NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 G 4.0108 8.3549 109.7415 45.7718 0.0000 175.9272 5 S 4.3587 8.8918 118.2842 60.1915 63.3124 174.5782 6 R 3.9591 8.2839 120.5099 59.3724 31.0203 177.5549 7 R 3.6854 8.0001 116.9609 58.7969 29.9967 176.3262 8 Y 4.4942 8.2754 112.8384 57.4249 38.2226 174.8530 9 D 4.5587 7.6730 120.9702 53.8893 41.1966 176.5597 10 S 4.1455 8.7405 123.3774 59.5026 63.5862 174.2029 11 R 3.8064 8.5016 119.5410 57.2988 26.9324 177.2318 12 T 4.1080 7.7734 106.2323 63.4836 69.9901 175.1328 13 T 4.6204 7.3334 110.9142 60.7950 68.7451 172.7715 14 I 4.5934 7.0823 114.5271 59.5079 41.4571 175.1469 15 F 4.7651 8.4900 119.7240 56.9225 40.0087 175.8720 16 S 4.6848 8.4012 117.9218 55.5857 64.2792 173.5789 17 P 4.5388 0.0000 0.0000 64.9226 31.0316 177.2658 18 E 4.2897 8.1062 116.1472 55.6490 29.6839 175.8547 19 G 3.6392 8.3255 107.1630 47.0023 0.0000 174.0360 20 R 4.6126 7.9148 116.9665 53.8813 33.2519 175.9611 21 L 4.6049 7.9792 120.6293 54.2021 41.4541 177.2314 22 Y 3.5026 7.3896 117.2475 61.2203 37.8035 178.4315 23 Q 4.0902 8.0918 118.1052 59.3642 28.9891 179.6954 24 V 3.5587 7.5982 118.3705 65.9453 31.6504 177.5897 25 E 3.9347 7.9759 118.1909 59.9563 29.5121 179.1889 26 Y 4.4416 8.1229 116.6315 60.9183 37.7601 178.6448 27 A 4.0539 8.4176 122.3633 55.1771 18.5557 179.5658 28 L 3.9069 8.2333 117.8467 58.0254 41.4559 179.3872 29 E 3.9682 8.1710 118.3339 59.2542 29.8782 178.5938 30 S 4.3294 7.9668 112.9756 61.2658 62.5047 176.0883 31 I 3.7219 7.9670 123.0605 64.2939 36.6520 178.3258 32 S 4.3968 7.9573 113.8023 60.8416 62.6315 174.6774 33 H 4.6981 7.6651 116.9686 55.4194 29.1578 174.7092 34 A 4.4063 8.1718 123.5326 50.6855 19.5172 177.5788 35 G 4.0362 8.5395 106.6686 46.3117 0.0000 173.5715 36 T 4.2842 8.6817 120.4060 63.5479 69.8652 173.0873 37 A 5.1229 8.5020 126.1696 50.2427 22.0814 175.2534 38 I 4.5777 9.5160 123.7716 59.2943 41.0802 174.9702 39 G 4.4248 8.7041 112.0600 44.5542 0.0000 171.8094 40 I 4.7053 8.7639 126.3163 59.5863 40.6852 174.0929 41 M 4.8361 8.8242 126.5392 53.9633 33.7058 175.1637 42 A 4.7359 8.8924 130.2246 50.2843 21.7154 176.3574 43 S 4.3215 8.6336 112.3836 60.8258 63.2820 174.8779 44 D 4.8382 8.8123 118.3807 50.7686 39.6672 176.0766 45 G 4.0382 6.8763 108.2612 46.3497 0.0000 171.3309 46 I 5.1231 7.6451 118.5320 59.4647 41.3460 175.4669 47 V 4.5312 9.0404 124.1778 61.1070 34.7922 174.1876 48 L 5.3940 8.5964 125.9622 52.9520 44.7793 175.8132 49 A 4.7597 9.0281 124.2617 50.4989 22.6406 174.8380 50 A 5.0594 8.5645 122.9937 50.0890 22.5494 174.5812 51 E 4.4717 9.2195 121.4372 54.4122 31.5112 175.6723 52 R 4.2844 8.5711 126.6557 55.9199 30.4397 176.1994 53 K 3.9967 8.5692 124.8718 56.7096 33.0157 174.5016 54 V 3.1081 8.5753 126.7456 63.3747 30.8515 171.7011 55 T 4.7281 8.0747 114.6016 60.4409 71.7412 172.1222 56 S 4.6231 7.9948 114.7758 57.1221 65.6725 174.8398 57 T 3.9788 8.4456 119.2318 66.5929 68.1750 176.2804 58 L 4.1350 7.6966 119.5372 56.2211 41.9898 177.2341 59 L 3.8420 7.1549 120.3441 54.9328 40.7956 176.2084 60 E 4.1636 8.6683 127.1432 55.6036 28.9978 176.4593 61 Q 4.3065 8.5235 128.9445 58.6834 29.6681 177.7855 62 D 4.3621 8.1978 116.9376 57.2080 40.8768 177.1233 63 T 4.3235 7.1993 111.8706 63.3702 69.0388 174.6030 63A S 4.5490 7.4870 116.7414 57.6577 63.4840 173.9342 64 T 4.2586 7.9044 121.7735 63.1435 71.1868 173.1307 65 E 4.8609 8.6402 122.2115 55.6222 31.2841 175.9151 66 K 4.7663 7.7739 116.1576 56.2417 37.1325 175.4669 67 L 5.2226 7.7850 119.3338 