NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9269 8.3549 109.7361 45.2612 0.0000 173.4547 2 S 4.1602 8.6517 122.0475 57.2564 63.6388 171.9288 3 S 4.6852 8.6365 119.2315 57.1340 65.8036 174.9575 4 G 3.7060 8.2341 112.6585 46.8627 0.0000 171.9109 5 S 4.7161 8.2292 113.9017 56.2362 64.9759 173.9091 6 S 4.0091 8.7856 118.8952 58.7122 63.3075 173.9345 7 G 4.0647 8.6844 109.5689 46.2655 0.0000 174.2987 8 E 4.1867 7.8033 117.7552 59.3099 29.9260 178.6235 9 Q 3.8937 8.1866 119.9034 59.2923 29.1492 178.3174 10 A 4.0607 8.0380 120.9176 55.4084 18.4375 179.2766 11 E 4.0188 7.9111 115.2987 59.1483 28.8521 179.2709 12 A 4.0351 8.4688 121.5205 55.1437 18.4390 179.5702 13 Q 3.9284 8.0078 116.6110 58.7326 28.9625 177.9055 14 L 3.8814 7.8636 120.4995 58.5578 41.8565 178.7231 15 A 3.9584 7.7263 118.7131 55.8471 18.5623 178.6057 16 E 3.9291 7.8809 117.3109 59.3949 29.6398 178.8939 17 L 3.7074 7.8983 117.9749 58.1467 41.6737 179.1713 18 D 4.3228 8.0948 116.4134 57.3994 41.3002 178.0750 19 L 4.0701 8.4145 120.9413 58.1176 42.2088 178.4705 20 L 4.0405 8.1422 118.1765 58.4933 41.4080 179.4634 21 A 3.9727 7.6929 119.0337 55.4677 18.5365 179.3911 22 S 4.2057 8.5643 111.8694 61.8327 62.3669 176.0676 23 M 4.1418 7.9378 120.1067 56.8447 32.7308 176.6707 24 F 4.7632 7.4973 116.0337 54.5451 39.0914 172.9633 25 P 4.3551 0.0000 0.0000 64.7512 31.8597 178.0764 26 G 4.0170 8.0867 107.5532 45.7462 0.0000 172.6263 27 E 4.3063 8.6584 116.5545 57.4813 30.6466 176.7682 28 N 5.0994 7.9423 115.8883 52.8746 39.6323 174.5293 29 E 4.8347 8.1756 118.4885 56.7018 32.4931 177.2348 30 L 4.9984 7.6832 119.2229 53.4173 45.3895 175.5440 31 I 4.7269 9.0807 126.6572 59.4161 41.2046 174.3906 32 V 4.3932 8.3602 126.3754 60.2660 32.3157 175.5316 33 N 4.4557 8.5665 123.3369 55.3579 37.9578 175.4774 34 D 4.7229 7.5933 119.6635 53.0876 39.9733 176.1595 35 Q 4.2370 8.1354 124.5085 58.2754 29.5829 176.2664 36 L 3.9073 8.1127 120.8513 58.2764 41.6891 178.3783 37 A 4.0566 7.2331 119.2823 55.4804 18.5658 179.3369 38 V 3.6766 7.8945 115.4033 66.2531 31.6213 177.5176 39 A 4.0042 7.7565 119.9182 55.7161 18.0548 179.5497 40 E 3.9464 8.3248 116.6401 59.3907 28.3840 179.3309 41 L 4.0141 8.1137 120.3352 57.5852 42.2513 178.9759 42 K 4.3425 7.8272 118.2045 58.8858 32.2715 178.5334 43 D 4.4151 8.2856 118.6872 57.2483 41.2513 177.7004 44 C 3.9955 8.3595 115.4461 61.7103 29.0239 176.2708 45 I 3.6888 7.0312 121.1988 64.0929 36.8314 177.8698 46 E 4.1190 7.4509 116.5531 59.6170 29.5030 179.6036 47 K 4.0793 8.3929 116.5676 56.8364 32.5060 177.0967 48 K 3.8767 7.7287 117.7063 58.0668 30.1486 175.1379 49 T 4.3816 7.8154 109.9266 61.2260 69.2421 172.8971 50 M 3.2557 7.9870 118.8965 57.0908 29.6115 177.8497 51 E 4.4850 7.6920 116.9751 53.7667 30.8365 174.8938 52 G 3.8562 8.3482 118.8950 45.9766 0.0000 170.7750 53 R 3.7722 7.7374 124.9351 55.6715 28.4328 175.3952 54 S 4.5491 8.4986 117.0037 57.8458 64.2477 173.9419 55 S 5.0218 7.8934 114.6306 56.6702 65.7874 173.5744 56 K 4.2407 8.4785 122.6970 55.9329 33.2418 177.5724 57 V 3.8812 8.2339 122.8186 63.5391 31.6755 173.2799 58 Y 5.4239 8.5169 129.4062 55.8082 40.9166 174.0946 59 F 4.7246 8.3876 120.9089 55.9737 41.7574 173.4214 60 T 4.8644 8.6645 119.8770 62.2359 71.1060 173.7946 61 I 4.7316 8.0166 124.7339 59.6618 40.3612 174.3684 62 N 5.0924 9.3155 126.1760 52.4592 40.1847 174.1726 63 M 4.9054 8.7437 124.1245 53.2893 35.1079 174.8016 64 N 5.1195 8.9145 122.1177 52.2631 38.3839 174.3462 65 L 4.9379 8.7176 122.8304 52.9274 46.8645 175.3082 66 D 5.3992 8.4626 119.1544 51.8645 41.1581 175.9025 67 V 4.2009 8.0728 112.7970 62.5426 33.9145 175.6589 68 S 4.4501 7.9668 112.3058 58.7146 66.5202 174.2448 69 D 4.4384 9.4150 118.2309 57.1461 38.0683 173.5191 70 E 3.8298 8.0535 109.9542 57.2979 