NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 17 A 4.3540 8.2649 123.5826 51.7215 20.0819 176.5809 18 R 3.8801 8.6208 117.2835 57.2817 29.9548 175.0336 19 S 4.7869 7.6858 109.2771 56.0345 67.8584 172.7897 20 L 5.1140 8.7134 122.1729 54.5334 42.1660 175.8199 21 S 4.7545 8.6226 119.5592 57.4197 66.9062 172.5025 22 I 5.0513 8.0859 120.3465 59.6601 39.5777 175.8777 23 T 3.9158 8.8756 123.6922 64.7514 68.9407 174.7885 24 T 3.3929 8.7128 121.2809 63.1769 65.5611 170.1825 25 P 4.3788 0.0000 0.0000 65.1589 32.7913 175.8046 26 E 5.5010 7.6655 117.7944 53.8028 33.0649 174.4341 27 E 4.8603 8.5853 122.9116 55.5784 34.6772 173.4971 28 M 5.3461 8.5889 119.7428 53.8006 35.4652 175.7049 29 I 4.5823 8.8830 122.3347 59.7716 41.1222 174.0330 30 E 5.0785 8.8949 126.8085 55.0519 31.1123 175.6427 31 K 4.7989 9.0299 122.3260 54.5532 37.2174 175.4038 32 A 4.5814 8.4055 122.8559 50.9240 20.3619 176.8704 33 K 3.7157 8.1543 121.8697 58.4585 32.2134 175.1278 34 G 4.2738 9.1625 116.6039 45.8121 0.0000 173.6972 35 E 4.2705 7.7489 118.7395 56.3696 30.8920 176.2108 36 T 4.7077 8.2686 112.1042 60.2150 70.5925 174.0972 37 A 4.2754 8.5262 128.4158 51.6081 20.1630 175.3002 38 Y 5.0016 8.5301 123.0378 56.1600 40.5579 174.9318 39 L 4.3790 8.2772 128.0832 52.3570 43.3762 174.0200 40 P 4.3719 0.0000 0.0000 62.3283 32.4427 177.5883 41 C 4.8967 9.7053 124.4489 54.6470 43.6575 170.6972 42 K 5.1946 8.4037 122.7563 54.2073 33.8257 175.0217 43 F 5.5079 8.9295 120.2079 55.2673 41.3663 174.4245 44 T 4.5757 8.9393 117.1690 61.9183 70.8375 174.2820 45 L 4.8932 8.6110 126.4999 54.1458 43.5017 175.8218 46 S 4.8642 8.7807 114.1896 55.7295 66.1414 173.3204 47 P 4.2570 0.0000 0.0000 65.9981 30.8430 177.6332 48 E 4.0825 8.0871 115.1364 58.5190 30.0684 177.4134 49 D 4.9131 7.7178 121.2928 54.0143 38.6746 176.1413 50 Q 4.1843 7.8390 117.5788 56.6707 29.8277 176.8133 51 G 3.9258 7.8476 107.7883 43.6502 0.0000 171.4576 52 P 4.3775 0.0000 0.0000 62.0884 31.8660 175.9119 53 L 4.2346 8.4069 123.9044 55.4279 42.8913 175.9213 54 D 4.7669 9.2748 125.8755 53.0866 43.7581 173.4099 55 I 5.0834 8.8950 126.9734 59.4773 40.3834 174.7041 56 E 5.3753 9.1596 122.4190 55.0622 33.4501 173.7011 57 W 5.1740 9.2244 121.2740 55.1204 32.1823 174.9962 58 L 5.3547 9.2944 123.2508 53.0410 45.9634 175.2743 59 I 4.3776 8.1305 119.5301 60.0224 41.3872 173.9245 60 S 4.5864 8.8131 127.3025 56.0236 62.9307 171.8975 61 P 4.7057 0.0000 0.0000 62.6244 31.6468 176.6429 62 A 4.3190 8.3564 123.2050 53.8399 19.2490 178.9214 63 D 4.5178 8.1716 115.6502 56.8157 41.0297 175.7050 64 N 5.0693 7.6101 113.2121 50.8380 40.5903 174.0552 65 Q 4.0338 8.9304 116.9830 59.2759 28.7598 178.2229 66 K 3.8811 7.0442 114.7875 56.7656 32.3290 176.3060 67 V 4.2874 7.9489 122.6141 62.0615 34.8139 174.5258 68 D 4.2674 8.1655 123.8522 55.5317 38.4887 173.4632 69 Q 4.7104 7.7740 118.0506 53.5812 31.4078 177.5416 70 V 4.0821 8.4949 124.3632 62.4195 31.4344 175.4875 71 I 4.5746 8.6968 116.2817 62.1582 39.8125 175.6984 72 I 5.2057 7.6890 121.2499 59.2299 41.6062 173.5337 73 L 5.5918 9.4455 127.1681 54.5869 44.8851 174.2500 74 Y 5.3211 9.2030 121.0430 56.1723 41.5464 174.1604 75 S 4.5871 8.8637 120.9536 57.0785 66.6387 173.8105 76 G 3.7774 9.2469 112.7014 47.4297 0.0000 172.4333 77 D 4.3597 7.5786 111.0912 53.3135 39.0438 174.2195 78 K 4.5329 7.2424 115.1565 54.7240 36.3859 175.6655 79 I 5.0581 7.9596 121.8688 59.8844 39.1897 174.9326 80 Y 4.7882 9.2092 122.3758 56.4026 40.3114 175.6624 81 D 4.9920 8.8395 122.0640 52.9101 41.3509 175.8728 82 D 4.6769 7.5903 121.3984 53.5613 39.8777 174.2352 83 Y 4.5538 7.8260 118.5578 58.9394 40.7324 175.8220 84 Y 4.6548 7.8784 122.9322 55.1212 39.2432 173.6761 85 P 4.1758 0.0000 0.0000 65.8477 31.4516 178.7711 86 D 4.3447 