NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 D 4.6191 8.3649 120.5296 54.3224 42.1147 175.0147 3 K 4.2430 8.3756 119.4084 55.8680 33.6707 174.9153 4 I 4.1516 8.2753 122.1168 60.7857 38.8955 175.3083 5 I 3.9645 8.4075 129.0500 61.2579 38.1708 174.8547 6 H 4.9199 8.8458 125.1924 55.1031 29.1955 175.0116 7 L 4.8959 8.5989 123.9381 53.3456 44.1497 175.9328 8 T 5.5625 9.0851 109.5649 58.1380 71.9828 174.6071 9 D 4.5151 9.3939 124.5192 58.7336 40.7772 179.5189 10 D 4.5814 8.0896 120.0828 58.1118 40.2116 179.9164 11 S 4.6112 8.0372 113.9217 59.7576 63.3878 176.0724 12 F 3.8669 8.3076 127.8157 62.1980 39.1822 176.9481 13 D 4.4942 8.4136 120.1364 58.8721 37.9591 180.4913 14 T 4.0269 7.7771 110.4839 64.9343 68.7160 176.1848 15 D 4.5322 8.0303 120.9858 55.5742 40.6156 177.5247 16 V 3.8231 7.2346 116.5784 64.4007 32.6999 177.7267 17 L 3.7881 7.4617 118.8904 57.6244 41.6877 178.8665 18 K 4.2486 7.2685 116.6018 54.6789 32.3091 179.6936 19 A 4.0830 6.9939 119.8488 53.2649 18.7700 176.2769 20 D 4.4899 8.5138 119.7694 53.8219 42.0995 177.7640 21 G 3.8742 8.7293 115.1137 44.1471 0.0000 172.2826 22 A 4.3960 8.1554 119.8692 52.1417 19.7372 176.6350 23 I 4.9910 8.8326 121.5342 59.2109 41.6615 173.6159 24 L 4.9750 8.8748 132.2683 53.9243 43.5017 175.0149 25 V 4.4222 9.1011 127.8397 61.5520 33.6262 174.0225 26 D 4.7193 8.7538 128.3904 52.6475 42.8822 175.0405 27 F 5.2131 9.1221 127.0254 56.7125 40.1538 175.2513 28 W 5.6768 9.0967 120.3038 55.5044 32.4474 173.2858 29 A 3.8137 7.8869 118.9935 50.4371 21.2685 177.4743 30 E 4.0112 8.3819 119.1543 58.7388 29.6596 178.4667 31 W 4.4853 7.4823 113.3863 57.0086 28.9916 177.1090 32 C 4.4631 7.6386 120.9043 55.3383 37.9235 173.4062 33 G 3.8720 8.8235 115.4534 48.0522 0.0000 172.4880 34 P 4.3998 0.0000 0.0000 64.3940 31.2292 179.5464 35 C 4.3986 8.0928 115.6996 59.9068 39.9751 175.9260 36 K 3.9316 7.7773 121.7076 60.1483 31.7682 179.5200 37 M 4.2945 7.8169 118.6727 58.0009 31.7056 179.5389 38 I 4.4330 7.2191 109.3640 61.8720 38.5838 177.3344 39 A 3.7772 7.3504 123.5364 55.1140 18.1612 177.8257 40 P 4.2145 0.0000 0.0000 65.1411 31.3988 178.9610 41 I 3.7689 7.4962 118.8236 64.1875 37.0364 178.1273 42 L 3.9475 8.0066 119.9389 57.7938 41.1925 179.2012 43 D 4.2623 7.7807 118.7993 57.2942 40.7165 178.7033 44 E 4.0038 8.1306 118.9598 59.5285 29.4479 179.4329 45 I 3.8916 8.0166 119.6559 64.5296 36.9797 178.3116 46 A 3.9969 8.5162 120.7616 55.1077 18.5197 179.0391 47 D 4.3713 7.8698 116.4146 57.6329 41.2300 178.1974 48 E 4.0075 8.2796 118.2391 58.4120 29.9316 177.1626 49 Y 4.3846 8.1547 114.9883 56.4345 38.6831 175.2645 50 Q 4.3268 7.0791 121.1824 57.7588 29.6634 175.3543 51 G 4.2454 9.2898 112.7673 45.7485 0.0000 174.4107 52 K 4.6273 8.0509 114.0554 55.7717 34.0956 175.6064 53 L 4.9220 7.7631 120.7590 54.1602 45.2524 174.9199 54 T 4.6868 8.8051 122.2255 61.8092 71.5632 173.3641 55 V 4.8223 8.2632 124.1204 61.1673 34.3924 174.0975 56 A 5.2008 8.9602 127.9254 50.1973 23.3542 174.7330 57 K 4.9376 8.7603 117.1872 54.6404 36.9403 175.9074 58 L 4.9442 8.9397 125.0288 53.1652 45.3690 175.1217 59 N 4.0551 8.8653 126.4817 53.1038 39.1968 175.6953 60 I 4.2770 8.0237 119.8296 63.1474 38.3276 177.3527 61 D 4.5255 8.1491 120.8163 57.5752 40.6272 177.9566 62 Q 4.1893 8.0484 115.4278 57.8008 29.1829 176.1277 63 N 5.0177 7.9368 115.5138 50.8314 39.0994 172.5850 64 P 4.7777 0.0000 0.0000 62.6274 32.4896 178.1578 65 G 3.7123 8.2601 109.1823 48.8771 0.0000 175.7125 66 T 3.9159 8.1299 116.1962 66.3107 69.3779 176.4061 67 A 3.6858 8.3304 122.8031 54.8631 18.0677 177.3620 68 P 4.1204 0.0000 0.0000 66.0791 31.2355 178.7135 69 K 3.7008 7.4127 114.8288 58.7046 31.9052 177.1768 70 Y 4.5324 7.3007 113.6977 56.8311 38.6309 175.6028 71 G 3.9135 8.2939 107.8062 46.4906 0.0000 174.4134 72 I 3.8900 7.7789 120.0652 60.9142 37.6221 176.3535 73 R 4.6075 8.3673 122.2478 56.0777 32.3161 176.1114 74 S 4.6734 7.7917 110.8360 57.0287 65.5852 173.6803 75 I 4.5895 8.1980 117.5418 58.3136 39.7838 173.3223 