NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 T 4.5529 8.1749 117.3735 63.7115 70.2269 172.9508 2 T 4.6274 9.7400 122.6405 60.3216 72.3692 171.5035 3 T 5.2506 8.4412 116.4038 59.9701 72.4446 172.7186 4 L 4.9969 9.2514 123.5544 54.6659 44.6695 174.8169 5 A 5.1294 8.3459 120.2758 50.9866 22.1409 175.6023 6 F 5.0636 8.6466 116.5714 55.2668 41.9311 173.5216 7 R 5.2761 8.6758 120.3123 55.5019 32.0909 175.1765 8 F 4.8075 9.1423 118.4064 56.3580 41.0995 174.0317 9 Q 3.7750 9.2923 121.3919 59.6932 28.3874 178.1971 10 G 3.5245 6.1676 102.3865 45.4976 0.0000 172.6229 11 G 3.9310 6.2787 107.1797 43.8456 0.0000 176.3517 12 I 5.1932 8.4313 124.1123 59.2807 40.6238 173.3255 13 I 4.3540 7.9676 126.7263 59.4122 39.7544 174.8730 14 V 4.8610 8.1258 124.5640 61.1228 34.2957 174.3272 15 A 4.8305 9.0560 128.8864 50.3831 22.3319 175.0708 16 V 4.9871 8.2925 113.6430 59.9263 36.3517 174.6750 17 D 4.9102 8.2733 122.3070 51.9940 42.1882 176.4900 18 S 4.8250 8.1668 111.2220 58.4401 64.4788 173.2099 19 R 5.0228 8.9823 120.4713 56.0634 31.4310 175.4319 20 A 4.8025 9.0088 126.6966 50.4777 22.3641 175.1093 21 T 4.8279 8.6114 111.6940 59.8521 72.2691 173.9844 22 A 4.5438 9.4544 126.2948 49.9819 19.9815 177.9536 23 G 4.0262 8.9946 114.5332 46.5690 0.0000 172.6430 24 N 4.7907 9.0976 121.1274 52.2571 39.6453 173.8472 25 W 4.5770 7.9384 130.6981 56.2534 31.3121 175.3680 26 V 3.8913 7.8180 126.0008 61.6706 30.2720 175.1492 27 A 3.4864 7.9983 132.1401 54.3676 18.8174 177.5173 28 S 4.5143 7.2755 107.8560 57.5379 65.1832 174.1261 29 Q 4.6749 8.5965 123.3295 55.7536 29.9088 175.5710 30 T 4.7258 7.6007 107.6063 61.0900 68.0212 174.1905 31 V 4.1995 7.8756 121.0438 62.5973 33.3603 175.7031 32 K 4.2751 8.6131 127.1759 55.6194 32.6105 176.3952 33 K 4.5423 8.6446 123.7722 55.8771 33.7130 175.6042 34 V 4.7685 7.6606 120.1988 61.2111 33.8977 174.5973 35 I 4.2758 9.0930 129.8244 60.0984 38.9533 175.5555 36 E 4.4803 8.7809 127.3761 54.6388 28.2084 175.7517 37 I 3.7865 8.1484 124.4195 63.8665 37.5424 175.4655 38 N 4.3941 7.4776 113.9710 52.0513 40.1440 173.0211 39 P 4.3496 0.0000 0.0000 64.4553 31.2685 177.1052 40 F 4.7175 9.6542 116.4004 56.7473 40.8334 175.2034 41 L 5.1966 7.9763 119.1267 52.7657 44.8626 175.6104 42 L 5.0187 8.9472 121.7717 52.9129 45.7253 175.7655 43 G 4.7250 9.3786 109.2764 43.5332 0.0000 171.9194 44 T 5.0329 8.5135 114.2859 60.5412 70.9613 173.6508 45 M 4.7828 8.7672 123.3690 53.8635 34.1689 174.9539 46 A 4.5266 8.5740 127.4978 52.1710 23.4235 173.6214 47 G 4.2002 9.5528 109.6256 44.2481 0.0000 176.6350 48 G 3.9233 7.4489 116.2793 43.7387 0.0000 174.1367 49 A 3.9611 8.9065 127.4993 55.3008 18.4338 178.8539 50 A 3.9163 8.0254 118.4081 55.6139 18.5403 179.1038 51 D 4.4706 8.1864 116.4264 57.9628 40.9344 179.0819 52 C 4.2319 8.3558 116.8207 62.8849 28.2939 175.6434 53 Q 4.0010 8.5755 121.4509 59.5515 28.5360 178.1622 54 F 3.8070 8.7994 121.6223 61.2726 39.4394 177.1735 55 W 4.4865 8.3738 118.2434 59.6453 28.7896 178.3387 56 E 4.3142 8.6814 118.6559 59.1631 28.8606 179.2039 57 T 3.9329 7.8440 115.7895 66.1540 68.5273 176.6461 58 W 4.0066 8.3479 130.5798 60.1064 30.5948 177.6786 59 L 3.7038 8.4231 120.5606 58.2031 41.5953 178.9544 60 G 3.7705 8.0071 105.5138 48.3401 0.0000 175.6973 61 S 4.0712 7.5866 117.1823 61.3574 62.8662 176.7203 62 Q 3.7454 7.4645 120.7420 58.8910 28.2785 178.7589 63 C 4.0427 8.1275 117.9970 62.8164 28.2584 176.0049 64 R 3.8575 7.8213 120.2612 59.4291 29.5902 178.3179 65 L 3.9737 7.8773 120.1343 57.9877 42.0459 178.4266 66 H 4.0106 8.0329 118.2849 59.4416 29.6161 177.2563 67 E 4.3922 8.3441 120.0888 59.0963 28.9312 179.4713 68 L 4.0083 7.4017 118.2570 57.4173 41.8418 179.0266 69 R 3.9967 7.6947 117.5245 59.2640 30.2459 177.1169 70 E 4.2721 8.2385 114.8379 55.2825 29.9464 176.2874 71 K 3.9216 7.5292 117.5766 56.3464 30.3313 174.4513 72 E 