28.9938 174.4449 71 K 4.6645 8.2746 116.9903 56.0052 35.0721 175.2470 72 M 5.1423 8.1994 118.4880 53.9854 35.6456 174.7862 73 A 4.7385 8.6557 120.6958 51.2483 23.3300 174.9663 74 M 4.8474 8.5867 119.2185 54.7041 34.1519 175.5781 75 F 4.5862 8.9180 123.6067 55.7949 42.1404 174.4658 76 S 4.8242 8.5931 121.1521 57.9098 64.1584 173.6980 77 L 4.8446 8.5550 125.5903 52.6707 42.9988 174.9895 78 A 4.4176 8.7853 125.9537 51.9689 18.2824 174.9733 79 C 4.5327 8.2252 118.9698 59.0995 30.3728 172.9690 80 I 4.9379 7.9668 123.0827 59.5127 40.8343 174.2027 81 L 4.6218 8.5782 128.0695 52.5337 42.8833 175.0430 82 P 4.0934 0.0000 0.0000 61.8433 32.8918 175.7723 83 F 5.1290 7.9517 115.9937 58.0474 39.1495 176.9952 84 K 4.4682 7.8686 120.1869 58.3749 34.4876 176.1672 85 Y 4.2270 7.8834 117.1202 56.0180 39.5822 174.4598 86 P 2.9700 0.0000 0.0000 63.9176 31.0598 177.3182 87 A 3.4966 6.7075 118.8679 54.3147 19.2367 176.8242 88 V 4.4339 7.3827 107.7912 58.5373 34.0616 176.3908 89 L 4.3130 8.6504 124.5877 54.5781 42.0241 175.0729 90 P 4.4084 0.0000 0.0000 62.1891 32.5531 175.9701 91 E 4.5881 7.7682 118.3516 55.3278 27.7578 177.9162 92 I 3.7682 7.5145 119.7463 62.2561 38.4837 177.7811 93 T 4.5911 8.8708 125.1102 61.4862 70.6657 173.5821 94 V 4.3646 9.2266 127.7882 62.8001 32.6245 175.6698 95 R 5.1369 9.1109 125.5337 54.1366 35.1342 174.2570 96 S 4.3905 8.6067 113.4237 57.7116 64.9917 176.3165 97 V 3.5191 8.8038 121.5910 64.7358 31.7103 177.7277 98 L 4.0665 7.7626 118.4837 57.6821 41.6259 177.5877 99 L 4.1149 7.5645 118.1276 54.5240 42.1700 177.5964 100 S 4.5351 8.3178 117.6080 56.9896 65.2770 174.9272 101 R 3.8378 8.5882 119.0600 60.1203 29.5608 177.9518 102 S 4.1288 8.0656 114.3405 61.9774 62.7902 175.9714 103 Q 3.9897 8.1674 118.7176 59.3452 28.7306 179.3856 104 Q 3.7410 8.4373 119.8695 59.9909 29.3835 179.4126 105 T 3.7697 7.7298 115.8909 66.9830 68.6066 175.7858 106 Q 3.9622 8.0601 120.2851 59.5612 29.0680 178.3363 107 L 3.2069 7.7261 121.0244 58.4375 41.8684 178.3101 108 N 4.1965 8.3633 115.8096 57.0837 38.2963 177.3443 109 T 3.8436 7.9326 116.4799 67.0750 68.5858 176.1123 110 D 4.2876 8.0870 120.1412 57.3516 40.5697 178.3923 111 L 2.6938 7.7895 120.9042 58.3138 42.0592 179.3925 112 T 3.7062 7.7712 115.0709 66.4965 68.4552 176.2047 113 A 4.0261 7.4346 121.3888 55.7347 18.3053 179.1980 114 F 3.8390 7.6970 118.4942 61.6591 39.3590 177.5318 115 L 3.4010 7.4491 118.3970 58.1773 41.3407 179.8011 116 Q 3.8205 7.4197 116.5857 58.8533 28.6634 179.1302 117 K 4.1022 7.6281 119.4334 59.2725 32.6579 178.0023 118 H 4.2581 8.4138 117.2839 57.1054 28.8691 175.7436 119 C 4.3385 7.3975 126.0524 58.4977 27.9356 173.4383 120 H 4.6532 8.3596 124.5418 55.8957 31.3082 172.9969 121 G 3.7067 10.1515 116.7564 45.8743 0.0000 171.6355 122 D 4.5123 7.5215 116.3492 53.0465 45.0124 176.6357 123 V 4.0920 7.8554 114.8923 60.2239 30.1551 174.5984 124 C 4.9025 9.0266 119.4702 57.9121 29.4711 173.9884 125 I 4.2304 8.7014 125.8371 63.0290 37.9493 179.0801 126 L 4.1331 8.3555 120.4842 58.3376 41.4322 178.9063 127 N 4.3813 8.4175 114.2126 56.6275 38.7543 176.6307 128 A 4.2819 8.0522 122.1982 55.1050 18.7930 179.4208 129 T 4.0374 8.1637 107.2854 65.4577 68.0410 175.8815 130 E 4.0149 8.3752 121.0794 58.8436 29.5325 178.8201 131 W 3.6017 8.4655 128.4036 59.8899 30.5636 177.5995 132 V 3.8962 7.9518 118.9514 65.0169 30.1760 177.7490 133 R 3.6505 8.0018 115.4333 59.5488 28.9597 178.2369 134 E 3.6502 7.2178 118.1771 59.2656 29.8965 178.4946 135 H 3.8398 7.6070 115.0751 59.6046 28.8381 177.5484 136 A 4.0271 8.4377 121.2166 55.4317 17.9946 179.4280 137 S 4.1684 7.5061 113.9554 61.6596 63.2255 177.5295 138 G 3.5907 8.0869 107.3093 47.9885 0.0000 174.2469 139 Y 4.1682 7.9958 117.9263 60.5063 38.0299 177.6782 140 V 3.5885 7.8496 