NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 71 K 4.2920 8.3149 120.1311 56.2319 33.5528 174.9517 72 T 4.0483 8.1403 116.7990 61.9327 68.9926 172.9892 73 P 4.3014 0.0000 0.0000 62.0011 33.1524 174.8906 74 P 4.4681 0.0000 0.0000 62.3703 33.2179 177.6982 75 A 4.0491 8.5274 121.9173 55.5177 18.4114 180.2206 76 S 4.1521 8.1732 112.3343 61.6034 62.8582 176.3679 77 F 4.0863 8.1157 123.5083 61.2077 39.3305 176.8432 78 L 3.8972 8.2221 118.5274 57.7168 41.3070 179.7242 79 L 3.9211 8.3837 119.1696 57.7188 41.6487 179.3312 80 K 3.7768 8.2346 118.8120 59.5786 32.0055 179.3434 81 K 3.7335 7.6692 117.9626 59.4305 31.7548 179.1971 82 A 3.9313 7.7384 119.2412 55.1623 18.4014 179.1749 83 A 4.2795 8.0914 117.5568 52.6981 18.5654 177.9963 84 G 3.7267 7.8280 105.3728 46.4412 0.0000 173.2802 85 I 4.5307 7.5844 112.1803 58.6073 40.1563 174.6759 86 E 4.5879 8.5521 116.1455 56.0629 31.0707 176.0343 87 K 4.6140 7.6377 117.3658 54.5106 36.1392 176.0028 88 G 3.9092 8.3652 110.6288 44.3985 0.0000 173.4314 89 S 4.2614 8.2740 114.5873 58.1547 62.6972 174.4054 90 S 4.4647 8.4868 119.6091 59.8309 63.8352 174.6117 91 E 4.6329 8.1639 120.8659 53.2307 30.1785 172.4273 92 P 4.4382 0.0000 0.0000 63.9486 32.5225 176.1466 93 K 4.4837 8.9080 124.8132 57.2768 30.5180 178.1938 94 R 4.0503 7.7674 115.2770 58.0588 30.3374 176.6641 95 K 4.3948 8.1222 118.3187 54.6128 34.3583 175.2329 96 I 4.3233 8.3725 127.7862 60.9018 37.8579 176.1362 97 V 4.1797 8.2892 118.3406 61.4645 32.7954 175.4061 98 G 4.1673 7.6766 106.7876 46.1073 0.0000 172.0933 99 K 5.2870 8.4232 117.3462 55.9307 35.3700 175.7854 100 V 4.8724 9.2742 115.4780 59.6840 36.0220 175.4681 101 T 4.2830 9.0785 113.5991 60.9450 70.0226 175.9240 102 R 3.8314 8.5591 122.6761 59.4981 29.9170 178.8440 103 K 3.9916 7.9669 119.1992 59.3745 32.3004 178.6965 104 Q 4.8582 8.0972 119.8586 58.7478 28.6851 178.5550 105 I 3.6943 7.9876 121.0471 64.4527 37.1089 178.0759 106 E 3.9355 8.0132 119.5846 59.4049 29.5089 178.7204 107 E 4.0027 8.0689 118.5496 59.3941 29.4643 179.5796 108 I 3.7170 7.8136 119.6578 64.3101 37.3778 178.1454 109 A 4.1101 8.0654 121.5976 55.2138 17.8928 179.9221 110 K 3.9667 7.9892 116.0989 59.7850 32.2073 179.4762 111 T 4.0415 7.5841 114.9183 66.5587 68.7760 176.3341 112 K 4.2615 8.5595 118.5031 56.8930 32.2034 178.3388 113 M 3.9335 7.7217 120.2975 58.4971 31.8697 176.1687 114 P 4.2053 0.0000 0.0000 65.8177 31.2194 176.9967 115 D 4.6104 8.0063 115.9652 53.7766 41.5658 176.5279 116 L 4.4520 7.3655 120.3144 53.9709 42.7225 176.1903 117 N 4.7196 8.5061 117.6541 52.5081 37.7408 175.1749 118 A 4.2037 7.7274 121.4289 52.8324 18.9508 177.5587 119 N 4.9206 8.5593 115.7967 53.2003 40.1095 175.8467 120 S 4.6764 7.5259 113.0442 55.4621 67.3109 174.2050 121 L 3.8444 8.6614 125.3020 58.5248 41.4861 179.0290 122 E 3.8847 8.1297 117.3898 59.3288 29.8075 178.2790 123 A 4.1068 7.7489 120.4661 54.9202 18.3676 179.2859 124 A 3.9283 8.6687 119.7515 55.8815 18.5332 179.8826 125 M 4.0025 8.3390 117.1412 58.3985 31.7404 179.1104 126 K 4.1239 7.8437 118.3407 58.8009 31.8558 179.5950 127 I 3.7875 7.8412 120.8273 64.3043 37.0917 178.3025 128 I 3.7139 7.6597 120.0790 64.4802 37.0534 177.6597 129 E 4.0400 8.2707 120.2322 59.5378 29.0620 179.1642 130 G 3.6817 7.5267 104.4895 48.0425 0.0000 175.6094 131 T 4.0142 7.5963 117.5563 66.4147 68.5753 176.4755 132 A 3.9793 8.3317 123.0775 55.5040 18.1262 179.8632 133 K 4.0855 8.4213 116.0042 58.7660 32.2068 178.7909 134 S 4.5986 8.0161 113.0813 58.8609 63.6696 174.0747 135 M 4.7461 7.2089 120.0723 54.9625 31.8494 175.3757 136 G 4.0928 8.3342 105.0127 47.8855 0.0000 173.5867 