4.5547 7.6121 115.5103 54.6033 32.7179 174.2196 73 R 3.8743 8.5378 125.9437 56.3884 30.4024 176.0246 74 I 3.7044 8.1035 125.8405 60.9314 38.7264 175.9155 75 S 4.4634 8.2822 121.8453 57.6995 65.4906 175.4336 76 V 3.5232 8.5531 123.3083 66.2509 31.0628 178.3548 77 A 3.9535 7.9414 119.7226 55.0760 18.3248 179.3249 78 A 3.8903 7.7665 119.2125 55.1617 18.4076 179.6386 79 A 3.9130 8.2360 119.8344 55.2191 18.4698 179.9921 80 S 4.0769 7.9633 112.4112 61.6986 63.1163 176.7272 81 K 4.1331 8.0926 123.6768 58.7501 31.9595 178.7458 82 I 3.7445 7.9817 120.4604 64.2572 36.9860 178.0581 83 L 4.2153 7.8642 120.5601 58.3181 41.9956 178.4276 84 S 4.1282 8.5771 113.4595 62.0040 62.0287 176.1499 85 N 4.3940 8.5907 117.5896 56.1201 38.4344 176.9550 86 L 3.9600 7.8378 121.4217 58.1012 42.1590 178.8414 87 V 3.3775 7.8967 118.3154 66.5261 31.5134 177.4930 88 Y 4.0280 8.3107 118.7178 60.5894 38.3040 178.0195 89 Q 3.9101 8.1898 118.8971 58.2676 28.8535 177.1805 90 Y 4.4905 7.6949 116.1398 56.2011 38.0525 175.0579 91 K 3.8859 6.8546 121.9867 58.2586 32.0494 176.6407 92 G 3.9785 9.0099 114.4327 45.5185 0.0000 174.8722 93 A 3.9698 7.8866 121.7309 53.4314 18.4369 178.2407 94 G 4.1248 7.5039 103.4060 45.0019 0.0000 174.3423 95 L 4.1759 7.6543 119.2197 54.9072 42.3122 176.5389 96 S 4.6872 9.2742 116.6492 57.2126 65.3628 172.7269 97 M 4.9738 8.4979 121.7675 54.4816 33.1037 174.1012 98 G 4.2123 9.1400 111.5423 44.6224 0.0000 171.9259 99 T 5.0445 8.4845 119.0411 60.8252 71.1757 172.3601 100 M 4.7170 9.6463 127.0437 53.6375 34.7347 174.8993 101 I 4.7012 8.4694 124.1105 59.9801 39.3324 174.5749 102 C 4.8961 9.1271 125.9478 58.0088 30.7478 173.6000 103 G 4.4478 8.3982 108.3339 45.7728 0.0000 172.4918 104 Y 4.8785 8.6870 121.7601 55.6330 39.3389 175.4366 105 T 4.2336 8.4788 114.4825 61.2935 69.1751 175.2481 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 4.24 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 1.22 0.00 0.00 2 T 9.74 4.63 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 1.22 0.00 0.00 3 T 8.44 5.25 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 1.27 0.00 0.00 4 L 9.25 5.00 0.00 1.68 1.78 1.04 0.55 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 8.35 5.13 1.20 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 0.00 0.00 0.00 6 F 8.65 5.06 0.00 3.05 3.09 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 0.00 0.00 0.00 7 R 8.68 5.28 0.00 1.93 1.95 0.00 3.23 0.00 0.00 3.28 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.60 0.00 8 F 9.14 4.81 0.00 3.34 3.20 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 0.00 9 Q 9.29 3.78 0.00 2.03 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.40 0.00 0.00 0.00 0.00 0.00 2.28 2.33 0.00 10 G 6.17 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 0.00 0.00 0.00 11 G 6.28 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 12 I 8.43 5.19 1.88 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.63 0.91 0.00 0.00 13 I 7.97 4.35 0.56 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 0.26 0.78 0.64 0.00 0.00 14 V 8.13 4.86 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 0.82 0.00 0.00 0.88 0.00 0.00 15 A 9.06 4.83 1.20 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 0.00 0.00 0.00 16 V 8.29 4.99 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 17 D 8.27 4.91 0.00 2.68 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 18 S 8.17 4.83 0.00 3.99 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 8.98 5.02 0.00 1.74 1.94 0.00 3.16 0.00 0.00 3.16 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.48 0.00 20 A 9.01 4.80 1.13 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 0.00 0.00 21 T 8.61 4.83 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 1.11 0.00 0.00 22 A 9.45 4.54 1.49 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 23 G 