53.1048 43.6649 175.7034 68 Y 4.7179 8.8316 121.5985 55.8092 41.7088 175.0530 69 K 4.5253 8.7948 124.5699 55.8768 33.2808 176.0432 70 L 4.4907 8.5056 125.8189 55.8061 43.1857 175.4177 71 N 4.9438 7.5316 113.5254 52.6155 41.7505 172.6094 72 D 4.6324 8.6952 115.7887 55.6316 41.5693 177.0961 73 K 4.7086 7.9866 116.3663 55.9303 34.4015 175.5344 74 I 5.2930 7.6527 120.5082 59.6545 41.5255 174.0460 75 A 5.0966 8.9344 125.7498 50.9817 23.4100 175.2426 76 V 4.9380 8.8683 110.8659 59.6807 36.6448 174.6174 77 A 5.3712 8.8246 124.3665 50.2776 21.6259 175.5917 78 V 4.9224 8.8031 121.8308 61.1104 34.3739 175.2390 79 A 4.3420 9.1547 127.8078 52.3790 21.5896 173.9145 80 G 3.7098 8.7256 112.3520 44.9391 0.0000 172.8021 81 L 4.1184 8.6881 125.4496 54.8430 41.9523 177.9539 82 T 3.8936 8.7981 121.5070 66.5887 68.3092 176.3218 83 A 4.0055 7.9862 122.0756 55.4040 18.3650 179.2341 84 D 4.4467 8.1554 116.6480 57.4045 40.8506 178.7879 85 A 4.0839 8.0175 121.2617 55.3074 18.4218 179.3961 86 E 3.6062 8.2605 117.1663 59.5087 29.2062 179.6892 87 I 3.7106 7.5231 119.8138 64.4995 37.2245 178.4675 88 L 3.8195 7.5191 119.6974 57.6729 41.3334 179.3419 89 I 3.4487 8.2752 120.2839 64.6587 37.2062 177.8015 90 N 4.2492 8.2251 117.7063 57.0417 38.6302 176.9331 91 T 3.9721 7.7360 110.6880 64.4395 68.9433 176.6833 92 A 3.9724 8.0558 123.9439 55.0207 18.3538 179.7603 93 R 3.8967 8.2647 116.9039 59.4607 30.0414 179.4095 94 I 3.7381 7.7151 119.3215 64.5419 37.1234 177.7983 95 H 4.2061 8.5632 119.1697 59.3997 29.6575 177.0948 96 A 3.9724 8.0911 122.3787 55.3835 18.1833 179.7076 97 Q 4.0546 8.0441 116.1333 58.9922 28.6577 178.6763 98 N 4.3722 8.5893 118.0859 56.2851 38.4911 176.7452 99 Y 3.9572 8.2205 120.9499 60.5743 38.9393 177.8467 100 L 4.3360 8.0837 122.5272 57.6619 42.0152 178.8189 101 K 3.9501 8.2004 118.5023 59.7932 32.1455 178.6336 102 T 3.7601 7.8046 115.2066 66.0713 68.4961 175.6456 103 Y 4.5325 7.6228 115.1478 56.4700 39.0961 175.3340 104 N 4.3904 8.7001 116.6637 53.7057 36.7848 173.9537 105 E 4.8239 7.8800 114.7832 54.6315 33.8867 175.0096 106 D 4.5128 8.6714 122.3641 54.2703 41.5464 176.2171 107 I 2.8733 8.0985 122.8437 59.6474 38.5908 174.0838 108 P 4.1364 0.0000 0.0000 62.4218 32.1575 176.9656 109 V 3.4333 8.3779 122.6071 66.4456 31.3015 178.1438 110 E 3.7899 7.9751 118.0559 59.2217 29.4482 178.5488 111 I 3.6274 7.3508 119.8535 64.2603 37.1441 178.1651 112 L 3.8566 7.5504 120.6265 58.0716 41.9868 179.0364 113 V 3.0009 7.4161 118.1945 65.6314 31.2750 178.0464 114 R 3.8380 8.3024 119.0712 59.1089 29.8893 178.5052 115 R 3.8400 7.7855 118.1418 59.5544 30.0429 178.4986 116 L 4.0094 7.6886 118.2524 58.0116 41.4764 179.8249 117 S 4.2434 8.1546 115.1605 61.5661 62.7380 176.4028 118 D 4.3865 8.3032 121.8888 57.2479 40.2761 178.8806 119 I 3.8213 7.6053 119.6268 64.3255 36.9253 178.2701 120 K 4.2391 7.8558 119.2053 59.6101 31.9087 178.9385 121 Q 4.1515 8.5269 120.2299 59.2331 28.7586 178.7796 122 G 3.6780 8.2318 106.5132 48.1695 0.0000 174.9346 123 Y 4.0371 7.8732 115.6096 59.5355 37.8757 177.6243 124 T 4.3340 7.8483 116.1696 63.8933 69.4562 174.9093 125 Q 4.4476 7.7118 119.8114 56.0215 30.6966 174.4210 126 H 4.5818 7.6881 110.0169 55.8645 30.3343 173.6420 127 G 3.8400 9.0239 108.7065 44.3640 0.0000 174.9708 128 G 4.4778 7.9054 105.8913 46.2737 0.0000 173.1424 129 L 4.7128 6.9889 118.0224 52.1334 43.8072 176.8880 130 R 4.1323 8.1640 117.0865 55.5597 30.1182 174.6297 131 P 4.5640 0.0000 0.0000 61.5524 32.4758 175.9116 132 F 4.3003 8.5175 