NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.2364 8.3144 121.7896 55.7603 33.3907 175.1291 2 E 3.9141 8.4907 125.1460 54.2744 30.4176 175.8641 3 T 4.2193 8.6592 117.8365 61.2171 72.1853 175.0603 4 A 4.0304 8.4867 122.8767 55.2236 18.5147 179.8411 5 A 4.1061 7.9989 118.6580 55.3190 18.5506 179.5899 6 A 4.3054 8.0536 120.7231 54.6880 18.3632 179.8036 7 K 4.0705 8.2675 118.2576 59.5066 32.1799 178.8757 8 F 4.0887 8.3083 120.9944 61.1458 38.8137 177.0102 9 E 4.0503 8.3313 117.8310 59.4450 29.1089 179.2921 10 R 3.8949 7.8441 117.2522 59.6979 30.2761 178.2862 11 Q 3.9331 8.0646 116.5812 57.9370 29.0503 176.3278 12 H 4.5873 8.0432 114.7392 54.3735 31.4127 173.5911 13 M 4.7120 8.0780 118.8469 53.8679 33.3943 176.5068 14 D 4.8290 8.8761 122.5197 53.0136 40.9922 175.7860 15 S 4.5256 8.3621 114.7961 59.2915 63.7315 175.5587 16 S 4.4070 7.9210 115.2551 59.6029 63.2905 174.2721 17 T 4.7321 7.4833 110.4423 59.6913 71.4393 174.1342 18 S 4.1794 8.6574 117.2290 60.3315 63.6813 173.8064 19 A 3.6493 6.8878 121.0152 51.0740 21.0304 175.3728 20 A 3.5005 8.5242 124.1109 52.2095 18.3310 178.1293 21 S 4.6141 8.4865 116.7556 58.0758 64.2656 173.8172 22 S 4.7039 7.4225 115.1869 56.6485 65.3073 174.3392 23 S 4.4069 8.6755 118.6530 59.8465 63.3744 174.1507 24 N 4.6916 8.9524 120.3798 53.8488 39.4925 175.4895 25 Y 4.0101 8.0683 118.8009 62.0790 38.6421 177.5891 26 C 4.1885 8.4312 117.0437 60.0401 38.5525 175.7850 27 N 4.3641 8.1907 117.5873 56.4546 38.1052 177.3918 28 Q 3.9749 7.9551 119.3205 59.2586 28.8591 178.6244 29 M 4.2205 7.7283 121.4013 57.9798 31.7091 178.7506 30 M 4.0184 8.0223 119.0746 57.9070 31.8726 178.7947 31 K 3.9505 7.6104 118.7198 59.3953 32.5283 179.0185 32 S 4.0812 8.1241 114.5862 61.0903 62.4461 175.6273 33 R 4.2431 7.7915 118.9082 54.8983 30.2205 175.7721 34 N 4.2636 8.0915 115.1928 54.6693 36.3956 174.8393 35 L 4.4891 8.2823 116.7046 55.1299 42.1889 178.0596 36 T 5.5005 7.5488 106.8393 60.4523 68.9362 174.9791 37 K 4.0399 7.9987 122.8885 59.7857 32.4302 177.3664 38 D 4.5720 7.8886 118.5968 55.6404 41.8299 176.0835 39 R 3.9206 7.4028 113.5844 55.4000 31.9574 173.8676 40 C 4.9934 8.5433 115.8157 55.1156 40.3485 173.9477 41 K 4.1895 8.3565 127.7748 55.7383 32.4812 174.8974 42 P 4.7116 0.0000 0.0000 65.5092 32.3550 176.4173 43 V 5.0658 7.5439 117.5811 61.1021 34.9149 174.1067 44 N 4.6944 9.1905 123.6988 52.8485 42.6303 172.9762 45 T 4.8356 7.9092 121.4998 61.6528 71.8299 172.8253 46 F 4.8477 8.9679 124.4187 55.7130 41.9831 174.6707 47 V 4.5642 8.8801 123.1306 61.2096 33.3835 175.5117 48 H 5.7049 8.7880 127.6991 53.7403 26.4335 173.1759 49 E 4.8003 7.7256 118.2842 53.3138 34.5106 176.3990 50 S 4.4011 8.3409 114.9076 58.0978 65.1054 174.9753 51 L 3.9718 8.4833 124.2194 58.3949 41.9419 179.0361 52 A 4.0351 8.0395 120.1762 55.5042 18.1075 179.2426 53 D 4.3493 8.0976 116.2481 57.2701 41.1416 178.8851 54 V 3.8022 7.8140 119.0797 65.9971 31.5782 178.1033 55 Q 3.9030 8.6177 118.0712 58.8371 28.5485 178.6195 56 A 4.0421 8.1675 121.4583 54.6147 18.2536 179.6631 57 V 3.4673 7.6662 117.0393 65.9510 31.3039 176.8745 58 C 3.8101 7.8086 114.4559 58.0883 39.9043 174.1342 59 S 4.5850 7.5492 115.5602 58.2179 63.9526 174.9187 60 Q 4.0355 7.4375 123.3927 55.3818 27.6412 176.5024 61 K 4.2689 7.8737 127.0274 57.2901 33.1963 176.0408 62 N 4.3645 8.8196 127.3877 53.3636 39.8207 174.2381 63 V 4.5848 8.1885 118.2934 59.1058 36.6059 174.8597 64 A 4.3944 8.3501 124.3001 52.1060 19.2872 178.3128 65 C 4.7044 9.1730 119.1410 55.8998 41.2920 175.2778 66 K 3.8552 8.6225 121.9872 59.6907 31.6780 177.9841 67 N 4.5221 8.0400 113.1824 53.1302 37.5909 175.7124 68 G 3.9805 8.4375 108.9072 45.5651 0.0000 174.4195 69 Q 4.1626 9.7281 119.5741 56.4518 29.1723 176.5727 70 T 