NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 101 L 4.3428 8.0433 120.6245 55.0619 44.0720 178.8781 102 C 3.9723 7.9915 116.0840 62.3232 28.0311 174.5881 103 K 3.9916 8.7653 120.9231 59.4738 32.0917 178.7796 104 N 4.3814 8.0575 116.3428 56.2674 38.5969 177.3589 105 L 4.0394 8.0710 120.4328 57.8230 41.6993 179.6114 106 L 4.1117 8.2435 119.1934 57.6215 41.5144 179.3611 107 Q 4.0187 8.3171 119.6522 59.3481 29.0672 178.1300 108 E 3.9983 8.3904 119.6518 59.3755 29.4310 178.7176 109 Y 4.0087 8.2273 119.3681 60.7160 38.9449 177.8678 110 A 3.9737 8.2988 121.6405 55.4182 18.4527 179.6060 111 Q 3.8963 8.1763 116.2962 59.1760 28.6192 179.3443 112 K 3.9623 7.8025 117.9046 58.8025 32.1031 178.2830 113 M 3.8164 7.1281 116.4388 53.8526 32.2549 175.6476 114 N 4.1247 7.4253 115.4259 54.5115 36.6718 173.7768 115 Y 4.9429 7.8120 114.9251 55.9719 40.0973 175.7295 116 A 4.2631 8.3651 124.0984 51.7118 19.0866 177.7258 117 I 3.8911 8.1638 113.4596 60.3227 38.0638 174.2342 118 P 4.5743 0.0000 0.0000 63.4487 32.0030 175.5361 119 L 4.6849 8.7876 124.2539 53.3063 43.6843 174.7117 120 Y 5.0277 8.6761 125.8891 56.3808 40.2334 174.3980 121 Q 4.3970 8.4989 127.4087 54.2431 32.4011 173.4700 122 C 5.2168 8.3882 120.1814 56.6663 33.0545 173.0136 123 Q 4.5296 9.0095 120.9091 54.8345 32.5331 172.9958 124 K 4.3296 8.6921 127.9824 55.3082 33.6211 175.5498 125 V 4.3767 8.4801 127.3845 61.0478 34.1414 173.8847 126 E 5.2074 8.7799 126.7589 54.7979 32.6098 175.6219 127 T 4.5023 8.0175 113.6760 59.9402 71.3141 175.7177 128 L 4.0419 8.6189 121.1362 57.1912 41.7432 178.4041 129 G 3.9043 8.0292 106.1431 44.7902 0.0000 173.5969 130 R 3.6878 7.6090 116.4502 57.1389 27.8219 176.9007 131 V 4.2433 7.7660 118.1740 61.6328 33.4469 174.8689 132 T 4.5828 8.4649 125.6884 62.8055 69.3233 174.3540 133 Q 4.7848 8.8365 123.6388 54.6832 32.7592 173.5670 134 F 5.2526 9.3865 119.8573 55.9690 42.1458 174.6431 135 T 5.0941 8.9473 112.0730 60.3750 72.2735 172.5254 136 C 5.2321 8.4545 118.7868 58.8939 33.1990 172.6508 137 T 5.0325 8.8280 114.6500 60.7108 71.2295 172.5364 138 V 4.7006 8.9130 127.2322 61.1345 34.2021 173.7226 139 E 4.8227 9.3030 130.1760 55.3303 31.0543 174.7139 140 I 4.4273 8.9188 128.9827 59.8248 39.6952 176.1456 141 G 3.8686 9.8926 115.3049 46.3925 0.0000 173.8867 142 G 3.7690 8.5679 105.9514 45.4002 0.0000 173.6514 143 I 4.1720 7.6321 121.5913 59.1359 39.0129 175.0447 144 K 4.3449 8.3230 127.5256 56.0576 33.0142 176.2493 145 Y 4.6827 8.9672 123.5352 56.7047 40.1462 174.7181 146 T 4.7259 8.0333 121.4936 61.4048 70.0836 175.5925 147 G 4.0929 8.8077 114.0715 45.0131 0.0000 173.0381 148 A 4.3802 8.5134 122.7584 51.0369 19.1710 177.5842 149 A 4.3325 8.4627 124.2220 52.4534 19.0776 177.1411 150 T 4.8253 8.6536 111.9025 59.6121 72.1192 175.0878 151 R 4.1027 8.6486 119.7244 58.2584 30.5829 177.5944 152 T 4.5663 7.2753 107.7483 59.0323 72.8643 174.9280 153 K 3.7160 7.3028 122.1882 59.4076 32.3376 179.2486 154 K 3.9157 7.7432 118.4075 59.5333 32.0037 178.9228 155 D 4.3688 7.9745 118.7686 57.1935 40.7469 178.6388 156 A 4.0751 8.0851 121.4708 54.9369 18.3003 179.3292 157 E 4.0712 8.4567 117.9910 59.7088 29.7769 179.0460 158 I 3.6765 7.6722 118.0917 63.7230 37.9636 177.8620 159 S 4.0519 8.1520 114.2089 61.3681 62.2942 175.9985 160 A 4.2012 8.2909 123.6544 55.0178 18.0744 179.8809 161 G 3.5615 8.4156 104.4614 47.9848 0.0000 176.1801 162 R 3.9122 8.2335 120.8888 59.1863 30.0989 179.2751 163 T 3.7915 8.0004 115.1616 66.5524 68.5034 176.5662 164 A 3.3984 8.0261 122.5019 54.8534 18.3902 179.4024 165 L 3.7239 7.8648 118.8024 58.3297 42.1964 179.1729 166 L 