NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 I 4.1057 8.0249 114.2709 60.4772 39.6717 175.1983 2 Q 4.7419 7.7855 120.6343 53.5473 30.7482 173.5752 3 R 4.6577 9.4412 121.2147 54.5895 34.5833 174.4660 4 T 4.9634 9.0076 119.3731 60.9733 68.0852 172.0720 5 P 4.8985 0.0000 0.0000 62.9249 32.7206 175.3357 6 K 4.7520 9.2922 120.3590 55.0362 34.8356 175.6621 7 I 5.2160 8.2202 122.7499 59.8447 41.0295 174.6030 8 Q 4.8292 9.4469 125.5270 54.0880 32.2637 174.4262 9 V 5.0756 8.6481 123.8093 61.4491 33.9263 173.8823 10 Y 5.3558 8.2358 124.8877 56.8520 41.7553 173.0883 11 S 5.1461 8.9588 113.9034 56.6279 64.9684 174.4861 12 R 4.1660 8.7121 121.8844 59.0898 30.2842 176.2814 13 H 5.1162 8.2288 113.2471 52.6304 32.6846 171.1704 14 P 4.2707 0.0000 0.0000 62.8562 31.5019 176.4170 15 A 4.1275 8.8698 126.5371 52.3067 18.8947 176.2348 16 E 4.4998 8.5561 123.1754 54.0683 32.0406 174.2057 17 N 4.4613 8.7931 123.2671 55.3979 38.9965 175.5944 18 G 4.0561 9.0472 111.8608 45.1349 0.0000 173.6906 19 K 4.2320 7.6252 119.3301 54.8827 32.8833 176.7823 20 S 4.0969 8.4971 118.6449 58.8339 63.0647 172.6017 21 N 5.0621 9.1678 125.4941 52.6071 42.8137 171.9217 22 F 5.1373 9.5185 115.8729 55.8973 43.2677 173.7194 23 L 4.3404 8.7217 126.0804 53.2669 43.6937 174.7365 24 N 5.3668 8.8800 123.6162 51.4618 42.1827 172.9647 25 C 5.2045 9.4700 122.2175 55.1554 47.7229 172.0479 26 Y 5.3608 9.5159 129.7653 56.5333 40.0302 174.1763 27 V 4.8777 8.8527 127.8635 61.3163 34.2642 174.7655 28 S 5.1147 8.3753 121.0761 58.2357 66.7211 174.8282 29 G 4.4427 8.8610 106.3393 47.2202 0.0000 173.0480 30 F 5.8064 7.5721 113.8775 54.9048 41.0952 174.1563 31 H 5.2242 8.6059 119.0714 54.6047 33.2906 171.4750 32 P 4.8553 0.0000 0.0000 62.1956 32.1175 176.4360 33 S 3.8915 8.1823 113.5009 60.6977 63.0413 174.7262 34 D 4.3847 7.8501 121.2466 54.5970 40.9143 175.0169 35 I 4.5243 7.7269 122.1927 60.1585 41.3415 172.8029 36 E 4.6486 8.8421 125.7703 54.3567 32.8111 174.3825 37 V 4.6758 7.9978 125.1120 61.2102 34.9779 174.0781 38 D 4.7638 8.6518 125.4135 52.6620 45.4934 174.2386 39 L 4.9573 8.4762 122.0388 53.4604 44.0096 175.3888 40 L 5.1572 9.1715 122.6566 52.7638 45.6047 175.6115 41 K 4.2360 9.0761 124.1183 54.5052 34.3724 175.6501 42 N 4.3500 9.4279 128.0488 54.4980 36.1603 176.2232 43 G 3.9160 8.4152 105.1434 45.3837 0.0000 173.3596 44 E 4.5491 7.4358 120.8974 53.6562 31.3071 175.0945 45 R 4.3003 8.4776 126.0923 56.6549 30.7326 175.5506 46 I 4.2925 8.2530 126.2557 60.3069 38.5020 175.5238 47 E 4.1531 8.7763 125.7486 58.8136 30.4540 177.6369 48 K 4.3345 7.7641 117.5522 55.8351 30.2633 176.0961 49 V 4.5008 7.3555 118.2989 61.0896 34.2155 175.2642 50 E 4.5803 8.5500 127.2466 55.0996 32.6745 174.2178 51 H 5.6002 7.7584 114.3229 55.1838 30.9991 173.4761 52 S 4.5736 8.6229 115.0823 58.1404 64.3254 173.0097 53 D 4.6937 8.4274 119.7314 52.7930 41.7443 176.3058 54 L 4.0104 8.5277 123.8156 56.4960 42.5326 176.2533 55 S 4.9081 8.4124 119.8508 57.1495 68.0119 172.4679 56 F 5.2857 7.7840 114.3334 55.8709 41.0709 174.3596 57 S 4.6763 9.4226 116.8800 57.0649 64.2273 175.6766 58 K 3.7156 8.3768 120.0833 59.0928 31.7085 177.7864 59 D 4.5031 7.8899 116.8828 52.6834 39.3798 177.5387 60 W 3.7683 7.7881 118.9920 57.1167 28.4059 174.6565 61 S 4.3750 8.2093 114.3380 58.0186 63.9765 174.1728 62 F 4.9789 8.5878 121.6567 57.6594 40.6251 173.9642 63 Y 5.5639 8.4150 117.3357 56.4330 41.5668 173.6115 64 L 5.2080 9.7955 119.9525 53.4669 47.1872 174.6694 65 L 5.4568 9.4055 123.6168 53.8424 45.0262 174.5882 66 Y 5.1004 9.3469 124.6160 56.5895 40.5417 174.4938 67 Y 5.8275 8.5868 120.5913 56.4226 42.3972 173.4947 68 T 4.8676 8.2152 112.6592 60.8351 70.9963 171.9095 69 E 4.0229 8.7466 130.0402 55.9210 30.4058 175.4117 70 F 4.9355 