76 P 5.2457 0.0000 0.0000 62.5740 33.1533 174.9532 77 T 4.8984 8.6066 117.9682 61.8588 72.3112 172.4862 78 L 5.2417 9.3115 127.0683 53.2296 43.9184 175.3190 79 L 5.0918 8.8380 124.6231 52.8788 44.4089 175.3114 80 L 5.0548 8.8686 126.3566 53.8055 43.7473 174.8313 81 F 5.2881 9.6001 126.0273 55.8633 41.1681 175.0795 82 K 4.7170 8.8024 122.4504 54.9883 35.5772 176.3924 83 N 4.2168 9.7979 122.6649 54.4550 36.3884 173.9383 84 G 3.9782 8.6050 99.0959 45.8165 0.0000 173.8447 85 E 4.7335 7.8160 116.7494 54.8556 33.4251 174.1248 86 V 3.5252 8.3980 125.8134 62.5730 31.7215 175.2579 87 A 4.4983 8.8935 129.7498 53.3369 19.9159 176.6008 88 A 4.5868 7.4270 114.2121 51.7574 22.5554 175.5261 89 T 5.0895 8.7784 115.5128 61.9189 72.8815 173.6438 90 K 4.2435 9.0638 126.9146 54.7562 35.5146 174.7385 91 V 4.5492 8.6713 127.2016 62.3825 33.7650 175.6048 92 G 3.8665 9.1638 113.2211 44.2820 0.0000 172.8043 93 A 4.1637 7.9924 121.3112 52.3613 18.8601 176.9200 94 L 4.6098 7.7673 118.8035 53.4026 43.0720 175.7775 95 S 4.4303 8.5742 116.4847 57.4496 65.2731 175.3182 96 K 3.9176 8.6239 122.3431 59.9372 31.8992 178.8177 97 G 3.7136 8.1101 105.0736 47.7150 0.0000 175.5435 98 Q 4.0435 7.6670 119.0263 58.7051 28.7764 178.1373 99 L 3.9837 7.9062 121.3908 58.0679 42.1107 179.1655 100 K 4.0016 8.1803 118.3843 59.4855 32.0440 178.7833 101 E 3.9563 8.1516 119.3555 59.2419 29.1947 178.4984 102 F 4.1734 8.5004 120.7522 61.5174 39.4704 177.1777 103 L 3.5562 8.1148 118.5249 57.7863 41.1352 179.2749 104 D 4.4044 8.4720 118.0183 57.2672 40.8563 178.4480 105 A 4.1276 7.8982 120.0100 53.9450 18.4531 177.6336 106 N 4.7101 7.2168 111.8418 52.6854 40.2592 174.4520 107 L 4.6443 7.4771 118.1103 52.3075 44.0040 176.3528 108 A 4.1522 8.4647 123.4361 52.6114 18.2896 177.5000 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 2 D 8.36 4.62 0.00 2.69 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 3 K 8.38 4.24 0.00 1.77 1.80 0.00 1.73 0.00 0.00 1.70 0.00 0.00 2.93 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.33 1.51 7.81 4 I 8.28 4.15 1.75 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.40 0.74 0.00 0.00 5 I 8.41 3.96 1.78 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 1.18 0.80 0.85 0.00 0.00 6 H 8.85 4.92 0.00 3.06 3.30 0.00 5.68 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 L 8.60 4.90 0.00 1.65 1.65 0.83 0.45 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 8 T 9.09 5.56 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 1.25 0.00 0.00 9 D 9.39 4.52 0.00 2.70 2.82 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 0.00 0.00 0.00 0.00 10 D 8.09 4.58 0.00 2.78 2.58 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 11 S 8.04 4.61 0.00 4.19 4.17 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 12 F 8.31 3.87 0.00 3.37 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 13 D 8.41 4.49 0.00 2.72 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 14 T 7.78 4.03 4.21 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 1.21 0.00 0.00 15 D 8.03 4.53 0.00 2.57 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 16 V 7.23 3.82 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 0.00 0.00 -0.08 0.00 0.00 -0.05 0.00 0.00 17 L 7.46 3.79 0.00 1.86 1.76 1.12 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 18 K 7.27 4.25 0.00 1.79 1.70 0.00 1.83 0.00 0.00 1.71 0.00 0.00 2.92 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.34 1.24 7.81 19 A 6.99 4.08 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 20 D 8.51 4.49 0.00 2.63 2.57 0.00 0.00 0.00 0.00 0.00 0.00 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 8.73 3.87 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 0.00 0.00 0.00 22 A 8.16 4.40 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 23 I 8.83 4.99 1.82 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 1.01 1.57 0.91 0.00 0.00 24 L 8.87 4.97 0.00 1.82 1.52 1.08 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 25 V 9.10 4.42 2.27 