4.5927 8.3583 109.6221 61.6240 69.1871 174.1256 71 N 5.0497 7.9691 118.3849 53.7244 38.4503 174.7182 72 C 5.3159 7.4813 115.1377 56.9062 43.2030 172.7238 73 Y 5.0308 8.9234 118.5522 56.4062 41.7555 173.8298 74 Q 5.0625 8.9475 125.5522 53.9717 31.2821 174.9266 75 S 4.3296 8.8619 122.2627 58.7239 63.1508 174.3245 76 Y 4.4937 9.2127 121.8381 60.4401 37.8156 176.3285 77 S 4.8571 7.8664 112.2707 56.2615 65.7123 173.1138 78 T 4.3056 7.9953 110.5322 61.6162 69.9802 173.7544 79 M 5.0593 9.2317 121.7085 53.4438 37.0672 174.5219 80 S 4.9882 9.5326 116.9047 58.1328 63.6286 173.1329 81 I 5.2140 9.3098 120.0606 59.5831 41.7951 174.1791 82 T 4.9737 9.0142 119.1073 61.9355 72.1712 172.5957 83 D 4.9443 9.4068 127.1885 53.4147 43.1505 174.2201 84 C 5.6846 9.2724 123.4457 55.3547 39.0888 173.2476 85 R 5.4520 8.8499 121.8360 54.2419 34.3112 174.7197 86 E 4.6319 9.2316 123.1524 56.1900 30.1771 177.2752 87 T 4.3288 8.2494 113.5224 60.1719 70.5365 175.8111 88 G 3.6702 8.6024 110.5925 48.6819 0.0000 174.0543 89 S 4.5824 7.7994 114.3953 58.6620 63.4174 173.5196 90 S 4.6175 7.4920 115.4185 56.3932 62.8095 173.4606 91 K 4.5216 8.4495 126.4183 54.5506 35.4585 175.2731 92 Y 3.7727 8.7864 125.5199 57.6279 39.1343 173.6154 93 P 3.4189 0.0000 0.0000 62.5055 31.9812 176.8166 94 N 4.6514 9.0600 119.0958 52.2856 36.9885 173.6867 95 C 4.4601 7.7661 116.5418 56.7680 37.1014 173.4717 96 A 5.0188 8.3142 124.6893 50.4892 22.0085 174.5760 97 Y 5.0648 9.4403 119.5330 55.9548 41.9541 175.0266 98 K 4.4836 9.4014 124.1217 55.8920 34.1007 175.2862 99 T 5.0113 8.5584 123.5891 62.3505 70.5247 174.0293 100 T 4.5470 8.8217 122.8430 61.7571 71.8313 172.9195 101 Q 4.7932 8.7570 128.0187 55.6069 30.4381 174.3551 102 A 4.5777 8.8648 126.0950 51.4190 23.7408 174.6754 103 N 5.4605 8.8357 118.6014 52.4955 40.6103 175.0174 104 K 4.7462 8.8291 126.3575 53.8365 37.2358 171.8599 105 H 5.0594 9.3826 116.1167 56.8685 30.0627 175.0840 106 I 4.7729 8.5413 114.8507 59.2843 40.8107 174.3490 107 I 4.9102 8.2177 124.4267 59.7296 39.9827 175.1344 108 V 4.7627 8.7720 119.5086 59.3437 36.2010 174.3086 109 A 5.0411 8.5459 124.4663 51.0432 20.5273 175.7667 110 C 5.1330 8.7617 119.7614 55.4101 39.0742 173.2260 111 E 4.6568 8.7283 119.2745 56.7894 34.1903 176.3095 112 G 4.0388 9.7829 108.2473 44.6805 0.0000 171.6892 113 N 5.0217 8.2177 117.4655 51.0668 40.5250 172.9799 114 P 4.3573 0.0000 0.0000 62.7006 32.0785 175.6337 115 Y 4.8037 8.2770 121.1908 56.6925 38.8541 174.5398 116 V 4.4331 8.1446 119.4082 58.3327 36.6258 173.4606 117 P 4.3476 0.0000 0.0000 62.9172 30.9901 177.0377 118 V 4.4917 8.7778 115.5318 61.0355 33.9786 175.3860 119 A 4.8729 7.7175 120.5761 50.8291 22.7525 174.8509 120 F 4.7815 8.8394 122.6138 57.0666 39.9281 174.9678 121 D 4.5168 8.5119 126.9351 56.1580 41.8001 175.6225 122 A 4.5935 6.4670 117.3918 51.7350 22.4351 174.4545 123 S 5.1616 8.8147 112.3007 56.9376 66.7316 174.8227 124 V 4.1591 8.8131 113.5707 61.7767 32.6783 175.3920 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 K 8.31 4.24 0.00 1.74 1.78 0.00 1.75 0.00 0.00 1.71 0.00 0.00 2.90 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.33 1.44 7.81 2 E 8.49 3.91 0.00 2.06 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 2.37 2.37 0.00 3 T 8.66 4.22 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 1.22 0.00 0.00 4 A 8.49 4.03 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 5 A 8.00 4.11 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 6 A 8.05 4.31 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.27 4.07 0.00 1.88 2.02 0.00 1.67 0.00 0.00 1.59 0.00 0.00 2.90 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.44 7.81 8 F 8.31 4.09 0.00 3.23 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 9 E 8.33 4.05 0.00 2.32 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 2.49 2.68 0.00 10 R 7.84 3.89 0.00 1.81 2.06 0.00 3.38 0.00 0.00 3.22 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.67 0.00 11 Q 8.06 3.93 0.00 1.44 1.