9.1549 120.9007 55.9900 42.3798 173.4600 71 T 4.2555 8.1946 114.9854 60.6311 70.2352 172.3146 72 P 4.6048 0.0000 0.0000 63.1398 32.5614 175.8547 73 T 5.1305 8.4185 110.6557 58.5511 72.1092 173.5752 74 E 4.1132 8.9664 123.3487 58.8812 29.8262 177.9983 75 K 4.2822 7.9390 116.1253 58.3693 33.6389 177.0310 76 D 4.3800 8.0497 119.6462 54.4581 41.3947 175.0421 77 E 4.9560 8.7978 124.2429 54.7711 32.5209 174.1965 78 Y 5.4560 8.6851 121.4375 56.7905 42.9436 173.8508 79 A 5.0693 8.9944 122.5751 51.5262 23.9642 174.0328 80 C 5.2577 9.3157 118.6960 54.9063 47.1313 172.5312 81 R 5.1033 9.1315 126.8017 54.5364 32.1990 174.4940 82 V 4.8317 9.0160 126.3689 60.9611 34.9950 173.5254 83 N 5.2254 9.0291 125.8789 52.1212 41.6390 172.4920 84 H 5.1803 8.5629 124.6000 54.1534 33.5965 174.2595 85 V 3.5873 8.0698 121.7763 64.8396 31.4392 177.3796 86 T 4.1559 8.1254 108.7625 62.4735 69.1020 173.4599 87 L 5.0243 7.5802 122.8484 53.2943 43.7175 176.8056 88 S 4.3582 8.6871 118.8372 60.7705 63.3183 174.7503 89 Q 4.6414 7.5494 116.0929 52.8489 32.2721 173.0844 90 P 4.4375 0.0000 0.0000 63.2972 32.3397 175.3555 91 K 4.5183 9.2287 124.6804 54.9181 34.1255 174.8250 92 I 4.9447 8.3765 127.8519 59.5038 39.5578 174.9550 93 V 4.4152 8.8932 127.1268 60.8595 33.7665 175.0100 94 K 4.7173 8.7677 127.4888 55.9942 33.0922 176.4377 95 W 4.6608 9.3062 134.6512 57.0644 31.6340 175.0168 96 D 4.4637 8.5413 126.3849 51.9689 42.0615 175.9649 97 R 3.3031 7.7532 127.7496 59.1627 29.9100 176.3442 98 D 4.8937 7.9984 115.6304 54.1480 41.0310 176.3315 99 M 4.3926 8.1774 125.4519 55.6975 33.0372 175.1348 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 I 8.02 4.11 1.88 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 1.42 1.14 0.89 0.00 0.00 2 Q 7.79 4.74 0.00 2.09 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.09 6.72 0.00 0.00 0.00 0.00 0.00 2.36 2.49 0.00 3 R 9.44 4.66 0.00 1.78 1.94 0.00 3.18 0.00 0.00 3.18 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.63 0.00 4 T 9.01 4.96 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 1.24 0.00 0.00 5 P 0.00 4.90 0.00 2.01 1.79 0.00 3.74 0.00 0.00 3.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.75 0.00 6 K 9.29 4.75 0.00 1.69 1.77 0.00 1.64 0.00 0.00 1.68 0.00 0.00 2.85 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.41 1.44 7.81 7 I 8.22 5.22 1.91 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 1.32 0.59 0.95 0.00 0.00 8 Q 9.45 4.83 0.00 2.40 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.75 0.00 0.00 0.00 0.00 0.00 2.39 2.44 0.00 9 V 8.65 5.08 2.34 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 0.90 0.00 0.00 1.12 0.00 0.00 10 Y 8.24 5.36 0.00 3.25 3.21 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 11 S 8.96 5.15 0.00 4.31 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 12 R 8.71 4.17 0.00 1.85 2.03 0.00 3.07 0.00 0.00 3.01 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 1.45 0.00 13 H 8.23 5.12 0.00 3.21 3.18 0.00 5.78 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 14 P 0.00 4.27 0.00 2.10 2.09 0.00 3.78 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.18 0.00 15 A 8.87 4.13 1.66 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 16 E 8.56 4.50 0.00 1.97 1.78 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 2.26 2.31 0.00 17 N 8.79 4.46 0.00 2.80 2.80 0.00 0.00 7.20 8.02 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 18 G 9.05 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 19 K 7.63 4.23 0.00 1.76 1.72 0.00 1.71 0.00 0.00 1.62 0.00 0.00 2.74 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.55 1.69 7.81 20 S 8.50 4.10 0.00 3.75 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 21 N 9.17 5.06 0.00 2.34 2.23 0.00 0.00 6.71 