NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9645 8.3549 109.7365 45.5461 0.0000 173.5116 2 S 3.9899 8.4303 121.0295 60.2669 63.3076 172.7461 3 S 4.5154 7.7029 110.4001 58.1195 65.6230 173.6293 4 G 4.2984 8.2515 110.7179 44.7137 0.0000 172.2066 5 S 4.6023 7.7799 114.1410 57.3347 66.8491 173.4464 6 S 4.6386 7.8631 115.5481 58.4536 65.7515 178.5362 7 G 4.1769 8.1798 111.5448 45.1723 0.0000 176.1212 8 D 4.6453 8.6632 123.8774 51.3362 41.7990 174.1848 9 K 4.4292 8.5797 122.9370 55.4127 34.1211 175.3916 10 L 5.0665 7.9587 121.2263 53.8343 46.7043 174.5274 11 Y 4.7276 9.5234 116.9796 55.7416 40.9562 174.0328 12 P 4.9577 0.0000 0.0000 62.9360 32.5691 175.3278 13 C 4.9545 9.3459 121.6042 57.1988 34.4015 174.4370 14 Q 4.0472 9.0003 124.3348 59.3826 28.5770 177.8943 15 C 4.1677 8.1802 111.0618 60.7386 29.8028 173.2614 16 G 3.6220 7.8648 109.8867 45.4365 0.0000 174.0746 17 K 4.3689 8.2005 120.0798 56.5180 33.6887 175.9637 18 S 5.2702 8.1580 115.0808 56.9751 65.5811 173.5428 19 F 4.7875 9.6653 122.7509 55.9280 41.4506 177.1382 20 T 4.2157 8.7528 116.9354 66.0117 68.4971 175.2995 21 H 4.6098 7.7970 117.0041 53.1280 33.1558 175.0114 22 K 3.6955 7.4335 121.9500 59.9124 32.8183 179.4936 23 S 4.0190 7.7138 114.9661 61.2712 62.6670 176.3880 24 Q 3.8442 7.7073 120.3747 58.3526 28.8511 177.8152 25 R 2.6631 7.0981 118.3828 58.2301 30.1149 178.0324 26 D 4.2877 8.1784 118.7062 57.3184 41.1242 178.1781 27 R 3.9452 7.5825 116.1969 59.8290 28.8379 177.8916 28 H 4.1961 7.3728 115.9653 58.4445 29.7448 176.8698 29 M 4.2434 8.3414 121.4727 58.2549 31.5779 178.6704 30 S 4.1391 7.9268 114.2013 61.5706 62.9379 176.2344 31 M 4.2464 7.4998 119.7893 58.2250 30.9813 177.8082 32 H 4.3225 7.4600 116.1468 57.9596 29.2160 175.8204 33 L 3.9349 6.6241 118.9378 54.6719 42.1883 177.1674 34 G 3.8919 8.4244 108.8881 44.9891 0.0000 172.9518 35 L 4.4789 8.5463 124.5095 55.7574 43.1878 177.0257 36 R 4.7938 7.4671 115.3792 53.4451 33.7201 174.1329 37 P 4.2034 0.0000 0.0000 64.7877 31.8206 175.7259 38 Y 4.7710 7.7621 116.7554 56.0814 40.0815 175.1828 39 G 4.4357 8.6765 110.7720 44.4646 0.0000 171.6174 40 C 4.4926 9.6010 126.1268 58.1784 32.2554 173.6234 41 G 3.9476 8.5871 117.5810 46.2964 0.0000 173.3994 42 V 4.2091 7.9911 120.1681 63.2916 33.6026 175.7388 43 C 4.6388 8.1050 111.7141 59.6916 31.2990 174.0245 44 G 4.1160 8.1532 108.7682 45.5041 0.0000 173.4894 45 K 4.5082 8.2121 119.6220 55.0574 35.0029 175.2979 46 K 5.1904 7.6235 118.2051 55.9983 36.3641 175.7934 47 F 4.7974 9.4659 120.2055 56.1308 43.2855 175.9261 48 K 4.1414 9.1401 123.9201 59.5161 31.7096 177.6957 49 M 4.4670 7.8384 117.5935 53.6683 34.9026 177.0981 50 K 2.8215 7.4789 120.1525 59.7169 32.8710 179.0038 51 H 4.1304 7.3175 115.6997 58.4898 28.3875 177.1394 52 H 4.2908 7.6150 117.6872 58.1055 28.8519 176.7809 53 L 2.0000 6.7856 122.7912 56.7635 42.0649 178.6908 54 V 3.5086 7.1797 118.3774 66.0295 31.3017 178.1438 55 G 3.7873 7.4112 103.2595 47.1013 0.0000 173.7091 56 H 4.7139 7.5041 119.1449 58.0339 31.2313 175.9920 57 M 4.0272 8.2755 120.9577 57.8287 31.5214 178.2876 58 K 4.1489 7.9012 119.0007 58.1522 32.6485 178.1682 59 I 3.9846 7.5285 113.7747 62.7614 38.0077 176.5460 60 H 4.7522 8.0280 117.4480 56.1883 30.0828 175.0217 61 T 3.8383 6.9637 109.8484 60.6443 69.3985 171.6099 62 G 4.0869 8.1593 114.1164 44.3679 0.0000 172.8590 63 I 3.7482 7.6876 125.1278 60.9416 37.7289 176.4641 64 K 4.2113 8.0621 124.1732 53.9286 31.5211 174.4433 65 P 4.0894 0.0000 0.0000 64.4760 31.8986 176.4230 66 Y 4.3638 6.4980 117.8506 55.9347 39.5700 174.6767 67 E 5.3714 8.5003 124.0022 54.5016 33.3598 174.3770 68 C 4.6120 9.5791 126.7465 60.0180 32.8350 173.3640 69 N 4.7335 8.6900 116.2432 54.5539 39.9719 176.7063 70 I 3.9125 7.5906 118.0683 63.9365 37.4329 176.6711 71 C 4.3002 8.1174 112.9462 57.8802 30.3135 173.7038 72 A 4.6927 8.0448 121.0778 51.9945 16.0643 177.3351 73 K 4.2358 7.5634 117.3061 58.2487 33.5166 176.3503 74 R 5.0492 7.9431 120.6229 54.6115 31.4067 175.7790 75 F 4.9840 9.0136 121.3361 56.2490 42.8328 175.8281 76 M 4.1783 9.1529 121.1240 57.5747 31.6780 177.1499 77 W 4.6052 8.1493 118.3867 