NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 N 4.5785 8.4249 119.1753 52.9633 39.9317 176.4902 4 Q 4.1792 8.1592 112.4535 54.3933 32.7333 172.2435 5 Y 5.0633 7.9317 117.2172 55.9418 39.4298 174.5512 6 Y 4.9109 8.5705 125.2095 58.0092 41.1231 174.2066 7 G 3.6857 6.4666 107.5325 46.3233 0.0000 171.8098 8 T 4.0560 8.0543 122.0347 62.6167 66.7514 174.5659 9 G 4.4165 10.5489 123.6863 46.2308 0.0000 173.0088 10 R 4.6279 8.0404 118.8807 55.3209 32.4012 175.4894 11 R 4.1713 8.4011 117.4572 56.3205 31.1156 171.1667 12 K 3.5573 8.9225 127.3677 56.4673 29.8259 174.3366 13 S 4.3803 8.6597 122.2433 58.3305 62.3437 170.6793 14 S 5.2323 7.9367 115.8192 57.8100 63.9735 173.0057 15 A 4.6566 8.7617 126.6299 50.3308 20.6015 174.8707 16 A 4.8528 8.2578 124.4220 51.3523 20.2514 176.2845 17 R 4.6000 8.6436 120.0504 55.1677 31.7528 175.8873 18 V 4.5434 8.2230 123.1272 60.9683 34.9831 174.4731 19 F 5.4060 8.7481 123.4884 56.1293 42.2405 173.7788 20 I 4.8962 8.3548 124.6622 59.7634 38.9597 175.0515 21 K 4.7651 8.8948 128.3534 53.4573 35.6134 172.9619 22 P 4.6643 0.0000 0.0000 62.9833 31.3482 175.2935 23 G 3.9992 8.2825 118.7348 46.4649 0.0000 174.2652 24 N 4.9750 8.9668 123.3509 51.6603 39.6442 175.8564 25 G 4.5404 7.8542 110.0627 45.6265 0.0000 174.3197 26 K 4.4021 8.2542 121.2397 55.6241 34.5220 175.3164 27 I 4.7554 7.9455 118.0100 60.2521 40.7260 175.9021 28 V 4.3026 7.9024 123.4205 63.0065 32.4640 174.6526 29 I 3.5182 7.6561 117.4099 62.2038 39.2534 174.8898 30 N 3.8559 10.2475 126.3973 56.7471 36.4539 174.4866 31 Q 3.4484 7.8922 113.0126 56.0055 27.1279 174.8739 32 R 4.3792 7.7193 113.9714 55.1204 33.8731 173.8388 33 S 4.6857 8.3344 117.9672 57.4055 63.1540 174.6662 34 L 3.9544 8.3558 122.4469 57.2323 41.8846 177.7323 35 E 4.3599 7.9456 115.6333 56.9146 30.1966 176.1396 36 Q 4.5846 7.3491 116.1617 55.7899 28.9381 175.3059 37 Y 5.1405 7.5039 118.0503 58.5717 42.8658 175.0005 38 F 5.0177 7.2185 114.2093 56.6937 39.4600 174.0846 39 G 4.3860 7.6954 111.7897 41.9253 0.0000 174.1208 40 R 5.6477 6.9970 131.1658 57.4964 33.0719 173.7516 41 E 4.6729 7.3348 114.3347 57.8739 29.3274 177.0987 42 T 4.4272 8.7259 120.7393 63.4757 68.3042 174.3426 43 A 5.5767 7.7900 132.5086 52.8815 21.4457 179.6263 44 R 4.1511 8.3044 122.0727 61.1832 30.3266 178.0602 45 M 4.8002 7.7755 109.7827 55.2715 33.1890 176.4034 46 V 3.8186 7.4894 112.0979 63.3910 31.7158 177.2613 47 V 3.9820 7.5793 112.6795 63.0654 32.4123 177.6906 48 R 4.0985 8.0692 119.0577 57.9582 29.8715 178.0920 49 Q 3.9011 7.9713 118.1590 58.7658 28.5758 176.8608 50 P 3.9238 0.0000 0.0000 64.4164 31.4713 176.0746 51 L 4.9094 7.5108 119.0225 54.2609 43.6303 177.1016 52 E 3.9525 8.6894 120.6961 57.8842 27.8579 178.5837 53 L 3.9935 9.4307 126.5064 58.5841 42.4804 177.8391 54 V 3.8407 7.5789 111.1857 60.1478 30.1549 175.2156 55 D 4.6993 8.2603 124.4510 54.8554 43.7110 176.6019 56 M 4.5585 9.0132 124.5824 54.6765 36.8713 175.4163 57 V 3.5837 9.4642 118.2724 63.0402 31.6181 171.6721 58 E 4.8111 7.6828 114.9132 56.1934 31.7813 176.4018 59 K 4.2476 8.1817 123.3178 58.6422 32.9254 176.3447 60 L 4.8761 7.4182 115.8530 54.9551 43.5817 173.7911 61 D 5.3387 9.2739 121.0847 53.0268 44.2296 175.5240 62 L 5.6808 7.9231 118.4728 55.4324 42.6167 173.4853 63 Y 4.7831 8.7817 127.4748 57.5438 40.0674 173.9595 64 I 4.9092 8.0012 126.3268 59.7156 41.9961 174.6336 65 T 5.4984 9.0302 121.6908 60.8420 71.5714 173.1840 66 V 5.1830 8.9578 126.0079 58.8987 34.0785 175.1052 67 K 4.5805 8.3521 120.6921 56.5718 36.4302 176.4911 68 G 3.9133 8.8004 108.3777 45.2427 0.0000 173.5786 69 G 4.3640 7.7285 105.7903 44.4507 0.0000 171.5459 70 G 4.3942 7.8332 107.3769 44.0105 0.0000 172.6588 71 I 3.4549 8.5421 120.4585 63.6256 36.7452 177.0977 72 S 4.0842 9.0224 126.2827 61.5720 63.2036 176.9474 73 G 3.4218 7.7258 109.2303 48.0287 0.0000 175.7246 74 Q 3.8888 7.9537 120.8488 58.1836 28.4814 179.1756 75 A 3.9407 7.4260 121.7565 