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 22 F 9.52 5.14 0.00 2.93 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 23 L 8.72 4.34 0.00 0.27 0.60 -0.29 -0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 24 N 8.88 5.37 0.00 1.49 2.21 0.00 0.00 5.99 8.29 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 25 C 9.47 5.20 0.00 2.89 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 26 Y 9.52 5.36 0.00 3.32 3.17 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 0.00 0.00 0.00 27 V 8.85 4.88 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 0.74 0.00 0.00 0.92 0.00 0.00 28 S 8.38 5.11 0.00 3.85 3.38 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 29 G 8.86 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 30 F 7.57 5.81 0.00 3.00 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 31 H 8.61 5.22 0.00 3.32 3.38 0.00 5.67 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 P 0.00 4.86 0.00 2.09 2.13 0.00 3.94 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.98 0.00 33 S 8.18 3.89 0.00 3.26 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 34 D 7.85 4.38 0.00 2.64 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 35 I 7.73 4.52 1.55 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.39 0.82 0.00 0.00 36 E 8.84 4.65 0.00 1.97 1.61 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 2.08 2.15 0.00 37 V 8.00 4.68 0.67 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 0.39 0.00 0.00 0.55 0.00 0.00 38 D 8.65 4.76 0.00 2.51 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 39 L 8.48 4.96 0.00 1.58 1.53 0.86 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 40 L 9.17 5.16 0.00 1.52 1.50 0.91 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 41 K 9.08 4.24 0.00 1.72 1.59 0.00 1.90 0.00 0.00 1.65 0.00 0.00 2.81 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.05 0.53 7.81 42 N 9.43 4.35 0.00 2.79 2.84 0.00 0.00 7.08 7.30 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 43 G 8.42 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 44 E 7.44 4.55 0.00 1.95 1.77 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 2.20 2.20 0.00 45 R 8.48 4.30 0.00 1.79 1.81 0.00 3.26 0.00 0.00 3.21 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.64 0.00 46 I 8.25 4.29 1.95 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.83 0.92 0.00 0.00 47 E 8.78 4.15 0.00 1.90 1.96 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 2.26 2.38 0.00 48 K 7.76 4.33 0.00 1.77 1.77 0.00 1.64 0.00 0.00 1.63 0.00 0.00 3.05 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.44 1.48 7.81 49 V 7.36 4.50 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 0.99 0.00 0.00 0.98 0.00 0.00 50 E 8.55 4.58 0.00 1.16 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 2.01 2.20 0.00 51 H 7.76 5.60 0.00 2.05 1.45 0.00 5.33 0.00 0.00 0.00 0.00 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 S 8.62 4.57 0.00 3.99 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 53 D 8.43 4.69 0.00 2.70 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 54 L 8.53 4.01 0.00 1.67 1.67 0.95 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 55 S 8.41 4.91 0.00 2.90 3.37 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 0.00 56 F 7.78 5.29 0.00 2.57 2.19 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 57 S 9.42 4.68 0.00 4.11 3.85 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 58 K 8.38 3.72 0.00 1.62 1.68 0.00 1.65 0.00 0.00 1.65 0.00 0.00 2.99 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.27 1.31 7.81 59 D 7.89 4.50 0.00 2.78 2.72 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 60 W 7.79 3.77 0.00 3.38 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 61 S 8.21 4.37 0.00 3.90 