8.99 4.03 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 0.00 0.00 0.00 24 N 9.10 4.79 0.00 2.78 2.90 0.00 0.00 6.70 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 7.94 4.58 0.00 3.31 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 26 V 7.82 3.89 1.71 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 0.61 0.00 0.00 0.80 0.00 0.00 27 A 8.00 3.49 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 28 S 7.28 4.51 0.00 3.75 3.58 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 29 Q 8.60 4.67 0.00 1.98 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 7.28 0.00 0.00 0.00 0.00 0.00 2.12 2.16 0.00 30 T 7.60 4.73 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 1.19 0.00 0.00 31 V 7.88 4.20 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 0.77 0.00 0.00 0.90 0.00 0.00 32 K 8.61 4.28 0.00 1.66 1.75 0.00 1.65 0.00 0.00 1.70 0.00 0.00 3.04 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.41 1.52 7.81 33 K 8.64 4.54 0.00 1.69 1.79 0.00 1.81 0.00 0.00 1.74 0.00 0.00 2.75 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.44 1.40 7.81 34 V 7.66 4.77 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 0.87 0.00 0.00 0.93 0.00 0.00 35 I 9.09 4.28 2.11 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 1.25 0.50 0.94 0.00 0.00 36 E 8.78 4.48 0.00 1.95 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 2.27 2.32 0.00 37 I 8.15 3.79 1.96 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 1.51 0.54 0.93 0.00 0.00 38 N 7.48 4.39 0.00 2.99 2.94 0.00 0.00 7.03 7.64 0.00 0.00 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 4.35 0.00 1.77 1.89 0.00 3.75 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 2.04 2.06 0.00 40 F 9.65 4.72 0.00 2.99 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 41 L 7.98 5.20 0.00 1.66 1.57 0.94 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 42 L 8.95 5.02 0.00 1.57 1.52 0.91 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 43 G 9.38 4.72 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 0.00 0.00 0.00 44 T 8.51 5.03 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 1.22 0.00 0.00 45 M 8.77 4.78 0.00 2.01 2.03 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 2.55 2.49 0.00 46 A 8.57 4.53 1.33 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 47 G 9.55 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 0.00 0.00 0.00 0.00 48 G 7.45 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 0.00 0.00 0.00 49 A 8.91 3.96 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 50 A 8.03 3.92 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 51 D 8.19 4.47 0.00 3.04 2.88 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 52 C 8.36 4.23 0.00 3.03 3.04 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 53 Q 8.58 4.00 0.00 2.21 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.80 0.00 0.00 0.00 0.00 0.00 2.39 2.41 0.00 54 F 8.80 3.81 0.00 3.02 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 55 W 8.37 4.49 0.00 3.77 3.34 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 56 E 8.68 4.31 0.00 2.29 2.07 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 2.45 2.50 0.00 57 T 7.84 3.93 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 1.11 0.00 0.00 58 W 8.35 4.01 0.00 2.97 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 59 L 8.42 3.70 0.00 2.19 1.91 0.98 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 60 G 8.01 3.77 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 0.00 0.00 0.00 61 S 7.59 4.07 0.00 3.75 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 62 Q 7.46 3.75 0.00 1.73 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.82 0.00 0.00 0.00 0.00 0.00 1.16 1.16 0.00 63 C 8.13 4.04 0.00 3.08 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 64 R 7.82 3.86 0.00 1.91 2.04 0.00 3.12 0.00 