118.7486 63.2849 31.7483 174.9276 141 S 4.5905 8.7195 121.6340 56.4027 63.6931 172.8137 142 R 4.5152 8.5705 127.7394 54.5619 31.9482 174.4566 143 D 4.7935 8.6296 124.9758 52.4126 41.1822 174.3452 144 T 4.5495 8.0497 118.4769 60.5603 68.2282 173.7517 145 S 4.3460 7.9593 114.5439 56.9394 64.2106 173.4240 146 S 4.6996 8.4183 122.5159 56.7152 64.9184 173.5876 147 S 4.4014 8.3182 116.0351 58.2902 63.3397 171.7886 148 G 3.6638 8.4994 114.9646 44.6944 0.0000 170.9562 149 P 4.3908 0.0000 0.0000 62.8242 32.4042 176.7893 150 S 4.7306 8.4358 117.0067 56.9037 64.6615 173.4304 151 S 4.6536 8.7297 118.8356 57.5964 64.4390 173.9691 152 G 4.0196 8.7481 114.1000 45.7933 0.0000 173.1524 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 G 8.35 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 2 S 8.65 4.16 0.00 3.95 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 3 S 8.64 4.69 0.00 3.79 3.70 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 4 G 8.23 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 0.00 0.00 0.00 5 S 8.23 4.72 0.00 4.15 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 6 S 8.79 4.01 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 7 G 8.68 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 0.00 0.00 0.00 8 E 7.80 4.19 0.00 2.24 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 0.00 2.35 2.42 0.00 9 Q 8.19 3.89 0.00 2.15 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.94 0.00 0.00 0.00 0.00 0.00 2.58 2.46 0.00 10 A 8.04 4.06 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 11 E 7.91 4.02 0.00 2.22 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 2.33 2.50 0.00 12 A 8.47 4.04 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 13 Q 8.01 3.93 0.00 2.16 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.56 7.00 0.00 0.00 0.00 0.00 0.00 2.71 2.55 0.00 14 L 7.86 3.88 0.00 1.80 1.83 0.92 1.13 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 15 A 7.73 3.96 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 16 E 7.88 3.93 0.00 2.33 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 2.39 2.45 0.00 17 L 7.90 3.71 0.00 1.86 1.59 0.88 0.53 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 18 D 8.09 4.32 0.00 2.64 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 19 L 8.41 4.07 0.00 1.77 1.89 0.94 0.68 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 20 L 8.14 4.04 0.00 1.88 1.82 0.91 0.96 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 21 A 7.69 3.97 1.36 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 22 S 8.56 4.21 0.00 3.88 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 23 M 7.94 4.14 0.00 1.67 2.27 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.95 0.00 24 F 7.50 4.76 0.00 3.00 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 25 P 0.00 4.36 0.00 2.19 2.19 0.00 3.80 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.94 0.00 26 G 8.09 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 27 E 8.66 4.31 0.00 2.10 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 2.25 2.34 0.00 28 N 7.94 5.10 0.00 2.72 2.83 0.00 0.00 6.80 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 29 E 8.18 4.83 0.00 2.01 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 0.00 2.41 2.22 0.00 30 L 7.68 5.00 0.00 1.18 1.32 0.72 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 31 I 9.08 4.73 1.82 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 0.53 0.87 0.00 0.00 32 V 8.36 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 0.68 0.00 0.00 1.01 0.00 0.00 33 N 8.57 4.46 0.00 2.78 2.95 0.00 0.00 7.07 8.03 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 34 D 7.59 4.72 0.00 2.92 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 35 Q 8.14 4.24 0.00 2.20 