137 I 4.8908 7.6206 119.9490 59.1449 39.3678 176.0063 138 E 4.4131 9.1274 127.2032 55.7413 31.2145 175.5556 139 V 4.8483 8.2012 121.9728 61.4230 33.7631 175.6294 140 V 4.0891 8.8502 126.6987 63.2788 31.3642 174.3728 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 71 K 8.31 4.29 0.00 1.74 1.82 0.00 1.70 0.00 0.00 1.70 0.00 0.00 2.94 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.34 1.46 7.81 72 T 8.14 4.05 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 1.31 0.00 0.00 73 P 0.00 4.30 0.00 2.30 1.71 0.00 3.74 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 2.17 2.06 0.00 74 P 0.00 4.47 0.00 2.25 2.00 0.00 3.55 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.13 0.00 75 A 8.53 4.05 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 76 S 8.17 4.15 0.00 4.09 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 0.00 77 F 8.12 4.09 0.00 3.16 3.33 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 78 L 8.22 3.90 0.00 1.93 1.73 0.98 0.61 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 79 L 8.38 3.92 0.00 1.85 1.69 0.98 1.01 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 80 K 8.23 3.78 0.00 1.85 1.73 0.00 1.69 0.00 0.00 1.65 0.00 0.00 3.09 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.43 1.48 7.81 81 K 7.67 3.73 0.00 1.65 1.67 0.00 1.58 0.00 0.00 1.57 0.00 0.00 2.99 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.23 0.90 7.81 82 A 7.74 3.93 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 83 A 8.09 4.28 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 84 G 7.83 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 0.00 0.00 0.00 85 I 7.58 4.53 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 1.46 0.73 0.94 0.00 0.00 86 E 8.55 4.59 0.00 2.06 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 0.00 2.16 2.29 0.00 87 K 7.64 4.61 0.00 1.70 1.69 0.00 1.74 0.00 0.00 1.71 0.00 0.00 3.01 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.34 1.42 7.81 88 G 8.37 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 0.00 0.00 0.00 89 S 8.27 4.26 0.00 3.90 3.89 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 90 S 8.49 4.46 0.00 4.02 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 91 E 8.16 4.63 0.00 1.99 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 2.22 2.26 0.00 92 P 0.00 4.44 0.00 2.03 2.00 0.00 3.75 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.12 0.00 93 K 8.91 4.48 0.00 1.91 2.01 0.00 1.63 0.00 0.00 1.81 0.00 0.00 3.09 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.31 1.50 7.81 94 R 7.77 4.05 0.00 1.95 1.98 0.00 3.20 0.00 0.00 3.22 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.61 0.00 95 K 8.12 4.39 0.00 1.64 1.64 0.00 1.80 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.34 1.53 7.81 96 I 8.37 4.32 1.87 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 1.41 0.95 1.00 0.00 0.00 97 V 8.29 4.18 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 0.64 0.00 0.00 1.00 0.00 0.00 98 G 7.68 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 0.00 0.00 0.00 0.00 99 K 8.42 5.29 0.00 1.77 1.73 0.00 1.51 0.00 0.00 1.70 0.00 0.00 2.74 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.30 1.46 7.81 100 V 9.27 4.87 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 0.74 0.00 0.00 0.97 0.00 0.00 101 T 9.08 4.28 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 1.20 0.00 0.00 102 R 8.56 3.83 0.00 1.94 1.98 0.00 3.22 0.00 0.00 3.26 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.76 0.00 103 K 7.97 3.99 0.00 1.90 1.78 0.00 1.66 0.00 0.00 1.81 0.00 0.00 3.04 