3.8613 7.9388 118.7087 57.7229 41.2916 179.4159 167 A 3.8639 7.4751 119.7622 55.1158 18.2597 179.4787 168 I 3.5911 7.1950 117.5057 63.7805 37.2259 177.6611 169 Q 4.2744 7.6641 116.2517 56.0603 28.9817 176.3131 170 S 4.3474 7.6658 120.0175 58.5794 62.5892 173.1860 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 101 L 8.04 4.34 0.00 1.71 1.77 0.91 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 102 C 7.99 3.97 0.00 3.02 2.96 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 0.00 0.00 0.00 103 K 8.77 3.99 0.00 1.77 1.85 0.00 1.57 0.00 0.00 1.73 0.00 0.00 2.63 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.50 1.47 7.81 104 N 8.06 4.38 0.00 2.88 2.87 0.00 0.00 7.15 6.73 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 0.00 105 L 8.07 4.04 0.00 1.84 1.71 0.91 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 106 L 8.24 4.11 0.00 1.90 1.80 0.97 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 107 Q 8.32 4.02 0.00 2.28 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.81 0.00 0.00 0.00 0.00 0.00 2.38 2.44 0.00 108 E 8.39 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 2.34 2.49 0.00 109 Y 8.23 4.01 0.00 3.09 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 0.00 110 A 8.30 3.97 1.58 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 0.00 0.00 111 Q 8.18 3.90 0.00 2.26 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.75 0.00 0.00 0.00 0.00 0.00 2.38 2.56 0.00 112 K 7.80 3.96 0.00 1.71 1.73 0.00 1.69 0.00 0.00 1.68 0.00 0.00 3.01 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.42 1.60 7.81 113 M 7.13 3.82 0.00 0.51 1.15 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.77 0.00 114 N 7.43 4.12 0.00 2.74 2.88 0.00 0.00 6.79 7.52 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 0.00 115 Y 7.81 4.94 0.00 2.87 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 0.00 116 A 8.37 4.26 1.28 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 0.00 0.00 0.00 117 I 8.16 3.89 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 1.45 0.68 0.95 0.00 0.00 118 P 0.00 4.57 0.00 2.04 2.15 0.00 3.70 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 2.17 2.25 0.00 119 L 8.79 4.68 0.00 1.63 1.61 1.00 0.71 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 0.00 120 Y 8.68 5.03 0.00 2.96 2.90 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 0.00 0.00 0.00 121 Q 8.50 4.40 0.00 1.99 1.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.42 0.00 0.00 0.00 0.00 0.00 2.12 2.18 0.00 122 C 8.39 5.22 0.00 3.02 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 0.00 123 Q 9.01 4.53 0.00 2.05 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.91 0.00 0.00 0.00 0.00 0.00 2.22 2.28 0.00 124 K 8.69 4.33 0.00 1.79 1.61 0.00 1.79 0.00 0.00 1.57 0.00 0.00 2.65 0.00 0.00 2.56 0.00 0.00 0.00 0.00 1.04 0.42 7.81 125 V 8.48 4.38 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 0.87 0.00 0.00 0.87 0.00 0.00 126 E 8.78 5.21 0.00 1.79 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 2.09 2.14 0.00 127 T 8.02 4.50 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 1.24 0.00 0.00 128 L 8.62 4.04 0.00 1.65 1.77 0.91 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 129 G 8.03 3.90 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 0.00 0.00 0.00 0.00 0.00 0.00 130 R 7.61 3.69 0.00 1.98 2.02 0.00 3.13 0.00 0.00 3.14 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.54 0.00 131 V 7.77 4.24 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 0.95 0.00 0.00 0.97 0.00 0.00 132 T 8.46 4.58 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 