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.48 0.00 0.00 0.00 0.00 0.00 2.24 2.53 0.00 12 H 8.04 4.59 0.00 1.97 2.73 0.00 5.61 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 M 8.08 4.71 0.00 1.96 2.15 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.71 0.00 14 D 8.88 4.83 0.00 2.70 2.52 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 0.00 0.00 0.00 0.00 15 S 8.36 4.53 0.00 3.94 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 16 S 7.92 4.41 0.00 3.94 3.99 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 17 T 7.48 4.73 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 1.24 0.00 0.00 18 S 8.66 4.18 0.00 3.97 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 19 A 6.89 3.65 1.11 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 0.00 0.00 20 A 8.52 3.50 0.73 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 0.00 0.00 21 S 8.49 4.61 0.00 3.95 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 S 7.42 4.70 0.00 3.83 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 23 S 8.68 4.41 0.00 4.05 3.99 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 24 N 8.95 4.69 0.00 2.72 3.06 0.00 0.00 6.68 6.32 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 25 Y 8.07 4.01 0.00 3.05 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 26 C 8.43 4.19 0.00 3.16 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 27 N 8.19 4.36 0.00 2.92 2.91 0.00 0.00 7.14 7.74 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 28 Q 7.96 3.97 0.00 1.99 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.81 0.00 0.00 0.00 0.00 0.00 2.32 2.51 0.00 29 M 7.73 4.22 0.00 0.87 1.10 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.61 0.00 30 M 8.02 4.02 0.00 1.72 1.84 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 2.39 0.00 31 K 7.61 3.95 0.00 1.94 1.90 0.00 1.63 0.00 0.00 1.67 0.00 0.00 2.98 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.41 1.43 7.81 32 S 8.12 4.08 0.00 4.00 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 33 R 7.79 4.24 0.00 1.93 2.11 0.00 3.62 0.00 0.00 3.21 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.95 0.00 34 N 8.09 4.26 0.00 2.86 2.92 0.00 0.00 6.85 8.70 0.00 0.00 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 8.28 4.49 0.00 1.76 1.64 0.80 0.42 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 36 T 7.55 5.50 4.39 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 0.00 0.00 0.00 1.45 0.00 0.00 37 K 8.00 4.04 0.00 1.93 1.88 0.00 1.78 0.00 0.00 1.73 0.00 0.00 2.98 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.47 1.50 7.81 38 D 7.89 4.57 0.00 2.65 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 39 R 7.40 3.92 0.00 1.84 1.81 0.00 2.92 0.00 0.00 3.29 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.65 0.00 40 C 8.54 4.99 0.00 3.08 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 41 K 8.36 4.19 0.00 1.82 1.77 0.00 1.76 0.00 0.00 1.66 0.00 0.00 3.05 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.47 1.39 7.81 42 P 0.00 4.71 0.00 2.27 2.32 0.00 3.46 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 2.10 2.10 0.00 43 V 7.54 5.07 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 0.81 0.00 0.00 0.98 0.00 0.00 44 N 9.19 4.69 0.00 2.62 2.27 0.00 0.00 6.94 6.76 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 45 T 7.91 4.84 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 0.86 0.00 0.00 46 F 8.97 4.85 0.00 3.05 2.89 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 47 V 