54.8713 18.4631 179.7320 76 G 3.5521 8.1080 104.2081 48.1819 0.0000 175.0835 77 A 3.9642 8.2506 123.4252 54.9619 18.0793 179.4039 78 I 3.7620 7.3615 117.3741 64.6651 37.7414 177.7925 79 R 3.9251 8.1720 119.3108 59.9774 29.7746 177.8692 80 H 4.2998 8.4028 117.6664 59.2278 29.6370 177.2440 81 G 4.1388 8.7072 108.8251 45.8628 0.0000 174.7752 82 I 3.7867 7.5221 122.3120 63.8488 37.6965 178.0049 83 T 3.8940 7.1235 108.1923 64.6828 68.5172 176.1246 84 R 4.0853 7.7269 120.1486 58.7362 30.3589 178.0288 85 A 4.2517 7.1674 117.4292 53.4924 18.6884 177.9916 86 L 4.3802 7.7555 118.8665 55.0583 42.4984 177.4932 87 M 4.4645 8.3064 117.5376 58.0194 30.8017 177.9479 88 E 3.4176 7.2707 117.6507 59.6527 29.4905 178.5985 89 Y 4.4282 7.7319 116.2493 58.8993 38.3903 175.2559 90 D 4.4155 6.7014 114.5299 53.4983 42.2249 175.1186 91 E 4.5182 8.8284 117.4927 56.6082 29.5048 177.1680 92 S 4.5908 8.1731 114.1800 58.2571 63.6986 174.5224 93 L 4.4417 7.8740 119.7377 57.3628 41.2972 177.8327 94 R 4.5202 7.7772 118.8450 56.2998 29.6554 176.7752 95 S 4.6486 8.3538 111.0344 56.8955 66.4106 175.4496 96 E 4.5145 8.1405 117.3278 56.1605 30.1098 176.3296 97 L 4.4689 7.7785 119.4385 55.9455 43.0682 177.4617 98 R 4.0693 7.7976 118.4139 59.0948 29.9377 177.7294 99 K 3.7545 8.0205 118.5564 59.4372 32.5675 177.3164 100 A 3.7366 7.8193 119.5462 52.6187 18.1344 178.7382 101 G 3.8879 8.4421 104.8611 45.4745 0.0000 175.3776 102 F 4.6926 7.0660 116.3365 59.0999 39.0445 176.6811 103 V 3.9620 7.3912 113.9191 63.6427 31.9172 177.0955 104 T 4.2118 7.6960 114.7070 62.9627 69.1907 173.6628 105 R 4.2551 8.1053 123.4719 54.4752 30.8751 176.3518 106 D 4.5026 8.4363 125.6862 54.5639 38.8078 176.7632 107 A 4.1880 8.2064 125.5030 53.0531 18.8146 178.1476 108 R 3.9000 7.2658 114.1277 56.8759 30.4702 176.1244 109 Q 4.7055 8.2822 120.7212 53.3906 32.2862 175.7195 110 V 3.5800 8.2914 113.3735 62.0683 32.0971 175.4164 111 E 4.4028 8.4912 124.1859 54.2163 30.4062 176.0885 112 R 3.9740 8.4634 122.7801 56.2920 29.8790 175.2447 113 K 4.4470 8.3457 120.0316 55.2189 32.7131 176.0511 114 K 4.3869 8.4012 126.4508 54.6127 33.3158 176.5892 115 V 3.5239 8.3582 122.5270 63.5630 31.4666 174.5655 116 G 4.2453 9.1544 114.5079 45.8903 0.0000 173.8468 117 L 4.4428 7.3137 119.4105 53.0449 42.8657 176.7129 118 R 3.9507 8.2506 125.2091 58.8552 30.0231 176.9474 119 K 4.1034 7.9029 115.2330 57.0621 32.2909 173.4355 120 A 4.2922 8.3031 131.4131 52.8678 17.3188 178.9601 121 R 4.3939 7.4109 112.8181 56.1119 33.1982 176.1053 122 R 3.8622 7.8894 117.8747 56.3298 29.8301 175.0082 123 R 4.4759 8.3746 126.6890 54.3736 30.9377 174.1246 124 P 4.2479 0.0000 0.0000 62.5763 31.5297 175.7749 125 Q 3.9637 8.8416 124.3073 56.6166 29.1619 175.8092 126 F 4.9896 8.5854 119.4524 54.2851 40.5675 174.8537 127 S 4.2652 8.4591 116.5781 57.7411 64.3881 176.5148 128 K 3.9954 7.4095 118.2002 57.6811 31.3035 177.1981 129 R 4.2586 8.8872 116.5994 56.1516 30.2518 175.5376 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 3 N 8.42 4.58 0.00 2.57 1.81 0.00 0.00 6.81 6.19 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 4 Q 8.16 4.18 0.00 1.96 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 7.05 0.00 0.00 0.00 0.00 0.00 2.09 2.12 0.00 5 Y 7.93 5.06 0.00 2.75 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 6 Y 8.57 4.91 0.00 3.49 3.05 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 0.00 0.00 0.00 7 G 6.47 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 8 T 8.05 4.06 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 9 G 10.55 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 0.00 0.00 0.00 0.00 10 R 8.04 4.63 0.00 1.98 1.85 0.00 3.08 0.00 0.00 3.15 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.58 0.00 11 R 8.40 4.17 0.00 1.69 2.00 0.00 3.41 0.00 0.00 3.12 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.55 0.00 12 K 8.92 3.56 0.00 1.89 1.79 0.00 1.87 0.00 0.00 1.60 0.00 