118.7445 57.5406 40.0032 177.3800 133 G 4.0222 8.9931 115.3702 44.8420 0.0000 172.6497 134 V 4.8970 7.2499 118.6026 61.5780 35.7627 174.7526 135 S 4.6001 8.4683 121.0879 56.6489 66.6081 173.0603 136 F 5.3882 8.6466 121.4859 55.6757 42.2838 174.5694 137 I 4.4961 8.4020 122.4126 59.8698 39.6691 174.0264 138 Y 5.0676 8.8568 124.7603 56.3005 39.8333 174.9665 139 A 4.7455 9.1031 126.2072 50.2841 21.5718 175.2370 140 G 4.9733 8.5316 108.0638 45.6296 0.0000 170.9704 141 Y 4.9693 8.4159 120.3751 55.7398 41.7448 173.8448 142 D 4.5743 7.3871 123.9689 51.5095 42.5983 174.8878 143 D 4.3429 8.3607 117.8618 54.4348 39.9187 176.3787 144 R 4.0656 8.3120 126.0802 56.5260 29.9790 175.4945 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 4 G 8.35 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 5 S 8.89 4.36 0.00 4.04 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 6 R 8.28 3.96 0.00 1.84 1.94 0.00 3.16 0.00 0.00 3.25 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.67 0.00 7 R 8.00 3.69 0.00 1.54 1.20 0.00 2.33 0.00 0.00 2.92 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 1.34 0.00 8 Y 8.28 4.49 0.00 2.91 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 9 D 7.67 4.56 0.00 2.65 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 10 S 8.74 4.15 0.00 3.91 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 11 R 8.50 3.81 0.00 2.02 1.96 0.00 3.12 0.00 0.00 3.21 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.67 0.00 12 T 7.77 4.11 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 13 T 7.33 4.62 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 1.21 0.00 0.00 14 I 7.08 4.59 1.96 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 1.70 1.20 0.93 0.00 0.00 15 F 8.49 4.77 0.00 3.10 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 16 S 8.40 4.68 0.00 3.67 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 17 P 0.00 4.54 0.00 2.09 2.18 0.00 3.75 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.18 0.00 18 E 8.11 4.29 0.00 1.87 1.93 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 2.25 2.34 0.00 19 G 8.33 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.91 4.61 0.00 1.62 1.78 0.00 3.05 0.00 0.00 3.10 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.49 0.00 21 L 7.98 4.60 0.00 1.57 1.49 0.81 0.21 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 22 Y 7.39 3.50 0.00 2.92 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 23 Q 8.09 4.09 0.00 2.05 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.91 0.00 0.00 0.00 0.00 0.00 2.50 2.42 0.00 24 V 7.60 3.56 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 1.15 0.00 0.00 0.90 0.00 0.00 25 E 7.98 3.93 0.00 1.92 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 2.31 2.35 0.00 26 Y 8.12 4.44 0.00 2.98 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 27 A 8.42 4.05 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.23 3.91 0.00 1.92 1.75 0.92 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 29 E 8.17 3.97 0.00 2.04 2.24 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 2.37 2.44 0.00 30 S 7.97 4.33 0.00 4.01 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 31 I 7.97 3.72 1.96 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 1.78 0.63 0.92 0.00 0.00 32 S 7.96 4.40 0.00 3.94 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 33 H 7.67 4.70 0.00 3.20 3.34 0.00 5.65 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 A 8.17 4.41 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 35 G 8.54 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 36 T 8.68 4.28 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 1.21 0.00 0.00 37 A 8.50 5.12 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 38 I 9.52 4.58 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 1.17 0.76 0.92 0.00 0.00 39 G 8.70 4.