8.88 4.56 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 1.07 0.00 0.00 1.04 0.00 0.00 48 H 8.79 5.70 0.00 3.04 3.49 0.00 5.62 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 E 7.73 4.80 0.00 1.95 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 2.26 2.27 0.00 50 S 8.34 4.40 0.00 4.07 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 51 L 8.48 3.97 0.00 1.83 1.74 1.02 1.18 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 52 A 8.04 4.04 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 53 D 8.10 4.35 0.00 2.83 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 54 V 7.81 3.80 2.30 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 1.23 0.00 0.00 1.04 0.00 0.00 55 Q 8.62 3.90 0.00 2.20 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.57 0.00 0.00 0.00 0.00 0.00 2.31 2.50 0.00 56 A 8.17 4.04 1.37 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 0.00 0.00 57 V 7.67 3.47 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 1.07 0.00 0.00 0.92 0.00 0.00 58 C 7.81 3.81 0.00 2.85 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 59 S 7.55 4.59 0.00 3.88 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 60 Q 7.44 4.04 0.00 1.73 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.89 0.00 0.00 0.00 0.00 0.00 1.79 2.17 0.00 61 K 7.87 4.27 0.00 2.17 1.89 0.00 1.64 0.00 0.00 1.77 0.00 0.00 2.90 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.50 1.46 7.81 62 N 8.82 4.36 0.00 2.74 2.64 0.00 0.00 7.01 7.71 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 63 V 8.19 4.58 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 0.68 0.00 0.00 0.85 0.00 0.00 64 A 8.35 4.39 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 65 C 9.17 4.70 0.00 3.13 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 66 K 8.62 3.86 0.00 1.76 1.89 0.00 1.70 0.00 0.00 1.76 0.00 0.00 3.05 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.47 1.51 7.81 67 N 8.04 4.52 0.00 2.81 2.92 0.00 0.00 6.25 7.00 0.00 0.00 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 8.44 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 69 Q 9.73 4.16 0.00 2.30 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.07 6.78 0.00 0.00 0.00 0.00 0.00 2.44 2.44 0.00 70 T 8.36 4.59 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 1.22 0.00 0.00 71 N 7.97 5.05 0.00 3.08 3.15 0.00 0.00 6.06 7.68 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 72 C 7.48 5.32 0.00 3.03 2.88 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 0.00 0.00 0.00 73 Y 8.92 5.03 0.00 2.79 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 74 Q 8.95 5.06 0.00 2.05 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.98 0.00 0.00 0.00 0.00 0.00 2.26 2.27 0.00 75 S 8.86 4.33 0.00 3.90 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 76 Y 9.21 4.49 0.00 2.99 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 77 S 7.87 4.86 0.00 3.99 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 78 T 8.00 4.31 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 0.99 0.00 0.00 79 M 9.23 5.06 0.00 1.96 2.00 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 2.54 2.49 0.00 80 S 9.53 4.99 0.00 3.88 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 81 I 9.31 5.21 1.97 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.71 1.07 0.00 0.00 82 T 9.01 4.97 4.43 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 1.28 0.00 0.00 83 D 9.41 4.94 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 84 C 9.27 5.68 0.00 2.92 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 85 R 8.85 5.45 0.00 1.75 1.82 0.00 3.17 0.00 0.00 3.21 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.81 0.00 86 E 9.23 4.63 0.00 1.77 1.72 