0.00 2.72 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.28 1.38 7.81 13 S 8.66 4.38 0.00 4.04 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 14 S 7.94 5.23 0.00 3.78 3.75 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 15 A 8.76 4.66 1.25 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 0.00 0.00 16 A 8.26 4.85 1.23 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 0.00 0.00 17 R 8.64 4.60 0.00 2.21 2.20 0.00 2.80 0.00 0.00 3.14 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.44 0.00 18 V 8.22 4.54 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 0.90 0.00 0.00 0.80 0.00 0.00 19 F 8.75 5.41 0.00 3.38 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 20 I 8.35 4.90 1.99 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 1.15 0.96 0.94 0.00 0.00 21 K 8.89 4.77 0.00 2.02 1.61 0.00 1.65 0.00 0.00 1.68 0.00 0.00 2.85 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.27 1.45 7.81 22 P 0.00 4.66 0.00 2.14 2.13 0.00 3.82 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.98 0.00 23 G 8.28 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.97 4.98 0.00 2.77 2.82 0.00 0.00 6.73 7.60 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 25 G 7.85 4.54 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 K 8.25 4.40 0.00 1.93 2.00 0.00 1.30 0.00 0.00 1.66 0.00 0.00 2.89 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.43 1.60 7.81 27 I 7.95 4.76 1.85 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 1.28 1.16 0.94 0.00 0.00 28 V 7.90 4.30 2.59 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 1.19 0.00 0.00 1.09 0.00 0.00 29 I 7.66 3.52 1.88 0.00 0.00 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 1.41 1.04 0.98 0.00 0.00 30 N 10.25 3.86 0.00 2.57 2.62 0.00 0.00 6.89 7.40 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 31 Q 7.89 3.45 0.00 2.13 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.73 0.00 0.00 0.00 0.00 0.00 2.45 2.51 0.00 32 R 7.72 4.38 0.00 1.77 1.64 0.00 3.25 0.00 0.00 3.11 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.49 0.00 33 S 8.33 4.69 0.00 3.88 3.75 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 34 L 8.36 3.95 0.00 1.69 1.58 0.73 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 35 E 7.95 4.36 0.00 1.97 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 2.22 2.23 0.00 36 Q 7.35 4.58 0.00 2.15 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.71 0.00 0.00 0.00 0.00 0.00 2.34 2.42 0.00 37 Y 7.50 5.14 0.00 2.68 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 38 F 7.22 5.02 0.00 3.06 2.89 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 0.00 0.00 0.00 39 G 7.70 4.39 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 0.00 40 R 7.00 5.65 0.00 1.85 1.98 0.00 3.19 0.00 0.00 3.23 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.39 0.00 41 E 7.33 4.67 0.00 2.02 1.12 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 2.26 2.30 0.00 42 T 8.73 4.43 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 1.19 0.00 0.00 43 A 7.79 5.58 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 44 R 8.30 4.15 0.00 1.83 2.06 0.00 3.20 0.00 0.00 3.42 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.67 0.00 45 M 7.78 4.80 0.00 2.11 2.20 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 2.56 2.51 0.00 46 V 7.49 3.82 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 0.68 0.00 0.00 0.98 0.00 0.00 47 V 7.58 3.98 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 0.89 0.00 0.00 1.00 0.00 0.00 48 R 8.07 4.10 0.00 1.82 2.04 0.00 3.27 0.00 0.00 3.15 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.80 0.00 49 Q 7.97 3.90 0.00 1.75 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.62 0.00 0.00 0.00 0.00 0.00 2.45 2.58 0.00 50 P 0.00 3.92 0.00 2.08 2.09 0.00 3.41 0.00 0.00 3.