NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 81 P 4.3289 0.0000 0.0000 61.7257 32.8559 175.8431 82 L 3.8498 7.5455 119.1785 55.4835 42.8169 177.0509 83 K 4.0561 8.5840 117.9918 57.1774 32.4665 177.8582 84 N 4.6152 7.8755 116.4002 54.3659 39.2728 175.6634 85 L 4.3601 7.6778 116.9660 56.5523 42.1723 176.5666 86 V 4.1192 7.3781 118.7764 62.0608 31.1066 175.2478 87 L 4.4428 8.8948 128.7513 56.2186 42.6772 176.7786 88 D 4.5962 7.5352 114.8764 53.6829 44.3753 174.8040 89 I 5.2468 8.3199 124.3663 60.0509 41.2788 173.8235 90 D 4.6096 8.9142 124.2212 55.0283 45.6507 172.8973 91 Y 4.8154 7.6020 116.2147 56.8913 40.6668 173.5387 92 N 4.3869 8.1308 119.9787 53.4653 39.8522 175.1309 93 D 4.6298 8.8305 114.8931 54.8338 41.8276 176.6028 94 A 4.5924 8.5908 121.2217 52.9369 20.9072 176.6165 95 V 4.7042 7.4487 106.3850 59.8853 36.9866 174.4356 96 V 4.4871 8.5751 122.4377 61.4572 33.6510 174.5290 97 V 4.9927 9.0413 128.1830 61.2226 33.9481 174.2031 98 I 5.1398 8.6581 127.9874 59.8561 40.6970 174.0786 99 H 5.3886 9.3168 123.3417 54.3790 31.2850 173.5982 100 T 4.9444 8.8735 113.7468 59.6354 72.3843 173.7103 101 S 4.5325 8.8168 117.7116 57.3717 64.1211 172.8277 102 P 4.3059 0.0000 0.0000 64.6587 31.1248 176.9385 103 G 3.8585 9.0517 110.5087 45.9727 0.0000 174.0978 104 A 4.4533 8.0456 120.6482 51.8498 19.1433 178.7308 105 A 3.9028 7.7849 120.5016 55.4025 18.7149 179.7012 106 Q 3.9293 8.0888 115.8183 59.0642 28.5907 178.9991 107 L 3.9340 7.7714 119.2364 58.4554 42.0489 178.7398 108 I 3.8243 7.8175 119.4301 64.1827 36.9720 178.3539 109 A 4.1222 8.3816 122.0858 54.9426 17.9220 179.5432 110 R 3.8614 7.7175 116.4062 59.4316 30.3563 178.1062 111 L 4.0920 7.6736 119.2510 58.3736 42.0791 178.8067 112 L 4.0440 8.1117 118.1744 58.0948 41.4205 178.8114 113 D 4.5346 8.0302 116.6965 55.8439 40.8029 177.7318 114 S 4.4597 8.3062 114.5084 59.3559 63.5866 175.6267 115 L 3.8814 7.8025 123.0839 57.7226 41.8202 178.4573 116 G 4.0622 7.8962 103.5791 44.6571 0.0000 174.1164 117 K 3.9578 8.7974 117.0751 58.4790 32.2102 179.4337 118 A 4.0813 8.0404 120.5066 54.9009 18.3493 177.7516 119 E 4.2696 8.0587 112.7961 56.3373 29.9188 176.8371 120 G 2.0044 8.1574 108.1990 44.9159 0.0000 172.9389 121 I 4.2449 7.1535 120.6698 59.0555 38.2318 176.1784 122 L 3.9625 9.0612 129.3584 57.7844 42.6062 176.7000 123 G 4.2346 7.7171 103.1814 46.1178 0.0000 171.7767 124 T 5.2921 8.2330 115.6564 62.1809 72.5654 173.8784 125 I 4.7099 9.0853 126.3534 59.3849 40.9175 174.4966 126 A 5.2290 8.8231 128.8565 50.4391 22.5524 175.8933 127 G 4.0797 8.2363 108.1624 45.9387 0.0000 174.3470 128 D 4.6560 8.8989 123.1756 54.9568 42.1654 176.3612 129 D 5.0839 7.8090 114.0993 51.6123 41.5311 175.2339 130 T 5.2348 7.8851 115.7270 62.0277 72.9483 172.7633 131 I 5.0948 8.6123 124.2767 59.7121 41.5145 174.1791 132 F 5.5807 9.3332 125.3987 56.1246 41.4849 174.6490 133 T 5.1328 8.8569 117.0826 60.7280 71.3622 172.2998 134 T 4.9919 8.4792 119.7866 59.6659 71.2194 171.2959 135 P 5.4671 0.0000 0.0000 62.1526 32.3932 175.8627 136 A 4.4463 8.2853 123.6516 51.0742 20.4431 176.1893 137 N 4.3819 8.6919 117.2590 55.0220 39.4329 175.2911 138 G 3.8175 8.9156 111.4595 45.4601 0.0000 173.1387 139 F 4.8317 7.6820 116.6467 55.2751 42.0032 175.6097 140 T 4.5005 8.4990 115.5898 60.3918 71.7348 176.2785 141 V 3.5118 8.0992 120.2110 65.9364 31.4860 177.8528 142 K 3.2996 7.8022 118.9176 59.1440 32.0168 178.4728 143 D 4.3558 7.9466 119.0424 57.0112 40.7362 178.3204 144 L 3.7570 7.6188 120.7286 58.1653 42.0895 178.0994 145 Y 3.9686 7.9752 119.7159 61.0873 38.7802 178.3240 146 E 3.7347 8.2005 118.8601 59.0837 29.4882 179.2943 147 A 4.1085 