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 1.70 1.80 0.00 87 T 8.25 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 1.22 0.00 0.00 88 G 8.60 3.67 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 0.00 0.00 0.00 89 S 7.80 4.58 0.00 3.84 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 90 S 7.49 4.62 0.00 3.72 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 91 K 8.45 4.52 0.00 1.76 1.65 0.00 1.73 0.00 0.00 1.59 0.00 0.00 2.86 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.38 1.37 7.81 92 Y 8.79 3.77 0.00 2.95 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 93 P 0.00 3.42 0.00 1.69 0.75 0.00 3.64 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 1.69 1.66 0.00 94 N 9.06 4.65 0.00 2.84 2.75 0.00 0.00 7.05 7.54 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 95 C 7.77 4.46 0.00 3.08 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 96 A 8.31 5.02 1.13 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 0.00 0.00 97 Y 9.44 5.06 0.00 2.93 2.89 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 98 K 9.40 4.48 0.00 1.83 1.73 0.00 1.63 0.00 0.00 1.69 0.00 0.00 2.88 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.44 1.45 7.81 99 T 8.56 5.01 4.32 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 1.33 0.00 0.00 100 T 8.82 4.55 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 1.23 0.00 0.00 101 Q 8.76 4.79 0.00 1.95 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.72 0.00 0.00 0.00 0.00 0.00 2.24 2.38 0.00 102 A 8.86 4.58 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 0.00 103 N 8.84 5.46 0.00 2.58 2.75 0.00 0.00 6.53 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 0.00 104 K 8.83 4.75 0.00 1.40 1.61 0.00 1.80 0.00 0.00 1.65 0.00 0.00 2.79 0.00 0.00 2.70 0.00 0.00 0.00 0.00 1.27 1.29 7.81 105 H 9.38 5.06 0.00 3.12 3.27 0.00 5.55 0.00 0.00 0.00 0.00 6.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 I 8.54 4.77 1.84 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 1.28 1.30 1.12 0.00 0.00 107 I 8.22 4.91 1.78 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.61 0.83 0.00 0.00 108 V 8.77 4.76 2.01 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 0.73 0.00 0.00 0.82 0.00 0.00 109 A 8.55 5.04 1.20 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 0.00 0.00 110 C 8.76 5.13 0.00 1.69 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 0.00 0.00 0.00 111 E 8.73 4.66 0.00 1.81 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 2.25 2.18 0.00 112 G 9.78 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 0.00 0.00 0.00 113 N 8.22 5.02 0.00 2.65 2.69 0.00 0.00 6.87 7.69 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 0.00 114 P 0.00 4.36 0.00 2.23 2.05 0.00 3.82 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 1.99 1.95 0.00 115 Y 8.28 4.80 0.00 2.84 2.88 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 0.00 0.00 0.00 116 V 8.14 4.43 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 0.67 0.00 0.00 0.88 0.00 0.00 117 P 0.00 4.35 0.00 0.49 1.13 0.00 3.32 0.00 0.00 3.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.76 0.00 118 V 8.78 4.49 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 0.64 0.00 0.00 0.92 0.00 0.00 119 A 7.72 4.87 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 0.00 120 F 8.84 4.78 0.00 2.63 2.80 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 0.00 121 D 8.51 4.52 0.00 2.58 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 0.00 122 A 6.47 4.59 1.18 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 0.00 123 S 8.81 5.16 0.00 4.10 4.08 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 0.00 124 V 8.81 4.16 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 0.65 0.00 0.00 1.04 0.00 0.00