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.92 0.00 51 L 7.51 4.91 0.00 1.81 1.68 0.92 0.94 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 52 E 8.69 3.95 0.00 2.07 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 2.39 2.44 0.00 53 L 9.43 3.99 0.00 1.65 1.78 0.98 0.90 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 54 V 7.58 3.84 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 0.71 0.00 0.00 0.96 0.00 0.00 55 D 8.26 4.70 0.00 2.64 2.60 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 56 M 9.01 4.56 0.00 2.27 1.80 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.73 2.58 0.00 57 V 9.46 3.58 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 0.79 0.00 0.00 0.94 0.00 0.00 58 E 7.68 4.81 0.00 1.94 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 2.21 2.23 0.00 59 K 8.18 4.25 0.00 2.02 1.84 0.00 1.83 0.00 0.00 1.88 0.00 0.00 3.00 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.49 1.43 7.81 60 L 7.42 4.88 0.00 1.92 1.75 0.97 0.72 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 61 D 9.27 5.34 0.00 2.92 2.59 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 0.00 0.00 0.00 0.00 62 L 7.92 5.68 0.00 1.82 1.80 0.92 0.77 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 63 Y 8.78 4.78 0.00 3.07 3.15 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 64 I 8.00 4.91 1.80 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 1.33 0.90 0.83 0.00 0.00 65 T 9.03 5.50 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 1.18 0.00 0.00 66 V 8.96 5.18 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 1.17 0.00 0.00 0.96 0.00 0.00 67 K 8.35 4.58 0.00 1.77 1.90 0.00 1.55 0.00 0.00 1.83 0.00 0.00 2.98 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.39 1.39 7.81 68 G 8.80 3.91 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 0.00 0.00 0.00 69 G 7.73 4.36 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 0.00 70 G 7.83 4.39 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 0.00 71 I 8.54 3.45 1.73 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 1.60 1.32 0.69 0.00 0.00 72 S 9.02 4.08 0.00 3.95 4.06 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 0.00 0.00 0.00 73 G 7.73 3.42 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 0.00 74 Q 7.95 3.89 0.00 1.91 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.78 0.00 0.00 0.00 0.00 0.00 2.39 2.50 0.00 75 A 7.43 3.94 1.02 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 76 G 8.11 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.25 3.96 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 78 I 7.36 3.76 2.09 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.77 0.93 0.00 0.00 79 R 8.17 3.93 0.00 1.95 2.13 0.00 2.88 0.00 0.00 2.25 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.73 0.00 80 H 8.40 4.30 0.00 3.31 3.45 0.00 5.85 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 G 8.71 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 82 I 7.52 3.79 1.95 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.96 0.86 0.00 0.00 83 T 7.12 3.89 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 1.28 0.00 0.00 84 R 7.73 4.09 0.00 1.74 1.93 0.00 3.16 0.00 0.00 3.22 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.57 0.00 85 A 7.17 4.25 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 86 L 7.76 4.38 0.00 1.99 1.75 0.94 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 87 M 8.31 4.46 0.00 2.40 2.44 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 2.55 2.61 0.00 88 E 7.27 3.42 0.00 1.16 1.62 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 2.19 2.16 0.00 89 Y 7.73 4.43 0.00 2.96 2.92 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 90 D 6.70 4.42 0.00 2.90 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 91 E 8.83 4.52 0.00 1.97 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 2.25 2.22 0.00 92 S 8.17 4.59 0.00 3.81 4.09 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 93 L 7.87 4.44 0.00 1.97 1.91 0.98 