 2.97 0.00 0.00 2.52 0.00 0.00 0.00 0.00 1.23 1.40 7.81 94 A 8.79 4.35 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 95 K 7.77 4.47 0.00 1.59 0.81 0.00 1.54 0.00 0.00 1.71 0.00 0.00 3.14 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.35 1.21 7.81 96 L 8.87 4.69 0.00 1.32 1.19 0.92 0.65 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 97 Y 7.38 4.42 0.00 3.17 2.95 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 98 Y 8.26 4.47 0.00 3.12 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 99 L 6.92 4.24 0.00 1.63 1.55 0.83 -0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 100 R 7.50 3.63 0.00 1.96 1.95 0.00 3.27 0.00 0.00 3.62 7.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.68 0.00 101 E 7.81 4.37 0.00 2.07 2.02 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 2.27 2.41 0.00 102 R 8.43 4.66 0.00 1.89 1.99 0.00 3.68 0.00 0.00 3.25 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.52 0.00 103 T 7.85 3.50 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 0.00 104 G 8.41 4.14 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 0.00 0.00 0.00 105 K 8.72 4.15 0.00 1.93 1.97 0.00 1.76 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.33 1.36 7.81 106 A 7.80 4.28 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 0.00 107 A 7.98 4.28 1.29 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 0.00 0.00 0.00 108 R 7.86 3.87 0.00 1.91 1.93 0.00 3.16 0.00 0.00 3.28 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.73 0.00 109 I 8.02 4.63 1.87 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 1.20 0.52 0.94 0.00 0.00 110 K 8.44 4.39 0.00 1.92 1.74 0.00 1.59 0.00 0.00 1.83 0.00 0.00 2.95 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.49 1.53 7.81 111 E 8.37 4.54 0.00 1.86 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 2.24 2.35 0.00 112 R 9.05 3.70 0.00 1.89 1.71 0.00 3.43 0.00 0.00 3.38 7.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.68 0.00 113 L 8.65 3.54 0.00 1.79 1.64 0.92 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 114 N 8.74 4.54 0.00 2.73 2.70 0.00 0.00 6.99 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