NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 D 4.6016 8.3644 120.3152 53.5041 41.5582 176.4966 2 R 3.7776 7.6988 118.7472 57.7740 30.1430 175.4358 3 I 3.8491 8.4070 118.0759 61.6017 39.4882 175.8045 4 C 4.9672 8.3484 125.6425 56.4140 35.8147 173.5999 5 T 4.3567 7.6889 110.5553 60.9463 70.6730 172.2011 6 N 4.9450 7.7287 116.4780 52.4497 39.3127 174.1447 7 C 2.8661 8.3073 116.3419 59.0492 38.4688 176.6377 8 C 4.7406 8.2452 118.7450 58.5852 44.0712 173.4360 9 A 4.8090 8.0566 123.6088 50.8239 18.3135 175.9083 10 G 4.4758 8.1487 115.9014 45.0351 0.0000 174.7905 11 T 4.4667 8.4644 127.8607 60.9957 71.1688 173.1256 12 K 4.1235 8.0494 127.4605 57.0922 32.7116 177.1686 13 G 4.0308 8.0179 114.5914 45.6428 0.0000 172.8229 14 C 4.5643 7.4682 117.6836 55.6348 40.3893 173.6509 15 K 4.8240 8.5371 123.4202 55.6238 31.7088 175.3941 16 Y 4.4654 8.1719 122.4063 58.8671 39.0940 175.6529 17 F 4.9685 9.3338 124.2949 56.8065 43.8175 172.5565 18 S 5.0102 7.7137 118.6419 55.2243 63.8311 174.7558 19 D 4.6294 8.9043 126.4481 56.3331 39.0268 177.5513 20 D 4.3430 7.2833 117.8600 54.8971 39.2096 177.1129 21 G 4.3537 8.3242 108.8591 45.8936 0.0000 173.3752 22 T 4.6694 7.1192 113.7917 60.9888 72.5376 173.6273 23 F 4.8855 8.6417 125.7169 58.3447 39.8138 173.4205 24 V 3.9970 5.8574 120.4013 62.8778 32.8485 174.0764 25 C 4.7163 6.5356 112.1703 54.9551 44.7578 170.8803 26 E 5.1042 8.9586 119.1476 54.1584 31.5850 175.6066 27 G 3.9125 8.4211 113.3760 45.9174 0.0000 173.1654 28 E 4.6356 9.1819 131.5769 55.9082 30.0063 175.9832 29 S 5.0262 8.1760 112.1107 55.0371 62.9197 169.9789 30 D 4.6896 8.0849 123.0738 51.7713 41.8979 175.4340 31 P 4.3237 0.0000 0.0000 65.7730 31.5486 177.3756 32 R 4.2380 8.0830 115.3572 56.1837 30.1957 176.1352 33 N 4.4167 7.6316 117.0857 52.5640 37.7137 173.6327 34 P 4.6234 0.0000 0.0000 62.7256 31.5960 174.6573 35 K 4.5933 7.5401 116.4639 56.0405 36.4372 175.8661 36 A 4.4831 8.1768 121.5212 51.2561 21.1341 177.0412 37 C 4.5663 8.6228 120.6545 56.6277 41.3467 173.1942 38 T 4.3301 8.0624 115.9966 61.6740 67.8073 173.7548 39 L 4.6184 8.0834 121.9491 55.2258 40.7151 176.2624 40 N 4.2857 7.4409 115.3329 54.4974 38.8827 173.8427 41 C 4.5113 8.5543 120.0283 56.1265 35.8917 173.6808 42 D 4.7160 8.2839 123.5480 51.2015 40.5380 174.0321 43 P 4.3322 0.0000 0.0000 64.7963 32.0985 178.8770 44 R 3.9047 8.0366 115.6178 58.7386 29.3668 176.6792 45 I 3.7662 7.1482 116.6320 61.6381 38.5535 174.1054 46 A 4.7568 8.5576 125.3831 52.9284 21.1403 175.3461 47 Y 4.6481 7.1128 110.5698 56.7611 41.2677 172.4466 48 G 4.3258 8.8991 106.5020 44.2455 0.0000 173.4306 49 V 4.1422 8.6813 126.6408 61.2942 31.9174 175.6879 50 C 4.8759 8.8141 124.3921 55.4523 41.0995 173.3020 51 P 3.9897 0.0000 0.0000 65.8788 30.9904 177.5789 52 R 3.7621 7.2457 116.2148 54.0463 29.6810 176.3759 53 S 3.7189 8.1784 120.5986 58.8648 60.2769 171.8329 54 E 4.5040 8.2967 123.0604 56.1456 29.3139 176.1553 55 E 4.5577 7.8806 119.5703 54.5197 31.5651 175.6050 56 K 4.6492 8.1490 121.7928 54.1079 38.0769 177.8389 57 K 4.1166 8.7834 125.9315 57.8502 30.2927 177.9081 58 N 4.3180 9.4544 111.7029 56.1365 39.5904 173.9280 59 D 4.5088 7.9599 120.2854 54.1068 40.3832 173.6526 60 R 3.7858 8.4691 114.2977 56.7605 28.6087 175.4679 61 I 4.1863 7.3443 118.0298 60.9674 38.2175 175.2166 62 C 5.0139 8.3545 128.4052 56.4782 39.1105 174.0327 63 T 4.5129 7.6714 109.1004 61.3866 71.2753 173.2612 64 N 4.8612 7.9241 118.8661 52.6001 42.2944 175.4465 65 C 3.8922 8.8114 122.3644 59.6384 44.1753 174.8928 66 C 4.4694 8.2740 118.4351 58.4208 42.2614 174.5220 67 A 3.7518 8.0702 124.7816 54.5595 18.5422 178.1720 68 G 3.3125 7.4534 104.7856 45.5499 0.0000 172.5878 69 T 4.5991 9.0108 115.1625 61.1778 68.0921 175.0348 70 K 4.8537 8.1282 128.9125 56.6673 32.1477 177.4562 71 G 4.1822 8.3512 105.2845 44.7189 0.0000 172.9318 72 C 4.8493 7.8295 116.3797 55.2432 45.9970 173.5186 73 K 4.4506 8.1873 121.8543 54.5456 31.8544 174.4505 74 Y 4.3771 8.7136 121.6552 58.7854 39.1367 175.3541 75 F 5.4668 9.7404 124.9808 56.5169 44.0740 172.9713 76 S 4.8395 7.5538 118.3057 56.2481 