7.3592 114.8765 56.2843 40.8912 177.0011 87 L 4.6451 8.2029 118.4519 53.8269 42.3016 175.8748 88 K 3.9892 7.8431 121.5350 58.1539 32.1453 177.1011 89 G 4.0111 9.0846 114.8055 45.4750 0.0000 173.5589 90 R 5.0881 8.1140 117.5032 55.0901 31.6220 175.5927 91 V 5.0778 7.9147 118.9810 60.1534 34.2312 174.2016 92 H 4.9295 8.2116 121.2464 54.1127 31.9103 172.7819 93 F 4.8523 8.7706 118.8212 58.1935 39.3193 175.4898 94 T 4.3248 8.7809 112.0378 63.7740 69.6865 175.8320 95 S 4.3111 7.9722 116.5243 57.3583 62.9301 173.6578 96 N 4.5329 8.7496 124.1328 54.6984 38.0825 174.6924 97 D 4.9411 8.1161 119.9179 52.8806 41.7777 177.0554 98 L 4.0942 8.1837 123.0952 57.3028 42.3939 178.7637 99 K 4.0542 7.7736 115.5582 59.3905 32.4828 177.1955 100 S 4.2379 7.8707 113.0728 58.2583 62.4227 173.3578 101 G 2.1622 7.0636 107.7252 45.2195 0.0000 173.2266 102 D 4.9401 7.7540 120.3897 52.2907 41.3751 174.9984 103 A 4.7038 9.4968 126.0257 51.9207 19.5060 177.5089 104 S 4.8528 9.1454 114.4644 59.2626 64.1870 173.5660 105 I 4.9328 8.2224 115.3364 59.2413 40.9671 173.8660 106 N 5.2260 8.5832 120.0101 51.7228 41.7289 174.6482 107 V 4.6271 8.2246 121.5097 61.1136 33.5616 174.9222 108 T 4.2158 9.1803 118.7953 61.0112 70.2913 173.6889 109 N 4.4191 8.3967 118.5372 53.2798 37.3648 174.5047 110 L 4.1921 7.6627 119.3215 55.3834 42.5995 177.6651 111 Q 4.8516 9.3319 121.5693 53.8885 31.2997 176.8800 112 L 4.0818 8.2766 118.5877 57.8103 41.7656 179.2637 113 S 4.6894 8.0187 110.4795 59.4763 63.1637 174.1287 114 D 4.8156 7.6671 119.9994 54.6873 41.2789 176.8507 115 I 3.9327 7.6069 120.9013 60.2156 37.7919 176.4114 116 G 4.2654 7.3552 110.0278 46.0764 0.0000 170.3255 117 T 5.0866 7.4651 115.9857 62.4174 70.3633 173.9359 118 Y 5.0839 9.3435 124.1184 56.2437 41.1757 174.5584 119 Q 4.8272 9.2809 124.2435 54.5455 32.6588 172.9943 120 C 4.0866 8.6119 127.7706 54.6453 43.9243 172.2093 121 K 4.6605 8.5302 127.5332 55.2683 33.5444 176.1479 122 V 4.2997 8.5081 125.8207 60.9647 33.6918 174.2699 123 K 4.8750 8.7792 127.8386 54.7159 35.2293 176.0087 124 K 5.1674 8.8992 124.8268 54.2640 33.8393 173.2228 125 A 4.0423 8.2609 125.4275 51.6091 18.9343 176.3687 126 P 4.7570 0.0000 0.0000 62.5816 31.9869 176.5667 127 G 3.7732 8.1221 109.4116 46.1081 0.0000 173.1178 128 V 4.9410 7.6974 120.2080 61.7093 34.7290 172.9858 129 A 4.6152 8.2960 125.1147 51.0924 22.9286 174.9753 130 N 5.7846 8.7132 117.6454 49.7612 40.6846 173.4768 131 K 4.7557 8.3298 120.9670 54.6163 36.0277 174.3981 132 K 4.9712 8.7391 125.8418 54.7426 34.7996 175.1075 133 I 4.7766 9.2682 126.6928 59.8184 40.0455 174.5341 134 H 5.1929 8.9163 125.6705 54.9544 29.2277 174.3964 135 L 5.0011 9.1641 126.9655 54.0981 44.0438 175.5433 136 V 4.6744 8.5740 123.7158 61.3357 35.3038 173.8729 137 V 5.2652 8.3635 125.8442 60.5522 34.7232 174.7249 138 L 4.6821 8.0350 124.8176 54.0976 46.1311 176.6337 139 V 3.9664 8.1880 119.6416 64.2130 31.6393 175.4588 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 17 A 8.26 4.35 1.29 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 0.00 0.00 18 R 8.62 3.88 0.00 1.90 2.01 0.00 3.16 0.00 0.00 3.25 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.68 0.00 19 S 7.69 4.79 0.00 3.81 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 20 L 8.71 5.11 0.00 1.85 1.63 0.88 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 21 S 8.62 4.75 0.00 3.89 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 22 I 8.09 5.05 1.86 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.66 0.95 0.00 0.00 23 T 8.88 3.92 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 1.22 0.00 0.00 24 T 8.71 3.39 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 1.30 0.00 0.00 25 P 0.00 4.38 0.00 2.06 2.11 0.00 3.54 