56.1954 30.4034 176.9043 78 R 4.0399 8.9420 120.7219 59.4638 29.7798 178.1360 79 D 4.4539 8.3404 118.1456 57.9800 40.8080 179.4566 80 S 4.0678 8.1745 114.6804 61.3322 62.9142 176.0346 81 F 3.7859 7.9354 123.0897 61.8447 39.1406 177.0241 82 H 3.4552 8.3478 115.7409 58.5079 27.2171 177.6384 83 R 3.8331 8.1360 120.9254 59.7638 29.7330 177.9332 84 H 3.9298 8.1042 117.8780 59.0457 29.9995 177.0284 85 V 3.4871 7.4581 119.9134 66.5154 30.9352 177.8438 86 T 3.7678 7.8275 114.7815 66.7603 68.6895 176.1569 87 S 4.2273 7.3836 113.0276 61.5669 63.1925 175.7465 88 C 3.7422 8.1633 123.1689 62.3917 31.0445 175.9164 89 T 4.0374 7.9812 116.7917 66.2515 68.1533 177.2260 90 K 4.0733 7.5414 119.2655 59.7003 32.3040 178.7692 91 S 4.2632 8.0511 114.6822 61.7683 62.8328 175.6701 92 Y 4.0125 7.4807 122.1416 60.9190 38.3896 178.1570 93 E 4.0699 9.0259 119.3485 59.5634 29.4060 178.9568 94 A 3.9641 7.6034 118.8007 55.4554 18.4108 179.2141 95 A 4.0181 7.8236 117.4325 54.5551 18.7508 179.0377 96 K 3.6956 7.9763 117.7241 58.8343 32.7387 177.1484 97 A 3.7988 7.8769 119.7004 52.4970 16.9632 178.2919 98 E 3.9683 8.4618 122.8520 60.3301 29.7922 178.1402 99 Q 4.5596 7.7585 114.4122 56.0652 28.8961 175.2124 100 N 4.7390 7.9311 118.4604 52.7328 39.3055 172.6982 101 T 4.0026 8.1409 119.3221 61.8706 68.0814 175.0433 102 T 4.2202 8.2025 125.9744 62.5272 67.2528 172.7343 103 E 4.1542 8.3287 126.0038 54.5737 30.6859 176.0767 104 A 3.9939 8.3695 128.9327 52.3370 19.1918 176.4953 105 S 4.6435 8.2317 113.5888 56.4902 64.1271 173.8491 106 G 3.7714 8.3337 113.5721 44.1239 0.0000 172.3370 107 P 4.5468 0.0000 0.0000 62.3744 32.4606 175.3780 108 S 4.5970 8.2043 113.5631 56.9567 65.3737 174.4899 109 S 4.3251 8.7287 119.1990 58.3582 63.5138 174.4195 110 G 4.0107 8.1112 115.4599 46.0401 0.0000 173.5887 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 3.96 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 2 S 8.43 3.99 0.00 3.95 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 3 S 7.70 4.52 0.00 3.76 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 4 G 8.25 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 0.00 0.00 0.00 0.00 5 S 7.78 4.60 0.00 3.81 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 6 S 7.86 4.64 0.00 3.76 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 7 G 8.18 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 0.00 0.00 0.00 0.00 8 D 8.66 4.65 0.00 2.72 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 9 K 8.58 4.43 0.00 1.83 1.84 0.00 1.60 0.00 0.00 1.74 0.00 0.00 2.80 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.37 1.52 7.81 10 L 7.96 5.07 0.00 1.53 1.85 0.93 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 11 Y 9.52 4.73 0.00 2.91 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 12 P 0.00 4.96 0.00 2.13 2.10 0.00 3.75 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.98 0.00 13 C 9.35 4.95 0.00 3.28 3.16 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 14 Q 9.00 4.05 0.00 2.12 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.89 0.00 0.00 0.00 0.00 0.00 2.34 2.39 0.00 15 C 8.18 4.17 0.00 3.16 2.98 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 16 G 7.86 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 0.00 0.00 0.00 17 K 8.20 4.37 0.00 1.83 1.52 0.00 1.74 0.00 0.00 1.77 0.00 0.00 3.08 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.48 1.49 7.81 18 S 8.16 5.27 0.00 3.87 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 19 F 9.67 4.79 0.00 3.08 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 20 T 8.75 4.22 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 1.16 0.00 0.00 21 H 7.80 4.61 0.00 3.12 2.95 0.00 5.61 0.00 0.00 0.00 0.00 6.