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.76 4.71 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 1.12 0.67 0.92 0.00 0.00 41 M 8.82 4.84 0.00 2.03 1.97 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.49 0.00 42 A 8.89 4.74 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 43 S 8.63 4.32 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 44 D 8.81 4.84 0.00 2.77 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 45 G 6.88 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 46 I 7.65 5.12 1.91 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.76 0.97 0.00 0.00 47 V 9.04 4.53 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 0.98 0.00 0.00 0.94 0.00 0.00 48 L 8.60 5.39 0.00 1.53 1.53 0.94 0.75 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 49 A 9.03 4.76 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 50 A 8.56 5.06 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 51 E 9.22 4.47 0.00 2.01 1.83 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 2.23 2.27 0.00 52 R 8.57 4.28 0.00 1.84 1.88 0.00 3.25 0.00 0.00 3.14 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.60 0.00 53 K 8.57 4.00 0.00 1.72 1.71 0.00 1.94 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.42 1.43 7.81 54 V 8.58 3.11 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 0.84 0.00 0.00 0.93 0.00 0.00 55 T 8.07 4.73 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 1.21 0.00 0.00 56 S 7.99 4.62 0.00 3.82 3.70 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 0.00 0.00 0.00 0.00 57 T 8.45 3.98 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 1.21 0.00 0.00 58 L 7.70 4.14 0.00 1.65 1.72 0.92 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 59 L 7.15 3.84 0.00 1.63 1.72 0.92 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 60 E 8.67 4.16 0.00 2.08 1.85 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 2.37 2.35 0.00 61 Q 8.52 4.31 0.00 2.12 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.41 6.66 0.00 0.00 0.00 0.00 0.00 2.40 2.36 0.00 62 D 8.20 4.36 0.00 2.68 2.71 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 63 T 7.20 4.32 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 1.21 0.00 0.00 63A S 7.49 4.55 0.00 4.02 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 64 T 7.90 4.26 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 0.55 0.00 0.00 65 E 8.64 4.86 0.00 2.06 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 2.15 2.31 0.00 66 K 7.77 4.77 0.00 1.67 1.84 0.00 1.70 0.00 0.00 1.82 0.00 0.00 2.93 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.47 1.47 7.81 67 L 7.78 5.22 0.00 1.37 1.49 0.93 0.73 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 68 Y 8.83 4.72 0.00 2.82 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 69 K 8.79 4.53 0.00 1.73 1.74 0.00 1.76 0.00 0.00 1.72 0.00 0.00 2.92 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.48 1.51 7.81 70 L 8.51 4.49 0.00 1.81 1.67 0.90 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 71 N 7.53 4.94 0.00 2.61 2.83 0.00 0.00 6.96 8.47 0.00 0.00 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 D 