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 62 F 8.59 4.98 0.00 1.86 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 63 Y 8.41 5.56 0.00 3.17 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 64 L 9.80 5.21 0.00 1.91 1.87 1.25 0.62 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 65 L 9.41 5.46 0.00 2.03 1.71 1.14 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 66 Y 9.35 5.10 0.00 3.02 2.87 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 0.00 0.00 0.00 67 Y 8.59 5.83 0.00 3.02 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 68 T 8.22 4.87 4.19 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 1.00 0.00 0.00 69 E 8.75 4.02 0.00 1.42 1.63 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 2.05 1.99 0.00 70 F 9.15 4.94 0.00 2.95 2.72 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 71 T 8.19 4.26 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 1.12 0.00 0.00 72 P 0.00 4.60 0.00 2.05 2.21 0.00 3.28 0.00 0.00 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.67 0.00 73 T 8.42 5.13 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 1.37 0.00 0.00 74 E 8.97 4.11 0.00 1.98 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 2.31 2.26 0.00 75 K 7.94 4.28 0.00 1.92 1.94 0.00 1.68 0.00 0.00 1.74 0.00 0.00 3.00 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.39 1.41 7.81 76 D 8.05 4.38 0.00 2.94 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 77 E 8.80 4.96 0.00 2.10 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 2.28 2.31 0.00 78 Y 8.69 5.46 0.00 3.21 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 79 A 8.99 5.07 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 80 C 9.32 5.26 0.00 2.97 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 81 R 9.13 5.10 0.00 1.82 1.68 0.00 3.05 0.00 0.00 3.06 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.50 0.00 82 V 9.02 4.83 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 0.52 0.00 0.00 0.81 0.00 0.00 83 N 9.03 5.23 0.00 2.76 2.53 0.00 0.00 6.33 8.60 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 84 H 8.56 5.18 0.00 3.00 2.97 0.00 5.73 0.00 0.00 0.00 0.00 6.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 V 8.07 3.59 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 0.68 0.00 0.00 0.90 0.00 0.00 86 T 8.13 4.16 4.31 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 1.39 0.00 0.00 87 L 7.58 5.02 0.00 1.75 1.77 0.92 0.74 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 88 S 8.69 4.36 0.00 3.86 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 89 Q 7.55 4.64 0.00 1.97 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.53 6.88 0.00 0.00 0.00 0.00 0.00 2.24 2.28 0.00 90 P 0.00 4.44 0.00 1.90 1.96 0.00 3.63 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 2.07 0.00 91 K 9.23 4.52 0.00 1.75 1.63 0.00 1.59 0.00 0.00 1.64 0.00 0.00 2.86 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.35 1.40 7.81 92 I 8.38 4.94 1.88 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 1.22 0.75 0.93 0.00 0.00 93 V 8.89 4.42 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 1.16 0.00 0.00 0.96 0.00 0.00 94 K 8.77 4.72 0.00 1.75 1.81 0.00 1.82 0.00 0.00 1.67 0.00 0.00 2.86 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.50 1.48 7.81 95 W 9.31 4.66 0.00 3.25 3.44 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 96 D 8.54 4.46 0.00 2.63 2.44 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 97 R 7.75 3.30 0.00 1.09 1.67 0.00 3.21 0.00 0.00 3.40 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.68 0.00 98 D 8.00 4.89 0.00 2.76 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 99 M 8.18 4.39 0.00 1.98 2.01 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.58 0.00