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 K 7.43 3.70 0.00 1.87 1.98 0.00 1.64 0.00 0.00 1.15 0.00 0.00 2.84 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.27 1.37 7.81 23 S 7.71 4.02 0.00 3.97 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 24 Q 7.71 3.84 0.00 2.15 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.01 7.07 0.00 0.00 0.00 0.00 0.00 2.42 2.51 0.00 25 R 7.10 2.66 0.00 1.88 1.95 0.00 3.23 0.00 0.00 3.25 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 2.17 0.00 26 D 8.18 4.29 0.00 2.73 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 27 R 7.58 3.95 0.00 2.04 2.10 0.00 2.77 0.00 0.00 3.01 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.53 0.00 28 H 7.37 4.20 0.00 2.85 3.33 0.00 5.77 0.00 0.00 0.00 0.00 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 M 8.34 4.24 0.00 2.05 2.20 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.76 2.60 0.00 30 S 7.93 4.14 0.00 4.01 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 31 M 7.50 4.25 0.00 2.26 2.20 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 2.53 2.47 0.00 32 H 7.46 4.32 0.00 3.37 3.38 0.00 5.69 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 L 6.62 3.93 0.00 1.87 1.66 0.92 0.91 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 34 G 8.42 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 35 L 8.55 4.48 0.00 1.60 1.69 0.95 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 36 R 7.47 4.79 0.00 1.76 2.07 0.00 3.26 0.00 0.00 3.25 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.70 0.00 37 P 0.00 4.20 0.00 1.49 1.98 0.00 3.83 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.95 0.00 38 Y 7.76 4.77 0.00 3.31 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 39 G 8.68 4.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 C 9.60 4.49 0.00 3.26 3.25 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 41 G 8.59 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 42 V 7.99 4.21 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 0.74 0.00 0.00 0.91 0.00 0.00 43 C 8.10 4.64 0.00 3.19 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 44 G 8.15 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 45 K 8.21 4.51 0.00 1.81 1.62 0.00 1.53 0.00 0.00 1.55 0.00 0.00 2.95 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.37 1.48 7.81 46 K 7.62 5.19 0.00 1.49 1.74 0.00 1.74 0.00 0.00 1.70 0.00 0.00 3.12 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.40 1.46 7.81 47 F 9.47 4.80 0.00 3.02 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 48 K 9.14 4.14 0.00 1.77 1.95 0.00 1.71 0.00 0.00 1.74 0.00 0.00 2.92 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.49 1.63 7.81 49 M 7.84 4.47 0.00 1.40 1.61 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.62 0.00 50 K 7.48 2.82 0.00 1.70 1.60 0.00 1.52 0.00 0.00 1.86 0.00 0.00 2.89 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.37 1.26 7.81 51 H 7.32 4.13 0.00 3.24 3.49 0.00 5.46 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 H 7.61 4.29 0.00 3.30 3.63 0.00 5.71 0.00 0.00 0.00 0.00 6.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 L 6.79 2.00 0.00 1.58 1.43 0.95 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 54 V 7.18 3.51 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 0.83 0.00 0.00 0.89 0.00 0.00 55 G 7.41 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 0.00 0.00 0.00 56 H 7.50 4.71 0.00 3.38 3.10 0.00 5.88 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 M 8.28 4.03 0.00 2.00 2.04 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.81 0.00 58 K 7.90 4.15 0.00 1.90 1.89 0.00 1.55 0.00 0.00 1.71 0.00 0.00 3.06 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.48 1.26 7.81 59 I 7.53 3.98 1.77 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.03 0.85 0.00 0.00 60 H 8.03 4.75 0.00 3.09 3.36 0.00 5.70 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 T 6.96 3.84 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 1.20 0.00 0.00 62 G 8.16 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 0.00 0.00 0.00 63 I 7.69 3.75 1.75 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.50 0.79 0.00 0.00 64 K 8.06 4.21 0.00 1.59 1.66 0.00 1.74 0.00 0.00 1.67 0.00 0.00 3.04 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.21 1.42 7.81 65 P 0.00 4.09 0.00 1.47 1.80 0.00 3.24 0.00 0.00 3.