64.1561 174.5937 77 D 4.5265 8.2818 128.2368 56.5155 39.2905 177.0388 78 D 4.8115 7.5058 116.6389 52.4117 39.3976 177.1987 79 G 3.8303 7.7213 103.6129 46.0893 0.0000 175.2711 80 T 2.7872 7.4369 114.9864 62.1949 68.1679 170.0666 81 F 4.7495 9.1102 120.9203 59.7529 38.8246 175.3215 82 V 3.7658 7.8417 129.8351 62.7576 31.2639 174.9790 83 C 4.2728 8.2488 111.9495 54.8901 45.6447 171.6705 84 E 5.2056 9.1185 120.3744 54.7226 30.7554 175.8152 85 G 4.0644 8.7778 112.1011 46.2057 0.0000 173.3600 86 E 4.8000 8.3255 123.0074 55.8871 30.5788 175.4244 87 S 4.5909 7.6349 114.0632 58.2104 66.3760 172.2839 88 D 5.0529 8.4076 118.2397 51.7814 43.9760 174.1456 89 P 4.2821 0.0000 0.0000 65.9895 31.7301 178.1273 90 R 4.0550 8.1900 116.3349 58.8296 30.1546 176.6155 91 N 4.7157 7.6817 114.3187 50.8622 38.4707 173.2736 92 P 4.5693 0.0000 0.0000 62.6557 32.5635 174.8522 93 K 4.3937 8.0036 117.0981 55.4743 34.7199 174.0532 94 A 4.6497 8.2239 126.2914 51.1651 20.4342 177.1529 95 C 4.7997 8.6194 117.4185 55.9345 44.0016 172.9841 96 P 3.9417 0.0000 0.0000 64.9591 30.7630 176.7109 97 R 4.5297 6.8571 118.7560 53.8908 37.5303 177.1871 98 N 4.2709 9.2728 116.0945 52.5150 40.8273 170.3608 99 C 3.9819 8.6968 124.8911 57.2985 41.5401 173.4583 100 D 4.5994 8.4202 123.4815 51.1426 41.0835 173.2831 101 P 4.2496 0.0000 0.0000 65.0955 31.1442 178.2012 102 R 4.1099 7.4307 118.2820 58.7136 30.1035 176.7748 103 I 4.0344 7.4093 117.1206 61.6882 38.4871 174.2730 104 A 4.3551 8.9252 122.4694 53.3155 22.1856 175.5237 105 Y 4.6255 7.8666 111.6056 57.4466 42.5039 173.7417 106 G 3.9713 8.7403 109.4588 45.8316 0.0000 173.5804 107 I 4.1359 8.7727 129.4164 60.4846 36.3511 173.1223 108 C 4.7670 8.1818 122.7301 55.0538 39.5909 171.3035 109 P 4.2089 0.0000 0.0000 63.1056 30.7387 176.7898 110 L 4.0649 8.4154 122.6407 55.4430 42.1327 177.0489 111 A 4.1742 7.4090 127.0080 52.4117 19.2759 175.8443 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 D 8.36 4.60 0.00 2.80 2.86 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 R 7.70 3.78 0.00 1.79 2.00 0.00 3.44 0.00 0.00 3.20 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.78 0.00 3 I 8.41 3.85 1.88 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.80 0.91 0.00 0.00 4 C 8.35 4.97 0.00 2.92 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 5 T 7.69 4.36 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 1.24 0.00 0.00 6 N 7.73 4.94 0.00 2.66 2.92 0.00 0.00 5.86 7.73 0.00 0.00 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 C 8.31 2.87 0.00 2.62 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 8 C 8.25 4.74 0.00 2.96 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 9 A 8.06 4.81 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 10 G 8.15 4.48 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 T 8.46 4.47 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 1.19 0.00 0.00 12 K 8.05 4.12 0.00 1.87 1.73 0.00 1.67 0.00 0.00 2.39 0.00 0.00 2.83 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.44 1.59 7.81 13 G 8.02 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 14 C 7.47 4.56 0.00 2.73 2.84 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 15 K 8.54 4.82 0.00 2.09 2.16 0.00 1.84 0.00 0.00 1.84 0.00 0.00 2.93 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.51 1.62 7.81 16 Y 8.17 4.47 0.00 2.99 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 17 F 9.33 4.97 0.00 2.96 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 0.00 0.00 0.00 0.00 18 S 7.71 5.01 0.00 3.64 3.45 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 19 D 8.90 4.63 0.00 2.87 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 D 7.28 4.34 0.00 2.78 2.78 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 21 G 8.32 4.35 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 0.00 22 T 7.12 4.67 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 1.21 0.00 0.00 23 F 8.64 4.89 0.00 3.06 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 24 V 5.86 4.00 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 0.58 0.00 0.00 0.66 0.00 0.00 25 C 