7.7944 122.4070 54.4589 18.3032 179.7713 148 I 3.1652 7.5904 118.3876 64.1717 37.1266 178.3640 149 L 3.7914 7.3021 120.0426 57.9109 41.0061 179.4843 150 E 4.0850 7.8590 116.0273 58.4714 29.4473 178.6452 151 L 3.9558 7.3832 121.3375 57.8152 42.1457 178.5202 152 F 4.7947 7.9126 117.2571 60.6495 39.1334 175.2298 153 D 4.5967 8.0092 121.3456 54.7805 40.6447 176.3288 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 81 P 0.00 4.33 0.00 2.15 2.16 0.00 3.74 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.98 0.00 82 L 7.55 3.85 0.00 1.77 1.62 0.90 0.36 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 83 K 8.58 4.06 0.00 1.70 1.64 0.00 0.98 0.00 0.00 1.46 0.00 0.00 2.43 0.00 0.00 2.62 0.00 0.00 0.00 0.00 1.40 1.16 7.81 84 N 7.88 4.62 0.00 2.65 2.79 0.00 0.00 7.16 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 85 L 7.68 4.36 0.00 1.69 1.63 0.87 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 86 V 7.38 4.12 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 0.79 0.00 0.00 0.48 0.00 0.00 87 L 8.89 4.44 0.00 1.74 1.73 0.93 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 88 D 7.54 4.60 0.00 2.79 2.56 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 89 I 8.32 5.25 2.09 0.00 0.00 1.12 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 0.95 1.14 0.00 0.00 90 D 8.91 4.61 0.00 2.82 2.49 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 7.60 4.82 0.00 3.16 2.84 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 92 N 8.13 4.39 0.00 2.68 2.56 0.00 0.00 6.92 7.90 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 93 D 8.83 4.63 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 94 A 8.59 4.59 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 95 V 7.45 4.70 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 0.37 0.00 0.00 96 V 8.58 4.49 2.10 0.00 0.00 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 0.00 0.00 0.92 0.00 0.00 97 V 9.04 4.99 2.07 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 0.92 0.00 0.00 0.59 0.00 0.00 98 I 8.66 5.14 1.98 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 1.34 1.06 1.11 0.00 0.00 99 H 9.32 5.39 0.00 3.14 3.23 0.00 5.76 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 T 8.87 4.94 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 1.21 0.00 0.00 101 S 8.82 4.53 0.00 3.78 3.82 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 0.00 102 P 0.00 4.31 0.00 2.17 2.08 0.00 3.79 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.98 0.00 103 G 9.05 3.86 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 0.00 0.00 0.00 104 A 8.05 4.45 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 0.00 105 A 7.78 3.90 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.09 3.93 0.00 2.07 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.85 0.00 0.00 0.00 0.00 0.00 2.45 2.37 0.00 107 L 7.77 3.93 0.00 1.62 1.85 0.89 1.01 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 0.00 108 I 7.82 3.82 1.87 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.09 0.82 0.00 0.00 109 A 8.38 4.12 1.43 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 0.00 0.00 0.00 110 R 7.72 3.86 0.00 2.03 1.99 0.00 3.28 0.00 0.00 3.15 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.65 0.00 111 L 7.67 4.09 0.00 2.06 1.83 1.14 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 112 L 8.11 4.04 0.00 1.92 1.72 0.75 1.28 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 0.00 113 D 8.03 4.53 0.00 2.86 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 0.00 114 S 8.31 4.46 0.00 3.97 3.97 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 0.00 115 L 7.80 