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.55 0.00 0.00 0.00 0.00 0.00 2.42 2.47 0.00 36 L 8.11 3.91 0.00 1.82 1.71 0.94 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 37 A 7.23 4.06 1.58 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 38 V 7.89 3.68 2.38 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 1.11 0.00 0.00 0.91 0.00 0.00 39 A 7.76 4.00 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 E 8.32 3.95 0.00 2.23 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 2.34 2.46 0.00 41 L 8.11 4.01 0.00 1.95 1.81 1.01 0.68 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 42 K 7.83 4.34 0.00 2.01 1.83 0.00 1.71 0.00 0.00 1.75 0.00 0.00 2.88 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.51 1.49 7.81 43 D 8.29 4.42 0.00 2.82 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 44 C 8.36 4.00 0.00 3.15 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 45 I 7.03 3.69 2.02 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 1.53 0.62 0.91 0.00 0.00 46 E 7.45 4.12 0.00 2.13 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 2.49 2.50 0.00 47 K 8.39 4.08 0.00 1.76 1.86 0.00 1.85 0.00 0.00 1.73 0.00 0.00 3.02 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.47 1.62 7.81 48 K 7.73 3.88 0.00 1.85 1.84 0.00 1.64 0.00 0.00 1.63 0.00 0.00 2.92 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.43 1.63 7.81 49 T 7.82 4.38 4.23 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 1.23 0.00 0.00 50 M 7.99 3.26 0.00 2.07 2.04 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.59 0.00 51 E 7.69 4.48 0.00 1.87 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 2.16 2.46 0.00 52 G 8.35 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 0.00 0.00 0.00 53 R 7.74 3.77 0.00 1.73 1.99 0.00 2.92 0.00 0.00 3.08 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.05 0.00 54 S 8.50 4.55 0.00 3.86 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 55 S 7.89 5.02 0.00 3.95 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 56 K 8.48 4.24 0.00 1.56 1.62 0.00 1.55 0.00 0.00 1.41 0.00 0.00 2.50 0.00 0.00 2.39 0.00 0.00 0.00 0.00 0.75 0.79 7.81 57 V 8.23 3.88 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 1.11 0.00 0.00 1.03 0.00 0.00 58 Y 8.52 5.42 0.00 3.02 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 59 F 8.39 4.72 0.00 2.95 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 60 T 8.66 4.86 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 1.17 0.00 0.00 61 I 8.02 4.73 1.79 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.98 0.74 0.00 0.00 62 N 9.32 5.09 0.00 2.77 2.79 0.00 0.00 6.35 7.54 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 63 M 8.74 4.91 0.00 2.03 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 2.59 2.62 0.00 64 N 8.91 5.12 0.00 2.77 2.90 0.00 0.00 6.05 7.81 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 65 L 8.72 4.94 0.00 1.37 1.40 0.52 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 66 D 8.46 5.40 0.00 2.85 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 67 V 8.07 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 0.95 0.00 0.00 1.00 0.00 0.00 68 S 7.97 4.45 0.00 3.84 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 69 D 9.41 4.44 0.00 2.76 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 70 E 8.05 3.83 0.00 2.14 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 2.20 2.25 0.00 71 K 8.27 4.66 0.00 1.93 1.75 0.00 1.63 0.00 0.00 1.66 0.00 0.00 3.08 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.47 1.52 7.81 72 M 8.20 5.14 0.00 1.99 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 2.49 2.40 0.00 73 A 8.66 4.74 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 74 M 8.59 4.85 0.00 2.04 2.00 