6.54 4.72 0.00 2.99 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 26 E 8.96 5.10 0.00 2.20 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 2.31 2.31 0.00 27 G 8.42 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 28 E 9.18 4.64 0.00 2.18 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 0.00 2.22 2.25 0.00 29 S 8.18 5.03 0.00 4.11 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 30 D 8.08 4.69 0.00 2.81 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 0.00 0.00 0.00 0.00 31 P 0.00 4.32 0.00 2.23 2.18 0.00 3.83 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 2.00 2.00 0.00 32 R 8.08 4.24 0.00 2.12 2.01 0.00 3.22 0.00 0.00 3.28 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.62 0.00 33 N 7.63 4.42 0.00 2.86 2.94 0.00 0.00 7.00 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 34 P 0.00 4.62 0.00 2.20 2.17 0.00 3.71 0.00 0.00 3.81 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 35 K 7.54 4.59 0.00 1.86 1.74 0.00 1.67 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.36 1.36 7.81 36 A 8.18 4.48 1.19 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 0.00 0.00 37 C 8.62 4.57 0.00 2.98 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 38 T 8.06 4.33 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 1.24 0.00 0.00 39 L 8.08 4.62 0.00 1.76 1.70 0.91 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 40 N 7.44 4.29 0.00 2.73 2.77 0.00 0.00 6.83 7.52 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 41 C 8.55 4.51 0.00 2.93 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 42 D 8.28 4.72 0.00 2.64 2.46 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.33 0.00 2.19 2.15 0.00 3.79 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.93 0.00 44 R 8.04 3.90 0.00 1.90 2.17 0.00 2.90 0.00 0.00 3.14 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.50 0.00 45 I 7.15 3.77 2.10 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.95 0.95 0.00 0.00 46 A 8.56 4.76 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 47 Y 7.11 4.65 0.00 3.08 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 48 G 8.90 4.33 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 0.00 49 V 8.68 4.14 2.16 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 0.88 0.00 0.00 0.92 0.00 0.00 50 C 8.81 4.88 0.00 3.03 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 51 P 0.00 3.99 0.00 2.02 2.14 0.00 3.65 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.13 0.00 52 R 7.25 3.76 0.00 1.91 2.07 0.00 3.30 0.00 0.00 3.21 7.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.58 0.00 53 S 8.18 3.72 0.00 3.96 3.80 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 0.00 0.00 0.00 54 E 8.30 4.50 0.00 1.90 1.92 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 2.26 2.36 0.00 55 E 7.88 4.56 0.00 1.77 1.65 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 2.06 2.18 0.00 56 K 8.15 4.65 0.00 1.75 1.71 0.00 1.72 0.00 0.00 1.57 0.00 0.00 2.85 0.00 0.00 3.24 0.00 0.00 0.00 0.00 1.28 1.30 7.81 57 K 8.78 4.12 0.00 1.68 1.25 0.00 1.66 0.00 0.00 1.71 0.00 0.00 2.93 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.42 1.51 7.81 58 N 9.45 4.32 0.00 2.73 2.83 0.00 0.00 6.83 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 59 D 7.96 4.51 0.00 2.93 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 60 R 8.47 3.79 0.00 1.98 2.00 0.00 3.01 0.00 0.00 3.15 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.58 0.00 61 I 7.34 4.19 1.85 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 1.28 1.09 0.89 0.00 0.00 62 C 8.35 5.01 0.00 2.91 2.96 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 63 T 7.67 4.51 4.16 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 1.23 0.00 0.00 64 N 7.92 4.86 0.00 2.83 2.53 0.00 0.00 6.46 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 65 C 8.81 3.89 0.00 2.98 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 66 C 8.27 4.47 0.00 2.97 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 67 A 8.07 3.75 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 68 G 7.45 3.31 