0.00 3.09 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.66 0.00 65 L 7.88 3.97 0.00 1.96 1.67 0.90 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 66 H 8.03 4.01 0.00 3.28 3.47 0.00 5.84 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 67 E 8.34 4.39 0.00 2.16 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 2.59 2.52 0.00 68 L 7.40 4.01 0.00 1.75 1.69 0.90 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 69 R 7.69 4.00 0.00 2.04 1.86 0.00 3.28 0.00 0.00 3.20 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.68 0.00 70 E 8.24 4.27 0.00 1.77 1.87 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 2.13 2.19 0.00 71 K 7.53 3.92 0.00 1.78 1.78 0.00 1.72 0.00 0.00 1.60 0.00 0.00 2.95 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.38 1.32 7.81 72 E 7.61 4.55 0.00 1.85 1.74 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 2.17 2.24 0.00 73 R 8.54 3.87 0.00 1.57 1.70 0.00 2.49 0.00 0.00 2.87 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.24 0.00 74 I 8.10 3.70 1.78 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 0.86 0.90 0.88 0.00 0.00 75 S 8.28 4.46 0.00 4.08 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 76 V 8.55 3.52 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 1.06 0.00 0.00 0.99 0.00 0.00 77 A 7.94 3.95 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 7.77 3.89 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 79 A 8.24 3.91 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 80 S 7.96 4.08 0.00 4.13 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 0.00 81 K 8.09 4.13 0.00 2.02 1.86 0.00 1.63 0.00 0.00 1.64 0.00 0.00 2.92 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.59 1.48 7.81 82 I 7.98 3.74 2.08 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.15 0.93 0.00 0.00 83 L 7.86 4.22 0.00 1.92 1.94 1.17 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 84 S 8.58 4.13 0.00 3.90 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 85 N 8.59 4.39 0.00 2.85 2.93 0.00 0.00 7.09 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 86 L 7.84 3.96 0.00 1.85 1.75 -0.82 0.18 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 7.90 3.38 2.30 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 1.01 0.00 0.00 0.78 0.00 0.00 88 Y 8.31 4.03 0.00 3.12 3.12 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 89 Q 8.19 3.91 0.00 2.05 1.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.93 0.00 0.00 0.00 0.00 0.00 2.56 2.43 0.00 90 Y 7.69 4.49 0.00 2.93 2.81 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 91 K 6.85 3.89 0.00 1.46 1.40 0.00 1.77 0.00 0.00 1.47 0.00 0.00 3.13 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.37 1.35 7.81 92 G 9.01 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 93 A 7.89 3.97 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.50 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 95 L 7.65 4.18 0.00 1.59 1.57 0.45 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 96 S 9.27 4.69 0.00 3.82 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 97 M 8.50 4.97 0.00 2.07 2.04 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.52 0.00 98 G 9.14 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 0.00 0.00 0.00 0.00 99 T 8.48 5.04 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 9.65 4.72 0.00 2.00 1.95 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.55 0.00 101 I 8.47 4.70 1.90 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.90 0.95 0.00 0.00 102 C 9.13 4.90 0.00 2.83 2.81 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 0.00 103 G 8.40 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 0.00 104 Y 8.69 4.88 0.00 2.88 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 0.00 105 T 8.48 4.23 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 1.26 0.00 0.00