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 2.12 2.11 0.00 26 E 7.67 5.50 0.00 1.87 1.75 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 2.25 2.23 0.00 27 E 8.59 4.86 0.00 1.92 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 2.31 2.35 0.00 28 M 8.59 5.35 0.00 1.90 1.97 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 2.56 2.58 0.00 29 I 8.88 4.58 1.84 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 1.23 0.68 0.88 0.00 0.00 30 E 8.89 5.08 0.00 1.85 1.88 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 2.26 2.34 0.00 31 K 9.03 4.80 0.00 1.58 1.62 0.00 1.67 0.00 0.00 1.65 0.00 0.00 2.83 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.33 1.49 7.81 32 A 8.41 4.58 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 33 K 8.15 3.72 0.00 2.00 1.75 0.00 1.79 0.00 0.00 1.71 0.00 0.00 2.94 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.58 1.57 7.81 34 G 9.16 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 0.00 0.00 0.00 0.00 35 E 7.75 4.27 0.00 1.97 1.88 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 2.33 2.41 0.00 36 T 8.27 4.71 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 1.22 0.00 0.00 37 A 8.53 4.28 1.14 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 0.00 0.00 38 Y 8.53 5.00 0.00 2.83 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 39 L 8.28 4.38 0.00 1.05 1.38 0.14 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 40 P 0.00 4.37 0.00 1.88 1.83 0.00 3.55 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 1.79 0.00 41 C 9.71 4.90 0.00 3.14 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 42 K 8.40 5.19 0.00 1.72 1.68 0.00 1.68 0.00 0.00 2.09 0.00 0.00 2.95 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.49 1.39 7.81 43 F 8.93 5.51 0.00 2.97 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 44 T 8.94 4.58 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 1.22 0.00 0.00 45 L 8.61 4.89 0.00 1.57 1.66 1.03 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 46 S 8.78 4.86 0.00 3.99 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 47 P 0.00 4.26 0.00 2.20 2.25 0.00 3.78 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 2.00 1.98 0.00 48 E 8.09 4.08 0.00 2.10 2.13 0.00 0.00 0.00 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 2.28 0.00 49 D 7.72 4.91 0.00 2.84 2.83 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 50 Q 7.84 4.18 0.00 2.04 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.02 0.00 0.00 0.00 0.00 0.00 2.47 2.30 0.00 51 G 7.85 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 52 P 0.00 4.38 0.00 2.19 2.07 0.00 3.77 0.00 0.00 3.58 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 53 L 8.41 4.23 0.00 1.76 1.79 0.77 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 54 D 9.27 4.77 0.00 2.82 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 55 I 8.90 5.08 2.01 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.71 1.02 0.00 0.00 56 E 9.16 5.38 0.00 2.02 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 2.14 2.27 0.00 57 W 9.22 5.17 0.00 3.43 3.13 0.00 0.00 0.00 0.00 0.00 0.00 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 L 9.29 5.35 0.00 1.52 1.47 0.90 0.75 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 59 I 8.13 4.38 1.32 0.00 0.00 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.08 0.34 0.18 0.00 0.00 60 S 8.81 4.59 0.00 3.73 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 61 P 0.00 4.71 0.00 2.11 2.07 0.00 3.90 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.05 0.00 62 A 8.36 4.32 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 63 D 8.17 4.52 0.00 2.71 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 64 N 7.61 5.07 0.00 2.76 2.77 0.00 0.00 5.99 7.39 