8.70 4.63 0.00 2.73 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 73 K 7.99 4.71 0.00 1.72 2.04 0.00 1.69 0.00 0.00 2.17 0.00 0.00 2.87 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.47 1.47 7.81 74 I 7.65 5.29 1.88 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 1.28 0.70 0.96 0.00 0.00 75 A 8.93 5.10 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 76 V 8.87 4.94 1.83 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 0.34 0.00 0.00 0.84 0.00 0.00 77 A 8.82 5.37 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 78 V 8.80 4.92 2.25 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 0.73 0.00 0.00 1.24 0.00 0.00 79 A 9.15 4.34 1.17 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 0.00 0.00 80 G 8.73 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 81 L 8.69 4.12 0.00 1.65 1.64 0.92 0.83 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 82 T 8.80 3.89 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 1.35 0.00 0.00 83 A 7.99 4.01 1.33 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 84 D 8.16 4.45 0.00 2.95 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 85 A 8.02 4.08 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 86 E 8.26 3.61 0.00 2.14 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 2.12 2.55 0.00 87 I 7.52 3.71 2.19 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.16 1.05 0.00 0.00 88 L 7.52 3.82 0.00 1.84 1.64 0.61 0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 89 I 8.28 3.45 1.81 0.00 0.00 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.42 0.78 0.00 0.00 90 N 8.23 4.25 0.00 2.82 2.81 0.00 0.00 7.09 6.80 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 91 T 7.74 3.97 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 92 A 8.06 3.97 1.33 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 93 R 8.26 3.90 0.00 2.01 2.00 0.00 3.14 0.00 0.00 3.18 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.83 0.00 94 I 7.72 3.74 2.02 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 0.71 0.94 0.00 0.00 95 H 8.56 4.21 0.00 3.31 3.49 0.00 5.78 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 A 8.09 3.97 1.36 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 0.00 0.00 0.00 97 Q 8.04 4.05 0.00 2.23 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.76 0.00 0.00 0.00 0.00 0.00 2.60 2.56 0.00 98 N 8.59 4.37 0.00 2.99 2.91 0.00 0.00 6.57 8.26 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 99 Y 8.22 3.96 0.00 3.24 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 0.00 100 L 8.08 4.34 0.00 2.00 1.89 1.02 0.37 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 0.00 101 K 8.20 3.95 0.00 1.85 1.91 0.00 1.83 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.40 1.46 7.81 102 T 7.80 3.76 3.64 0.00 0.00 0.00 0.00 0.00 0.00 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 0.00 103 Y 7.62 4.53 0.00 2.55 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 0.00 104 N 8.70 4.39 0.00 2.84 2.93 0.00 0.00 6.72 7.57 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 0.00 105 E 7.88 4.82 0.00 2.14 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 0.00 2.35 2.56 0.00 106 D 8.67 4.51 0.00 2.69 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 0.00 107 I 8.10 2.87 1.65 0.00 0.00 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 -0.36 0.75 0.00 0.00 108 P 0.00 4.14 0.00 1.98 1.79 0.00 2.74 0.00 0.00 3.