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 0.32 0.00 0.00 0.75 0.00 0.00 26 D 8.75 4.72 0.00 2.71 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 27 F 9.12 5.21 0.00 3.19 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 28 W 9.10 5.68 0.00 3.41 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 29 A 7.89 3.81 0.63 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 0.00 0.00 30 E 8.38 4.01 0.00 1.91 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 0.00 2.23 2.28 0.00 31 W 7.48 4.49 0.00 3.51 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 32 C 7.64 4.46 0.00 1.79 2.69 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 33 G 8.82 3.87 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 0.00 0.00 0.00 34 P 0.00 4.40 0.00 2.17 2.11 0.00 3.61 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 2.13 2.19 0.00 35 C 8.09 4.40 0.00 3.21 3.29 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 0.00 36 K 7.78 3.93 0.00 1.88 1.87 0.00 1.75 0.00 0.00 1.82 0.00 0.00 3.22 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.54 1.53 7.81 37 M 7.82 4.29 0.00 2.08 1.97 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.41 0.00 38 I 7.22 4.43 1.82 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.75 0.94 0.00 0.00 39 A 7.35 3.78 1.15 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 0.00 0.00 40 P 0.00 4.21 0.00 2.14 2.07 0.00 3.49 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.12 0.00 41 I 7.50 3.77 1.99 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 1.63 0.60 0.90 0.00 0.00 42 L 8.01 3.95 0.00 1.73 1.62 0.78 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 43 D 7.78 4.26 0.00 2.79 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 44 E 8.13 4.00 0.00 2.26 2.02 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 2.33 2.35 0.00 45 I 8.02 3.89 2.00 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 1.71 0.90 0.81 0.00 0.00 46 A 8.52 4.00 1.32 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 0.00 0.00 0.00 0.00 0.00 0.00 47 D 7.87 4.37 0.00 2.71 2.81 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 48 E 8.28 4.01 0.00 2.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 2.21 0.00 49 Y 8.15 4.38 0.00 3.27 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 50 Q 7.08 4.33 0.00 2.33 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.87 0.00 0.00 0.00 0.00 0.00 2.38 2.33 0.00 51 G 9.29 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 52 K 8.05 4.63 0.00 1.86 1.87 0.00 1.60 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.42 1.44 7.81 53 L 7.76 4.92 0.00 1.63 1.75 0.95 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 54 T 8.81 4.69 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 1.17 0.00 0.00 55 V 8.26 4.82 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 0.91 0.00 0.00 0.90 0.00 0.00 56 A 8.96 5.20 1.05 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 0.00 0.00 57 K 8.76 4.94 0.00 1.57 1.79 0.00 1.31 0.00 0.00 1.26 0.00 0.00 2.43 0.00 0.00 2.63 0.00 0.00 0.00 0.00 1.11 1.14 7.81 58 L 8.94 4.94 0.00 1.63 1.32 1.08 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 59 N 8.87 4.06 0.00 2.32 2.56 0.00 0.00 6.91 7.87 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 60 I 8.02 4.28 1.93 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.65 1.06 0.00 0.00 61 D 8.15 4.53 0.00 2.86 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 62 Q 8.05 4.19 0.00 2.01 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.60 7.17 0.00 0.00 0.00 0.00 0.00 2.33 2.43 0.00 63 N 7.94 5.02 0.00 2.85 3.10 0.00 0.00 6.54 8.07 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 64 P 0.00 4.78 0.00 2.18 2.16 0.00 3.90 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.96 0.00 65 G 8.26 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 66 T 8.13 3.92 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 0.23 0.00 0.00 67 A 8.33 3.69 1.24 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 