1.04 0.00 0.00 133 Q 8.84 4.78 0.00 2.19 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.74 0.00 0.00 0.00 0.00 0.00 2.30 2.27 0.00 134 F 9.39 5.25 0.00 3.17 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 0.00 135 T 8.95 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 1.22 0.00 0.00 136 C 8.45 5.23 0.00 3.12 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 0.00 137 T 8.83 5.03 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 1.19 0.00 0.00 138 V 8.91 4.70 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 1.08 0.00 0.00 1.17 0.00 0.00 139 E 9.30 4.82 0.00 2.06 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 2.25 2.23 0.00 140 I 8.92 4.43 2.25 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.05 1.23 0.00 0.00 141 G 9.89 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 0.00 142 G 8.57 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 0.00 143 I 7.63 4.17 1.87 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 1.13 0.52 0.35 0.00 0.00 144 K 8.32 4.34 0.00 1.51 1.66 0.00 1.63 0.00 0.00 1.65 0.00 0.00 2.99 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.37 1.37 7.81 145 Y 8.97 4.68 0.00 2.97 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 0.00 146 T 8.03 4.73 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 1.27 0.00 0.00 147 G 8.81 4.09 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 0.00 0.00 0.00 148 A 8.51 4.38 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 0.00 149 A 8.46 4.33 1.31 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 0.00 0.00 0.00 150 T 8.65 4.83 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 0.00 151 R 8.65 4.10 0.00 1.88 2.10 0.00 3.17 0.00 0.00 3.31 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.66 0.00 152 T 7.28 4.57 4.09 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 1.20 0.00 0.00 153 K 7.30 3.72 0.00 0.83 1.43 0.00 1.71 0.00 0.00 1.75 0.00 0.00 3.08 0.00 0.00 3.22 0.00 0.00 0.00 0.00 1.47 1.54 7.81 154 K 7.74 3.92 0.00 1.77 1.79 0.00 1.66 0.00 0.00 1.77 0.00 0.00 2.89 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.46 1.43 7.81 155 D 7.97 4.37 0.00 2.82 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 0.00 156 A 8.09 4.08 1.58 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 0.00 0.00 157 E 8.46 4.07 0.00 2.20 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 0.00 2.15 1.95 0.00 158 I 7.67 3.68 1.85 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 1.40 1.29 0.98 0.00 0.00 159 S 8.15 4.05 0.00 4.10 4.09 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 0.00 160 A 8.29 4.20 1.58 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 0.00 0.00 161 G 8.42 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 162 R 8.23 3.91 0.00 2.04 1.97 0.00 3.13 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.80 0.00 163 T 8.00 3.79 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 1.33 0.00 0.00 164 A 8.03 3.40 1.39 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 0.00 0.00 0.00 165 L 7.86 3.72 0.00 1.79 1.64 0.86 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 166 L 7.94 3.86 0.00 1.70 1.63 0.91 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 167 A 7.48 3.86 0.78 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 0.00 168 I 7.19 3.59 1.64 0.00 0.00 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 1.31 0.46 -0.05 0.00 0.00 169 Q 7.66 4.27 0.00 1.93 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.94 6.95 0.00 0.00 0.00 0.00 0.00 2.42 2.43 0.00 170 S 7.67 4.35 0.00 3.97 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