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 65 Q 8.93 4.03 0.00 2.07 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.76 0.00 0.00 0.00 0.00 0.00 2.39 2.38 0.00 66 K 7.04 3.88 0.00 2.00 1.84 0.00 1.73 0.00 0.00 1.68 0.00 0.00 3.05 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.52 1.47 7.81 67 V 7.95 4.29 2.06 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 0.81 0.00 0.00 0.99 0.00 0.00 68 D 8.17 4.27 0.00 2.83 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 69 Q 7.77 4.71 0.00 1.77 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.96 0.00 0.00 0.00 0.00 0.00 2.26 2.51 0.00 70 V 8.49 4.08 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.35 0.00 0.00 0.79 0.00 0.00 71 I 8.70 4.57 1.93 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.77 0.70 0.00 0.00 72 I 7.69 5.21 1.81 0.00 0.00 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.54 0.69 0.00 0.00 73 L 9.45 5.59 0.00 2.16 1.85 1.02 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 74 Y 9.20 5.32 0.00 3.02 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 75 S 8.86 4.59 0.00 3.94 3.73 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 0.00 0.00 0.00 0.00 76 G 9.25 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 0.00 0.00 0.00 77 D 7.58 4.36 0.00 2.75 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 78 K 7.24 4.53 0.00 1.69 1.11 0.00 1.64 0.00 0.00 1.57 0.00 0.00 2.97 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.22 1.41 7.81 79 I 7.96 5.06 1.95 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.87 1.14 0.00 0.00 80 Y 9.21 4.79 0.00 3.25 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 81 D 8.84 4.99 0.00 2.75 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 82 D 7.59 4.68 0.00 2.54 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 83 Y 7.83 4.55 0.00 3.12 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 84 Y 7.88 4.65 0.00 3.20 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 85 P 0.00 4.18 0.00 2.00 2.02 0.00 3.39 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.09 0.00 86 D 7.36 4.34 0.00 2.29 2.73 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 0.00 0.00 0.00 0.00 87 L 8.20 4.65 0.00 1.92 1.76 1.07 1.11 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 88 K 7.84 3.99 0.00 1.69 1.87 0.00 1.71 0.00 0.00 1.91 0.00 0.00 3.10 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.45 1.44 7.81 89 G 9.08 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 90 R 8.11 5.09 0.00 1.76 2.12 0.00 3.27 0.00 0.00 3.20 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.55 0.00 91 V 7.91 5.08 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 0.80 0.00 0.00 0.97 0.00 0.00 92 H 8.21 4.93 0.00 3.22 3.29 0.00 5.51 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 F 8.77 4.85 0.00 3.05 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 94 T 8.78 4.32 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 1.29 0.00 0.00 95 S 7.97 4.31 0.00 4.10 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 96 N 8.75 4.53 0.00 2.86 2.95 0.00 0.00 5.86 8.06 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 97 D 8.12 4.94 0.00 2.70 2.55 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 98 L 8.18 4.09 0.00 1.63 1.29 -0.41 -0.32 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 99 K 7.77 4.05 0.00 1.98 1.99 0.00 1.71 0.00 0.00 1.72 0.00 0.00 2.96 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.40 1.47 7.81 100 S 7.87 4.24 0.00 3.90 3.84 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 0.00 101 G 7.06 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 D 7.75 4.94 0.00 2.59 2.51 0.00 0.00 0.00 0.00 0.00 0.00 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 A 9.50 4.70 1.46 