0.00 0.00 0.00 68 P 0.00 4.12 0.00 2.11 2.09 0.00 3.59 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.18 0.00 69 K 7.41 3.70 0.00 1.57 1.29 0.00 1.53 0.00 0.00 1.55 0.00 0.00 3.04 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.34 1.56 7.81 70 Y 7.30 4.53 0.00 2.86 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 71 G 8.29 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 72 I 7.78 3.89 1.65 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.39 0.79 0.00 0.00 73 R 8.37 4.61 0.00 1.76 1.93 0.00 3.40 0.00 0.00 3.27 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.51 0.00 74 S 7.79 4.67 0.00 3.98 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 75 I 8.20 4.59 2.01 0.00 0.00 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.44 0.97 0.00 0.00 76 P 0.00 5.25 0.00 2.15 2.24 0.00 3.80 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 2.10 1.83 0.00 77 T 8.61 4.90 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 1.20 0.00 0.00 78 L 9.31 5.24 0.00 1.51 1.58 0.81 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 79 L 8.84 5.09 0.00 1.92 1.32 0.84 0.30 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 80 L 8.87 5.05 0.00 1.87 1.53 0.91 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 81 F 9.60 5.29 0.00 2.84 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 82 K 8.80 4.72 0.00 1.67 1.68 0.00 1.80 0.00 0.00 1.64 0.00 0.00 2.79 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.35 1.38 7.81 83 N 9.80 4.22 0.00 2.88 2.90 0.00 0.00 7.09 7.65 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 84 G 8.60 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 0.00 0.00 0.00 85 E 7.82 4.73 0.00 2.14 1.98 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 2.22 2.27 0.00 86 V 8.40 3.53 1.94 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 0.66 0.00 0.00 0.19 0.00 0.00 87 A 8.89 4.50 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 88 A 7.43 4.59 1.08 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 0.00 0.00 0.00 0.00 0.00 0.00 89 T 8.78 5.09 4.27 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 1.19 0.00 0.00 90 K 9.06 4.24 0.00 0.79 0.79 0.00 1.17 0.00 0.00 0.98 0.00 0.00 2.74 0.00 0.00 2.76 0.00 0.00 0.00 0.00 0.98 1.08 7.81 91 V 8.67 4.55 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 0.89 0.00 0.00 0.90 0.00 0.00 92 G 9.16 3.87 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 0.00 0.00 0.00 93 A 7.99 4.16 1.24 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 0.00 0.00 0.00 94 L 7.77 4.61 0.00 1.86 1.55 0.84 0.62 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 95 S 8.57 4.43 0.00 4.11 4.05 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 96 K 8.62 3.92 0.00 1.90 1.87 0.00 1.65 0.00 0.00 2.02 0.00 0.00 3.06 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.54 1.62 7.81 97 G 8.11 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 98 Q 7.67 4.04 0.00 2.33 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.74 0.00 0.00 0.00 0.00 0.00 2.39 2.37 0.00 99 L 7.91 3.98 0.00 1.77 1.85 0.96 0.77 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 0.00 100 K 8.18 4.00 0.00 2.10 1.97 0.00 1.82 0.00 0.00 1.77 0.00 0.00 3.27 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.73 1.67 7.81 101 E 8.15 3.96 0.00 2.25 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 2.36 2.36 0.00 102 F 8.50 4.17 0.00 3.10 3.24 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 0.00 103 L 8.11 3.56 0.00 1.53 1.31 0.20 0.86 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 0.00 104 D 8.47 4.40 0.00 2.67 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 A 7.90 4.13 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 0.00 106 N 7.22 4.71 0.00 2.36 2.54 0.00 0.00 6.85 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 0.00 107 L 7.48 4.64 0.00 1.63 1.56 0.90 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 108 A 8.46 4.15 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