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 1.34 0.00 66 Y 6.50 4.36 0.00 2.43 1.43 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 0.00 0.00 0.00 0.00 67 E 8.50 5.37 0.00 1.94 1.80 0.00 0.00 0.00 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 2.62 0.00 68 C 9.58 4.61 0.00 3.31 3.14 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 69 N 8.69 4.73 0.00 2.62 2.77 0.00 0.00 6.85 7.45 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 70 I 7.59 3.91 1.91 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 -0.15 1.09 0.00 0.00 71 C 8.12 4.30 0.00 3.18 3.26 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 72 A 8.04 4.69 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 73 K 7.56 4.24 0.00 1.80 1.42 0.00 1.84 0.00 0.00 1.74 0.00 0.00 3.01 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.39 1.48 7.81 74 R 7.94 5.05 0.00 1.49 1.70 0.00 3.10 0.00 0.00 3.14 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.54 0.00 75 F 9.01 4.98 0.00 3.23 3.14 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 76 M 9.15 4.18 0.00 1.98 1.83 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 2.63 0.00 77 W 8.15 4.61 0.00 3.58 3.30 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 78 R 8.94 4.04 0.00 1.98 2.00 0.00 3.14 0.00 0.00 3.34 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.29 0.00 79 D 8.34 4.45 0.00 2.76 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 80 S 8.17 4.07 0.00 4.06 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 81 F 7.94 3.79 0.00 3.35 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 82 H 8.35 3.46 0.00 3.12 3.15 0.00 5.89 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 R 8.14 3.83 0.00 1.84 2.07 0.00 3.03 0.00 0.00 3.04 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.59 0.00 84 H 8.10 3.93 0.00 3.02 2.94 0.00 5.86 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 V 7.46 3.49 1.60 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 0.78 0.00 0.00 0.52 0.00 0.00 86 T 7.83 3.77 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 1.15 0.00 0.00 87 S 7.38 4.23 0.00 3.96 4.04 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 88 C 8.16 3.74 0.00 2.79 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 89 T 7.98 4.04 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 1.24 0.00 0.00 90 K 7.54 4.07 0.00 1.94 1.88 0.00 1.72 0.00 0.00 1.69 0.00 0.00 3.04 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.69 1.66 7.81 91 S 8.05 4.26 0.00 3.90 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 92 Y 7.48 4.01 0.00 2.95 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 93 E 9.03 4.07 0.00 2.26 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 2.43 2.45 0.00 94 A 7.60 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 95 A 7.82 4.02 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 0.00 0.00 0.00 0.00 0.00 96 K 7.98 3.70 0.00 1.76 2.11 0.00 2.00 0.00 0.00 1.77 0.00 0.00 3.31 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.58 1.58 7.81 97 A 7.88 3.80 1.41 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 0.00 0.00 98 E 8.46 3.97 0.00 1.95 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 2.33 2.31 0.00 99 Q 7.76 4.56 0.00 2.14 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.78 0.00 0.00 0.00 0.00 0.00 2.21 2.31 0.00 100 N 7.93 4.74 0.00 2.67 2.74 0.00 0.00 6.97 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 0.00 101 T 8.14 4.00 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 0.00 102 T 8.20 4.22 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 1.20 0.00 0.00 103 E 8.33 4.15 0.00 1.90 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 2.27 2.36 0.00 104 A 8.37 3.99 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 0.00 105 S 8.23 4.64 0.00 3.83 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 0.00 106 G 8.33 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 0.00 107 P 0.00 4.55 0.00 2.19 2.10 0.00 3.71 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.98 0.00 108 S 8.20 4.60 0.00 3.82 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 0.00 109 S 8.73 4.33 0.00 3.97 3.97 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 0.00 110 G 8.11 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 0.00 0.00 0.00