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.50 1.58 7.81 104 Q 8.10 4.86 0.00 2.38 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.53 0.00 0.00 0.00 0.00 0.00 2.48 2.25 0.00 105 I 7.99 3.69 2.05 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 1.53 1.19 0.91 0.00 0.00 106 E 8.01 3.94 0.00 2.07 2.18 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 2.31 2.35 0.00 107 E 8.07 4.00 0.00 2.23 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 2.33 2.46 0.00 108 I 7.81 3.72 2.01 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.70 0.93 0.00 0.00 109 A 8.07 4.11 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 0.00 110 K 7.99 3.97 0.00 1.93 1.89 0.00 1.72 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.48 1.75 7.81 111 T 7.58 4.04 4.40 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 1.24 0.00 0.00 112 K 8.56 4.26 0.00 1.85 1.85 0.00 1.75 0.00 0.00 1.59 0.00 0.00 3.02 0.00 0.00 3.37 0.00 0.00 0.00 0.00 1.47 1.61 7.81 113 M 7.72 3.93 0.00 2.17 2.29 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.63 0.00 114 P 0.00 4.21 0.00 2.26 2.19 0.00 3.84 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 2.00 2.08 0.00 115 D 8.01 4.61 0.00 2.76 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 0.00 116 L 7.37 4.45 0.00 1.80 1.59 0.99 1.30 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 0.00 117 N 8.51 4.72 0.00 2.82 2.90 0.00 0.00 6.05 7.26 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 0.00 118 A 7.73 4.20 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 0.00 119 N 8.56 4.92 0.00 2.70 2.84 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 0.00 120 S 7.53 4.68 0.00 3.98 3.89 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 0.00 121 L 8.66 3.84 0.00 1.77 1.73 0.92 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 122 E 8.13 3.88 0.00 2.00 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 0.00 2.29 2.38 0.00 123 A 7.75 4.11 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 0.00 124 A 8.67 3.93 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 0.00 125 M 8.34 4.00 0.00 2.06 2.26 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.83 2.59 0.00 126 K 7.84 4.12 0.00 1.98 1.86 0.00 1.66 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.46 1.62 7.81 127 I 7.84 3.79 2.13 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 1.52 1.00 0.92 0.00 0.00 128 I 7.66 3.71 1.87 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 1.71 0.89 0.92 0.00 0.00 129 E 8.27 4.04 0.00 2.27 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 0.00 2.31 2.35 0.00 130 G 7.53 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 0.00 131 T 7.60 4.01 4.41 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 1.24 0.00 0.00 132 A 8.33 3.98 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 0.00 133 K 8.42 4.09 0.00 1.84 1.89 0.00 1.70 0.00 0.00 1.78 0.00 0.00 3.10 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.57 7.81 134 S 8.02 4.60 0.00 4.01 4.10 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 0.00 0.00 0.00 0.00 135 M 7.21 4.75 0.00 2.16 2.24 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.68 0.00 136 G 8.33 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 0.00 137 I 7.62 4.89 1.99 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 1.21 0.87 0.90 0.00 0.00 138 E 9.13 4.41 0.00 1.91 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 2.30 2.25 0.00 139 V 8.20 4.85 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 0.79 0.00 0.00 0.93 0.00 0.00 140 V 8.85 4.09 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 0.75 0.00 0.00 0.93 0.00 0.00