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 0.00 0.00 104 S 9.15 4.85 0.00 4.03 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 0.00 105 I 8.22 4.93 1.37 0.00 0.00 -0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.14 0.21 0.00 0.00 106 N 8.58 5.23 0.00 2.21 2.64 0.00 0.00 6.76 8.43 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 0.00 107 V 8.22 4.63 1.87 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 0.95 0.00 0.00 0.62 0.00 0.00 108 T 9.18 4.22 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 1.26 0.00 0.00 109 N 8.40 4.42 0.00 2.80 2.84 0.00 0.00 7.37 7.78 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 0.00 110 L 7.66 4.19 0.00 1.70 1.58 0.93 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 111 Q 9.33 4.85 0.00 2.04 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.98 6.81 0.00 0.00 0.00 0.00 0.00 2.31 2.46 0.00 112 L 8.28 4.08 0.00 1.73 1.73 0.93 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 113 S 8.02 4.69 0.00 4.17 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 0.00 114 D 7.67 4.82 0.00 2.90 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 0.00 115 I 7.61 3.93 1.92 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.27 1.00 0.00 0.00 116 G 7.36 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 0.00 0.00 0.00 0.00 117 T 7.47 5.09 4.26 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 1.24 0.00 0.00 118 Y 9.34 5.08 0.00 3.01 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 Q 9.28 4.83 0.00 2.07 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.77 0.00 0.00 0.00 0.00 0.00 2.14 2.15 0.00 120 C 8.61 4.09 0.00 1.23 2.15 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 0.00 121 K 8.53 4.66 0.00 1.61 1.60 0.00 1.59 0.00 0.00 1.50 0.00 0.00 2.71 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.30 1.27 7.81 122 V 8.51 4.30 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 0.05 0.00 0.00 0.54 0.00 0.00 123 K 8.78 4.87 0.00 1.75 1.60 0.00 1.66 0.00 0.00 1.53 0.00 0.00 2.75 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.28 1.26 7.81 124 K 8.90 5.17 0.00 1.75 1.62 0.00 1.75 0.00 0.00 1.80 0.00 0.00 2.92 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.47 1.49 7.81 125 A 8.26 4.04 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 0.00 126 P 0.00 4.76 0.00 2.18 2.14 0.00 3.95 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.95 0.00 127 G 8.12 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 0.00 128 V 7.70 4.94 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 0.68 0.00 0.00 0.93 0.00 0.00 129 A 8.30 4.62 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 0.00 130 N 8.71 5.78 0.00 2.56 2.63 0.00 0.00 6.11 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 K 8.33 4.76 0.00 1.75 1.50 0.00 1.78 0.00 0.00 1.89 0.00 0.00 2.90 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.35 1.57 7.81 132 K 8.74 4.97 0.00 1.70 1.60 0.00 1.67 0.00 0.00 1.67 0.00 0.00 3.04 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.34 1.35 7.81 133 I 9.27 4.78 2.04 0.00 0.00 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 1.28 0.82 0.91 0.00 0.00 134 H 8.92 5.19 0.00 3.15 3.28 0.00 5.60 0.00 0.00 0.00 0.00 6.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 L 9.16 5.00 0.00 1.71 1.70 0.89 0.32 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 0.00 136 V 8.57 4.67 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 0.97 0.00 0.00 0.97 0.00 0.00 137 V 8.36 5.27 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 1.27 0.00 0.00 1.01 0.00 0.00 138 L 8.03 4.68 0.00 1.58 1.53 0.98 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 139 V 8.19 3.97 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 0.75 0.00 0.00 0.94 0.00 0.00