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 0.00 0.00 0.00 0.00 0.00 0.00 94 R 7.78 4.52 0.00 1.80 1.96 0.00 3.20 0.00 0.00 3.22 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.66 0.00 95 S 8.35 4.65 0.00 3.82 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 96 E 8.14 4.51 0.00 1.93 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 2.22 2.27 0.00 97 L 7.78 4.47 0.00 1.86 1.72 1.13 1.03 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 98 R 7.80 4.07 0.00 1.92 1.89 0.00 3.24 0.00 0.00 3.25 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.66 0.00 99 K 8.02 3.75 0.00 1.72 1.79 0.00 1.81 0.00 0.00 1.69 0.00 0.00 2.97 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.38 1.41 7.81 100 A 7.82 3.74 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 0.00 101 G 8.44 3.89 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 0.00 0.00 0.00 0.00 0.00 0.00 102 F 7.07 4.69 0.00 3.17 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.39 3.96 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 0.76 0.00 0.00 0.94 0.00 0.00 104 T 7.70 4.21 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 1.21 0.00 0.00 105 R 8.11 4.26 0.00 1.64 1.77 0.00 3.37 0.00 0.00 3.17 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.48 0.00 106 D 8.44 4.50 0.00 2.76 2.61 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 0.00 107 A 8.21 4.19 1.26 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 0.00 108 R 7.27 3.90 0.00 1.84 1.92 0.00 3.09 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 1.66 1.62 0.00 109 Q 8.28 4.71 0.00 1.98 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.55 6.87 0.00 0.00 0.00 0.00 0.00 2.59 2.27 0.00 110 V 8.29 3.58 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 0.65 0.00 0.00 0.92 0.00 0.00 111 E 8.49 4.40 0.00 1.89 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 2.22 2.33 0.00 112 R 8.46 3.97 0.00 2.02 2.06 0.00 3.00 0.00 0.00 3.26 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.63 0.00 113 K 8.35 4.45 0.00 1.73 1.76 0.00 1.76 0.00 0.00 1.70 0.00 0.00 3.33 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.37 1.50 7.81 114 K 8.40 4.39 0.00 1.85 1.69 0.00 1.83 0.00 0.00 1.86 0.00 0.00 2.92 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.48 1.41 7.81 115 V 8.36 3.52 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 0.69 0.00 0.00 0.93 0.00 0.00 116 G 9.15 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 0.00 0.00 0.00 0.00 117 L 7.31 4.44 0.00 1.59 1.81 0.97 0.92 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 0.00 118 R 8.25 3.95 0.00 1.82 2.03 0.00 3.30 0.00 0.00 3.28 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.63 0.00 119 K 7.90 4.10 0.00 1.84 1.76 0.00 1.67 0.00 0.00 1.71 0.00 0.00 3.06 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.27 1.38 7.81 120 A 8.30 4.29 1.52 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 0.00 121 R 7.41 4.39 0.00 1.76 1.94 0.00 3.38 0.00 0.00 3.15 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.51 0.00 122 R 7.89 3.86 0.00 1.89 1.93 0.00 3.23 0.00 0.00 3.27 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.69 0.00 123 R 8.37 4.48 0.00 1.79 1.83 0.00 3.30 0.00 0.00 3.26 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.70 0.00 124 P 0.00 4.25 0.00 2.25 2.09 0.00 3.86 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.12 0.00 125 Q 8.84 3.96 0.00 2.05 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.85 0.00 0.00 0.00 0.00 0.00 2.33 2.38 0.00 126 F 8.59 4.99 0.00 3.17 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 0.00 127 S 8.46 4.27 0.00 3.94 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 0.00 128 K 7.41 4.00 0.00 1.88 0.98 0.00 1.41 0.00 0.00 1.67 0.00 0.00 3.05 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.40 1.40 7.81 129 R 8.89 4.26 0.00 1.81 1.89 0.00 3.45 0.00 0.00 3.30 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.55 0.00