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.91 0.00 109 V 8.38 3.43 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 0.92 0.00 0.00 0.86 0.00 0.00 110 E 7.98 3.79 0.00 1.97 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 0.00 2.29 2.30 0.00 111 I 7.35 3.63 1.74 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.83 0.83 0.00 0.00 112 L 7.55 3.86 0.00 1.52 1.65 0.86 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 113 V 7.42 3.00 1.86 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 0.47 0.00 0.00 -0.12 0.00 0.00 114 R 8.30 3.84 0.00 1.88 1.86 0.00 3.14 0.00 0.00 3.09 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.61 0.00 115 R 7.79 3.84 0.00 1.98 2.10 0.00 3.17 0.00 0.00 3.07 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.65 0.00 116 L 7.69 4.01 0.00 1.88 1.79 0.83 1.02 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 0.00 117 S 8.15 4.24 0.00 4.04 3.94 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 0.00 118 D 8.30 4.39 0.00 2.94 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 0.00 119 I 7.61 3.82 2.02 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 1.58 0.66 0.94 0.00 0.00 120 K 7.86 4.24 0.00 1.98 1.93 0.00 1.76 0.00 0.00 1.61 0.00 0.00 2.85 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.42 1.54 7.81 121 Q 8.53 4.15 0.00 2.23 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.78 0.00 0.00 0.00 0.00 0.00 2.39 2.57 0.00 122 G 8.23 3.68 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 0.00 0.00 0.00 123 Y 7.87 4.04 0.00 3.18 3.06 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 0.00 124 T 7.85 4.33 4.46 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 1.14 0.00 0.00 125 Q 7.71 4.45 0.00 1.92 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.68 0.00 0.00 0.00 0.00 0.00 2.28 2.23 0.00 126 H 7.69 4.58 0.00 3.17 3.20 0.00 5.74 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 G 9.02 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 0.00 0.00 0.00 128 G 7.91 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 0.00 129 L 6.99 4.71 0.00 1.52 1.64 0.88 0.83 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 0.00 130 R 8.16 4.13 0.00 1.90 1.93 0.00 2.99 0.00 0.00 3.20 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.52 0.00 131 P 0.00 4.56 0.00 2.09 2.09 0.00 3.67 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.12 0.00 132 F 8.52 4.30 0.00 2.86 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 0.00 133 G 8.99 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 0.00 0.00 0.00 134 V 7.25 4.90 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 -0.25 0.00 0.00 0.87 0.00 0.00 135 S 8.47 4.60 0.00 3.66 3.59 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 0.00 136 F 8.65 5.39 0.00 2.43 1.91 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 0.00 137 I 8.40 4.50 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 1.25 0.72 0.95 0.00 0.00 138 Y 8.86 5.07 0.00 2.79 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 0.00 139 A 9.10 4.75 1.25 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 0.00 140 G 8.53 4.97 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 0.00 141 Y 8.42 4.97 0.00 2.97 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 0.00 142 D 7.39 4.57 0.00 2.57 2.40 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 0.00 143 D 8.36 4.34 0.00 2.80 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 0.00 144 R 8.31 4.07 0.00 1.66 1.83 0.00 3.22 0.00 0.00 3.18 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.50 0.00