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 2.60 2.65 0.00 75 F 8.92 4.59 0.00 3.18 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 76 S 8.59 4.82 0.00 3.93 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 77 L 8.56 4.84 0.00 1.75 1.54 1.13 0.68 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 78 A 8.79 4.42 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 79 C 8.23 4.53 0.00 1.23 2.41 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 80 I 7.97 4.94 1.76 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.81 0.81 0.00 0.00 81 L 8.58 4.62 0.00 1.68 1.71 1.01 0.68 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 82 P 0.00 4.09 0.00 1.99 1.94 0.00 3.59 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 2.07 1.95 0.00 83 F 7.95 5.13 0.00 3.12 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 84 K 7.87 4.47 0.00 1.84 1.85 0.00 1.82 0.00 0.00 1.68 0.00 0.00 2.97 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.41 1.41 7.81 85 Y 7.88 4.23 0.00 2.86 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 86 P 0.00 2.97 0.00 1.84 1.51 0.00 3.76 0.00 0.00 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.76 0.00 87 A 6.71 3.50 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 88 V 7.38 4.43 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 0.75 0.00 0.00 0.97 0.00 0.00 89 L 8.65 4.31 0.00 1.66 1.67 0.96 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 90 P 0.00 4.41 0.00 1.87 1.69 0.00 3.69 0.00 0.00 3.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.65 0.00 91 E 7.77 4.59 0.00 1.76 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 2.18 2.18 0.00 92 I 7.51 3.77 1.82 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 1.23 0.37 0.87 0.00 0.00 93 T 8.87 4.59 4.18 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 1.16 0.00 0.00 94 V 9.23 4.36 2.12 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 0.90 0.00 0.00 1.00 0.00 0.00 95 R 9.11 5.14 0.00 1.61 1.67 0.00 3.33 0.00 0.00 3.14 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.51 0.00 96 S 8.61 4.39 0.00 3.12 3.03 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 97 V 8.80 3.52 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 0.66 0.00 0.00 0.86 0.00 0.00 98 L 7.76 4.07 0.00 1.41 1.70 0.83 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 99 L 7.56 4.11 0.00 1.70 1.57 0.97 0.94 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 0.00 100 S 8.32 4.54 0.00 4.00 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 0.00 101 R 8.59 3.84 0.00 1.85 1.96 0.00 3.33 0.00 0.00 3.32 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.66 0.00 102 S 8.07 4.13 0.00 3.92 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 0.00 103 Q 8.17 3.99 0.00 2.14 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.66 0.00 0.00 0.00 0.00 0.00 2.45 2.61 0.00 104 Q 8.44 3.74 0.00 2.24 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.70 0.00 0.00 0.00 0.00 0.00 2.31 2.44 0.00 105 T 7.73 3.77 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 1.20 0.00 0.00 106 Q 8.06 3.96 0.00 2.22 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.80 6.80 0.00 0.00 0.00 0.00 0.00 2.60 2.70 0.00 107 L 7.73 3.21 0.00 0.80 1.56 0.87 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 108 N 8.36 4.20 0.00 2.86 2.82 0.00 0.00 7.14 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 0.00 109 T 7.93 3.84 4.41 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 1.21 0.00 0.00 110 D 8.09 4.29 0.00 3.26 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 0.00 111 L 7.79 2.69 0.00 1.74 1.79 0.92 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 112 T 7.77 3.71 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 1.16 0.00 0.00 113 A 7.43 4.03 