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 T 9.01 4.60 4.37 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 70 K 8.13 4.85 0.00 2.00 1.82 0.00 1.67 0.00 0.00 1.60 0.00 0.00 3.04 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.56 1.55 7.81 71 G 8.35 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 72 C 7.83 4.85 0.00 2.44 2.48 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 0.00 0.00 0.00 0.00 73 K 8.19 4.45 0.00 1.75 1.49 0.00 1.55 0.00 0.00 1.39 0.00 0.00 2.44 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.50 1.38 7.81 74 Y 8.71 4.38 0.00 3.26 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 75 F 9.74 5.47 0.00 3.28 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 76 S 7.55 4.84 0.00 3.73 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 77 D 8.28 4.53 0.00 3.14 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 78 D 7.51 4.81 0.00 2.81 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 79 G 7.72 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 0.00 0.00 0.00 80 T 7.44 2.79 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 1.25 0.00 0.00 81 F 9.11 4.75 0.00 3.09 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 82 V 7.84 3.77 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 0.78 0.00 0.00 0.89 0.00 0.00 83 C 8.25 4.27 0.00 2.84 2.94 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 84 E 9.12 5.21 0.00 2.25 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 2.37 2.50 0.00 85 G 8.78 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 86 E 8.33 4.80 0.00 2.01 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 2.27 2.30 0.00 87 S 7.63 4.59 0.00 3.88 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 88 D 8.41 5.05 0.00 2.68 2.43 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 89 P 0.00 4.28 0.00 2.09 2.17 0.00 3.77 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.19 0.00 90 R 8.19 4.05 0.00 2.01 1.99 0.00 3.21 0.00 0.00 3.29 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.62 0.00 91 N 7.68 4.72 0.00 2.85 2.81 0.00 0.00 7.16 7.44 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 92 P 0.00 4.57 0.00 2.20 2.11 0.00 3.81 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.95 0.00 93 K 8.00 4.39 0.00 1.67 1.65 0.00 1.64 0.00 0.00 1.71 0.00 0.00 3.07 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.32 1.47 7.81 94 A 8.22 4.65 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 95 C 8.62 4.80 0.00 2.90 2.94 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 96 P 0.00 3.94 0.00 2.02 2.00 0.00 3.66 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.11 0.00 97 R 6.86 4.53 0.00 1.69 1.68 0.00 3.20 0.00 0.00 3.20 7.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.63 0.00 98 N 9.27 4.27 0.00 2.80 2.97 0.00 0.00 6.84 7.61 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 99 C 8.70 3.98 0.00 3.09 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 0.00 100 D 8.42 4.60 0.00 2.65 2.48 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 0.00 0.00 0.00 0.00 101 P 0.00 4.25 0.00 2.05 2.10 0.00 3.71 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.11 0.00 102 R 7.43 4.11 0.00 2.22 2.01 0.00 3.17 0.00 0.00 3.07 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.68 0.00 103 I 7.41 4.03 2.13 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.96 0.92 0.00 0.00 104 A 8.93 4.36 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 0.00 0.00 105 Y 7.87 4.63 0.00 2.93 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 0.00 106 G 8.74 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 0.00 0.00 0.00 107 I 8.77 4.14 1.87 0.00 0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.73 0.75 0.00 0.00 108 C 8.18 4.77 0.00 2.79 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 0.00 109 P 0.00 4.21 0.00 2.27 2.16 0.00 3.83 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 2.04 1.93 0.00 110 L 8.42 4.06 0.00 1.62 1.71 0.87 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 111 A 7.41 4.17 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