3.88 0.00 1.78 1.67 0.79 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 116 G 7.90 4.06 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 0.00 0.00 0.00 117 K 8.80 3.96 0.00 1.84 1.94 0.00 1.97 0.00 0.00 1.80 0.00 0.00 2.95 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.54 1.49 7.81 118 A 8.04 4.08 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 0.00 119 E 8.06 4.27 0.00 1.86 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 2.33 0.00 120 G 8.16 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 0.00 0.00 0.00 0.00 0.00 0.00 121 I 7.15 4.24 1.77 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 1.11 1.00 0.87 0.00 0.00 122 L 9.06 3.96 0.00 1.69 1.70 0.94 1.04 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 0.00 123 G 7.72 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 0.00 0.00 0.00 0.00 124 T 8.23 5.29 4.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 125 I 9.09 4.71 1.89 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 1.16 0.85 0.86 0.00 0.00 126 A 8.82 5.23 1.21 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 0.00 0.00 127 G 8.24 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 0.00 0.00 0.00 128 D 8.90 4.66 0.00 2.74 2.64 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 0.00 129 D 7.81 5.08 0.00 2.96 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 0.00 130 T 7.89 5.23 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 1.37 0.00 0.00 131 I 8.61 5.09 1.97 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.03 1.04 0.00 0.00 132 F 9.33 5.58 0.00 2.87 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 0.00 133 T 8.86 5.13 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 1.26 0.00 0.00 134 T 8.48 4.99 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 1.23 0.00 0.00 135 P 0.00 5.47 0.00 2.33 1.99 0.00 3.41 0.00 0.00 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.88 0.00 136 A 8.29 4.45 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 0.00 137 N 8.69 4.38 0.00 2.71 2.76 0.00 0.00 6.97 7.98 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 0.00 138 G 8.92 3.82 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 0.00 0.00 0.00 139 F 7.68 4.83 0.00 3.19 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 0.00 140 T 8.50 4.50 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 1.24 0.00 0.00 141 V 8.10 3.51 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 1.09 0.00 0.00 0.93 0.00 0.00 142 K 7.80 3.30 0.00 1.80 1.75 0.00 1.89 0.00 0.00 1.93 0.00 0.00 2.99 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.68 1.55 7.81 143 D 7.95 4.36 0.00 3.03 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 0.00 144 L 7.62 3.76 0.00 1.60 1.68 0.88 1.07 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 0.00 145 Y 7.98 3.97 0.00 2.65 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 0.00 146 E 8.20 3.73 0.00 2.04 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 2.39 2.57 0.00 147 A 7.79 4.11 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 0.00 148 I 7.59 3.17 1.67 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.61 0.22 0.00 0.00 149 L 7.30 3.79 0.00 1.59 1.56 0.40 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 150 E 7.86 4.08 0.00 2.23 2.14 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 2.23 2.42 0.00 151 L 7.38 3.96 0.00 1.64 1.45 0.84 0.59 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 0.00 152 F 7.91 4.79 0.00 3.12 2.95 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 0.00 153 D 8.01 4.60 0.00 2.67 2.61 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 0.00 0.00 0.00 0.00