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 0.00 114 F 7.70 3.84 0.00 1.94 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 0.00 115 L 7.45 3.40 0.00 1.92 1.76 0.96 0.96 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 0.00 116 Q 7.42 3.82 0.00 2.15 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.83 0.00 0.00 0.00 0.00 0.00 2.38 2.57 0.00 117 K 7.63 4.10 0.00 1.69 1.80 0.00 1.75 0.00 0.00 1.55 0.00 0.00 3.01 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.33 1.57 7.81 118 H 8.41 4.26 0.00 2.43 2.99 0.00 5.69 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 C 7.40 4.34 0.00 2.87 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 0.00 120 H 8.36 4.65 0.00 3.07 3.12 0.00 5.77 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 G 10.15 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 0.00 0.00 0.00 122 D 7.52 4.51 0.00 2.57 2.49 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 0.00 123 V 7.86 4.09 2.40 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 0.64 0.00 0.00 0.93 0.00 0.00 124 C 9.03 4.90 0.00 3.00 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 0.00 125 I 8.70 4.23 2.04 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 1.72 1.33 1.11 0.00 0.00 126 L 8.36 4.13 0.00 1.81 1.82 0.99 0.97 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 0.00 127 N 8.42 4.38 0.00 2.91 3.41 0.00 0.00 7.17 7.48 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 0.00 128 A 8.05 4.28 1.55 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 0.00 129 T 8.16 4.04 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 1.41 0.00 0.00 130 E 8.38 4.01 0.00 2.22 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 2.39 2.51 0.00 131 W 8.47 3.60 0.00 2.08 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 0.00 132 V 7.95 3.90 2.31 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 1.08 0.00 0.00 1.21 0.00 0.00 133 R 8.00 3.65 0.00 1.95 2.10 0.00 2.78 0.00 0.00 3.13 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.64 0.00 134 E 7.22 3.65 0.00 1.44 1.67 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 2.18 2.31 0.00 135 H 7.61 3.84 0.00 2.26 3.21 0.00 5.66 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 0.00 136 A 8.44 4.03 1.16 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 0.00 0.00 0.00 0.00 0.00 0.00 137 S 7.51 4.17 0.00 3.92 3.99 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 0.00 138 G 8.09 3.59 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 0.00 0.00 0.00 139 Y 8.00 4.17 0.00 3.25 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 0.00 140 V 7.85 3.59 2.32 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 0.79 0.00 0.00 1.24 0.00 0.00 141 S 8.72 4.59 0.00 3.85 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 0.00 142 R 8.57 4.52 0.00 1.76 1.86 0.00 3.29 0.00 0.00 3.16 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.64 0.00 143 D 8.63 4.79 0.00 2.61 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 0.00 144 T 8.05 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 1.29 0.00 0.00 145 S 7.96 4.35 0.00 3.82 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 0.00 146 S 8.42 4.70 0.00 4.00 3.83 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 0.00 0.00 0.00 147 S 8.32 4.40 0.00 3.84 3.79 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 0.00 148 G 8.50 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 0.00 0.00 0.00 149 P 0.00 4.39 0.00 2.19 2.06 0.00 3.74 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 0.00 150 S 8.44 4.73 0.00 3.87 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 0.00 151 S 8.73 4.65 0.00 3.79 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 0.00 152 G 8.75 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